USER MOD reduce.3.24.130724 H: found=0, std=0, add=1155, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1149 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 116 ASN : amide:sc= 0.832 K(o=0.72,f=-2.6) USER MOD Set 1.2: A 117 GLN : amide:sc= -0.117 K(o=0.72,f=-0.14) USER MOD Set 2.1: A 40 THR OG1 : rot 160:sc= 0 USER MOD Set 2.2: A 76 LYS NZ :NH3+ -156:sc= 0.765 (180deg=-1.22) USER MOD Set 2.3: A 106 HIS : no HE2:sc= 0.909 K(o=1.7,f=-19!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -154:sc= 0.202 (180deg=-0.0557) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 3 SER OG : rot 180:sc= -0.306 USER MOD Single : A 4 HIS : no HE2:sc= 1.1 K(o=1.1,f=-3.3!) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= -0.551! C(o=-0.55!,f=-3.4!) USER MOD Single : A 12 THR OG1 : rot 34:sc= 0.483 USER MOD Single : A 14 GLN : amide:sc= 1.09 K(o=1.1,f=-2.7!) USER MOD Single : A 16 GLN : amide:sc= 0.57 K(o=0.57,f=-0.39) USER MOD Single : A 18 SER OG : rot 180:sc= 0.0231 USER MOD Single : A 20 HIS : no HE2:sc= 0.934 K(o=0.93,f=-2.9!) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ 146:sc= 0.876 (180deg=-3.05!) USER MOD Single : A 24 MET CE :methyl 169:sc=-0.00298 (180deg=-0.167) USER MOD Single : A 27 LYS NZ :NH3+ 173:sc= 1.39 (180deg=1.35) USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 39 HIS : no HE2:sc= 0.969 K(o=0.97,f=-3.2!) USER MOD Single : A 41 SER OG : rot -168:sc= 1.04 USER MOD Single : A 44 LYS NZ :NH3+ -136:sc= -0.084 (180deg=-0.948) USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 TYR OH : rot 165:sc= 0 USER MOD Single : A 56 THR OG1 : rot 38:sc= 0.46 USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ -174:sc= 1.83 (180deg=1.52) USER MOD Single : A 68 THR OG1 : rot 38:sc= 0.328 USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 13:sc= 1.14 USER MOD Single : A 77 GLN :FLIP amide:sc= -0.482 F(o=-4!,f=-0.48) USER MOD Single : A 79 ASN : amide:sc= 0.714 K(o=0.71,f=-3!) USER MOD Single : A 81 LYS NZ :NH3+ 168:sc= 1.12 (180deg=0.551) USER MOD Single : A 84 HIS : no HE2:sc= -0.739 K(o=-0.74,f=-5.9!) USER MOD Single : A 86 LYS NZ :NH3+ -131:sc= -0.546! (180deg=-1.83!) USER MOD Single : A 87 SER OG : rot 180:sc= -0.243 USER MOD Single : A 91 ASN : amide:sc= -1.69 K(o=-1.7,f=-2.5) USER MOD Single : A 100 LYS NZ :NH3+ -120:sc= 1.2 (180deg=0.0759) USER MOD Single : A 104 LYS NZ :NH3+ 175:sc= -2.14! (180deg=-2.24!) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 7:sc= 0.467 USER MOD Single : A 115 TYR OH : rot 60:sc= -0.323 USER MOD Single : A 120 LYS NZ :NH3+ 156:sc= 1.17 (180deg=0.687) USER MOD Single : A 122 SER OG : rot 148:sc= 1.22 USER MOD Single : A 123 TYR OH : rot 180:sc= 0 USER MOD Single : A 124 SER OG : rot 51:sc= 1.24 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 GLN : amide:sc= 0.198 X(o=0.2,f=-0.27) USER MOD Single : A 138 SER OG : rot 8:sc= 0.718 USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 THR OG1 : rot 180:sc= 0.117 USER MOD Single : A 145 ASN : amide:sc= 0.955 K(o=0.96,f=-0.09) USER MOD Single : A 149 HIS : no HE2:sc= 0.358 K(o=0.36,f=-5.4!) USER MOD Single : A 155 LYS NZ :NH3+ 163:sc= 1.06 (180deg=0.88) USER MOD Single : A 156 GLN : amide:sc= -3.15! C(o=-3.2!,f=-3.1!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 17.986 -0.749 -18.791 1.00 55.68 N ATOM 2 CA MET A 1 17.863 0.049 -20.022 1.00 56.03 C ATOM 3 C MET A 1 16.443 -0.140 -20.544 1.00 54.56 C ATOM 4 O MET A 1 15.585 -0.513 -19.747 1.00 53.91 O ATOM 5 CB MET A 1 18.948 -0.322 -21.049 1.00 56.84 C ATOM 6 CG MET A 1 20.357 -0.346 -20.440 1.00 57.82 C ATOM 7 SD MET A 1 20.730 1.033 -19.329 1.00 59.28 S ATOM 8 CE MET A 1 22.412 0.610 -18.826 1.00 60.17 C ATOM 0 H1 MET A 1 18.721 -0.337 -18.182 1.00 55.68 H new ATOM 0 H2 MET A 1 17.077 -0.749 -18.285 1.00 55.68 H new ATOM 0 H3 MET A 1 18.246 -1.726 -19.035 1.00 55.68 H new ATOM 0 HA MET A 1 18.030 1.107 -19.820 1.00 56.03 H new ATOM 0 HB2 MET A 1 18.723 -1.301 -21.472 1.00 56.84 H new ATOM 0 HB3 MET A 1 18.924 0.393 -21.871 1.00 56.84 H new ATOM 0 HG2 MET A 1 20.484 -1.280 -19.892 1.00 57.82 H new ATOM 0 HG3 MET A 1 21.087 -0.349 -21.249 1.00 57.82 H new ATOM 0 HE1 MET A 1 22.787 1.367 -18.137 1.00 60.17 H new ATOM 0 HE2 MET A 1 22.411 -0.362 -18.332 1.00 60.17 H new ATOM 0 HE3 MET A 1 23.055 0.570 -19.705 1.00 60.17 H new ATOM 20 N GLN A 2 16.198 0.096 -21.835 1.00 54.11 N ATOM 21 CA GLN A 2 14.922 -0.221 -22.456 1.00 52.67 C ATOM 22 C GLN A 2 14.751 -1.741 -22.428 1.00 50.98 C ATOM 23 O GLN A 2 15.360 -2.453 -23.226 1.00 51.13 O ATOM 24 CB GLN A 2 14.892 0.328 -23.890 1.00 53.09 C ATOM 25 CG GLN A 2 14.951 1.862 -23.904 1.00 53.93 C ATOM 26 CD GLN A 2 14.985 2.407 -25.327 1.00 54.68 C ATOM 27 OE1 GLN A 2 15.988 2.960 -25.761 1.00 55.70 O ATOM 28 NE2 GLN A 2 13.890 2.257 -26.069 1.00 54.27 N ATOM 0 H GLN A 2 16.879 0.510 -22.472 1.00 54.11 H new ATOM 0 HA GLN A 2 14.096 0.242 -21.916 1.00 52.67 H new ATOM 0 HB2 GLN A 2 15.734 -0.075 -24.453 1.00 53.09 H new ATOM 0 HB3 GLN A 2 13.984 -0.007 -24.391 1.00 53.09 H new ATOM 0 HG2 GLN A 2 14.085 2.265 -23.380 1.00 53.93 H new ATOM 0 HG3 GLN A 2 15.836 2.198 -23.363 1.00 53.93 H new ATOM 0 HE21 GLN A 2 13.070 1.792 -25.680 1.00 54.27 H new ATOM 0 HE22 GLN A 2 13.871 2.607 -27.027 1.00 54.27 H new ATOM 37 N SER A 3 13.999 -2.253 -21.455 1.00 49.49 N ATOM 38 CA SER A 3 13.848 -3.681 -21.226 1.00 47.85 C ATOM 39 C SER A 3 12.529 -3.901 -20.488 1.00 46.31 C ATOM 40 O SER A 3 12.300 -3.256 -19.466 1.00 46.67 O ATOM 41 CB SER A 3 15.038 -4.192 -20.400 1.00 48.05 C ATOM 42 OG SER A 3 16.270 -3.714 -20.921 1.00 49.25 O ATOM 0 H SER A 3 13.473 -1.677 -20.798 1.00 49.49 H new ATOM 0 HA SER A 3 13.832 -4.232 -22.167 1.00 47.85 H new ATOM 0 HB2 SER A 3 14.929 -3.871 -19.364 1.00 48.05 H new ATOM 0 HB3 SER A 3 15.040 -5.282 -20.397 1.00 48.05 H new ATOM 0 HG SER A 3 17.010 -4.053 -20.375 1.00 49.25 H new ATOM 48 N HIS A 4 11.662 -4.774 -21.007 1.00 44.70 N ATOM 49 CA HIS A 4 10.363 -5.116 -20.441 1.00 43.07 C ATOM 50 C HIS A 4 9.954 -6.469 -21.026 1.00 41.41 C ATOM 51 O HIS A 4 10.608 -6.962 -21.944 1.00 41.76 O ATOM 52 CB HIS A 4 9.319 -4.029 -20.768 1.00 43.41 C ATOM 53 CG HIS A 4 8.911 -3.199 -19.576 1.00 43.96 C ATOM 54 ND1 HIS A 4 9.762 -2.548 -18.714 1.00 45.12 N ATOM 55 CD2 HIS A 4 7.631 -2.970 -19.141 1.00 43.49 C ATOM 56 CE1 HIS A 4 9.011 -1.938 -17.781 1.00 45.37 C ATOM 57 NE2 HIS A 4 7.706 -2.168 -17.998 1.00 44.41 N ATOM 0 H HIS A 4 11.858 -5.281 -21.870 1.00 44.70 H new ATOM 0 HA HIS A 4 10.422 -5.177 -19.354 1.00 43.07 H new ATOM 0 HB2 HIS A 4 9.723 -3.370 -21.537 1.00 43.41 H new ATOM 0 HB3 HIS A 4 8.433 -4.504 -21.189 1.00 43.41 H new ATOM 0 HD1 HIS A 4 10.780 -2.531 -18.772 1.00 45.12 H new ATOM 0 HD2 HIS A 4 6.727 -3.342 -19.599 1.00 43.49 H new ATOM 0 HE1 HIS A 4 9.403 -1.344 -16.968 1.00 45.37 H new ATOM 65 N SER A 5 8.889 -7.065 -20.489 1.00 39.72 N ATOM 66 CA SER A 5 8.307 -8.318 -20.944 1.00 38.04 C ATOM 67 C SER A 5 6.934 -8.442 -20.279 1.00 36.45 C ATOM 68 O SER A 5 6.557 -7.560 -19.504 1.00 36.68 O ATOM 69 CB SER A 5 9.240 -9.489 -20.596 1.00 37.82 C ATOM 70 OG SER A 5 9.600 -9.446 -19.230 1.00 37.82 O ATOM 0 H SER A 5 8.391 -6.668 -19.692 1.00 39.72 H new ATOM 0 HA SER A 5 8.185 -8.339 -22.027 1.00 38.04 H new ATOM 0 HB2 SER A 5 8.745 -10.434 -20.818 1.00 37.82 H new ATOM 0 HB3 SER A 5 10.136 -9.445 -21.216 1.00 37.82 H new ATOM 0 HG SER A 5 10.193 -10.199 -19.024 1.00 37.82 H new ATOM 76 N ALA A 6 6.191 -9.511 -20.573 1.00 34.98 N ATOM 77 CA ALA A 6 4.914 -9.820 -19.952 1.00 33.36 C ATOM 78 C ALA A 6 4.752 -11.338 -19.962 1.00 31.70 C ATOM 79 O ALA A 6 5.471 -12.021 -20.690 1.00 31.93 O ATOM 80 CB ALA A 6 3.779 -9.134 -20.719 1.00 33.56 C ATOM 0 H ALA A 6 6.474 -10.200 -21.269 1.00 34.98 H new ATOM 0 HA ALA A 6 4.879 -9.453 -18.926 1.00 33.36 H new ATOM 0 HB1 ALA A 6 2.826 -9.371 -20.247 1.00 33.56 H new ATOM 0 HB2 ALA A 6 3.932 -8.055 -20.707 1.00 33.56 H new ATOM 0 HB3 ALA A 6 3.771 -9.487 -21.750 1.00 33.56 H new ATOM 86 N LEU A 7 3.828 -11.860 -19.153 1.00 30.17 N ATOM 87 CA LEU A 7 3.555 -13.270 -18.987 1.00 28.58 C ATOM 88 C LEU A 7 2.055 -13.359 -18.704 1.00 27.11 C ATOM 89 O LEU A 7 1.535 -12.524 -17.966 1.00 27.30 O ATOM 90 CB LEU A 7 4.411 -13.772 -17.813 1.00 28.47 C ATOM 91 CG LEU A 7 3.961 -15.117 -17.236 1.00 27.49 C ATOM 92 CD1 LEU A 7 4.112 -16.260 -18.245 1.00 27.05 C ATOM 93 CD2 LEU A 7 4.779 -15.439 -15.981 1.00 27.79 C ATOM 0 H LEU A 7 3.227 -11.275 -18.573 1.00 30.17 H new ATOM 0 HA LEU A 7 3.800 -13.884 -19.854 1.00 28.58 H new ATOM 0 HB2 LEU A 7 5.446 -13.860 -18.144 1.00 28.47 H new ATOM 0 HB3 LEU A 7 4.393 -13.025 -17.020 1.00 28.47 H new ATOM 0 HG LEU A 7 2.903 -15.028 -16.989 1.00 27.49 H new ATOM 0 HD11 LEU A 7 3.780 -17.193 -17.790 1.00 27.05 H new ATOM 0 HD12 LEU A 7 3.505 -16.050 -19.126 1.00 27.05 H new ATOM 0 HD13 LEU A 7 5.158 -16.351 -18.538 1.00 27.05 H new ATOM 0 HD21 LEU A 7 4.457 -16.397 -15.572 1.00 27.79 H new ATOM 0 HD22 LEU A 7 5.837 -15.492 -16.240 1.00 27.79 H new ATOM 0 HD23 LEU A 7 4.627 -14.657 -15.237 1.00 27.79 H new ATOM 105 N THR A 8 1.363 -14.332 -19.303 1.00 25.82 N ATOM 106 CA THR A 8 -0.040 -14.600 -19.016 1.00 24.35 C ATOM 107 C THR A 8 -0.123 -15.521 -17.794 1.00 22.85 C ATOM 108 O THR A 8 0.713 -16.412 -17.637 1.00 22.88 O ATOM 109 CB THR A 8 -0.732 -15.164 -20.266 1.00 24.24 C ATOM 110 OG1 THR A 8 -2.131 -15.210 -20.087 1.00 23.23 O ATOM 111 CG2 THR A 8 -0.246 -16.562 -20.665 1.00 24.06 C ATOM 0 H THR A 8 1.766 -14.956 -20.002 1.00 25.82 H new ATOM 0 HA THR A 8 -0.575 -13.684 -18.767 1.00 24.35 H new ATOM 0 HB THR A 8 -0.467 -14.480 -21.072 1.00 24.24 H new ATOM 0 HG1 THR A 8 -2.552 -15.570 -20.895 1.00 23.23 H new ATOM 0 HG21 THR A 8 -0.780 -16.893 -21.556 1.00 24.06 H new ATOM 0 HG22 THR A 8 0.823 -16.529 -20.875 1.00 24.06 H new ATOM 0 HG23 THR A 8 -0.435 -17.259 -19.849 1.00 24.06 H new ATOM 119 N ALA A 9 -1.093 -15.280 -16.910 1.00 21.72 N ATOM 120 CA ALA A 9 -1.306 -16.102 -15.729 1.00 20.28 C ATOM 121 C ALA A 9 -2.058 -17.385 -16.096 1.00 18.84 C ATOM 122 O ALA A 9 -2.465 -17.575 -17.242 1.00 19.22 O ATOM 123 CB ALA A 9 -2.072 -15.290 -14.682 1.00 20.17 C ATOM 0 H ALA A 9 -1.752 -14.506 -16.998 1.00 21.72 H new ATOM 0 HA ALA A 9 -0.343 -16.396 -15.310 1.00 20.28 H new ATOM 0 HB1 ALA A 9 -2.234 -15.902 -13.795 1.00 20.17 H new ATOM 0 HB2 ALA A 9 -1.494 -14.406 -14.413 1.00 20.17 H new ATOM 0 HB3 ALA A 9 -3.034 -14.983 -15.092 1.00 20.17 H new ATOM 129 N PHE A 10 -2.206 -18.276 -15.116 1.00 17.44 N ATOM 130 CA PHE A 10 -3.022 -19.474 -15.176 1.00 16.09 C ATOM 131 C PHE A 10 -3.065 -20.045 -13.758 1.00 15.12 C ATOM 132 O PHE A 10 -2.217 -19.682 -12.940 1.00 15.58 O ATOM 133 CB PHE A 10 -2.472 -20.489 -16.190 1.00 16.32 C ATOM 134 CG PHE A 10 -1.014 -20.863 -15.996 1.00 17.18 C ATOM 135 CD1 PHE A 10 -0.664 -21.925 -15.141 1.00 17.22 C ATOM 136 CD2 PHE A 10 -0.004 -20.126 -16.644 1.00 18.25 C ATOM 137 CE1 PHE A 10 0.690 -22.245 -14.931 1.00 18.32 C ATOM 138 CE2 PHE A 10 1.349 -20.441 -16.428 1.00 19.29 C ATOM 139 CZ PHE A 10 1.696 -21.502 -15.573 1.00 19.33 C ATOM 0 H PHE A 10 -1.734 -18.171 -14.218 1.00 17.44 H new ATOM 0 HA PHE A 10 -4.028 -19.239 -15.524 1.00 16.09 H new ATOM 0 HB2 PHE A 10 -3.074 -21.396 -16.137 1.00 16.32 H new ATOM 0 HB3 PHE A 10 -2.597 -20.082 -17.193 1.00 16.32 H new ATOM 0 HD1 PHE A 10 -1.436 -22.495 -14.645 1.00 17.22 H new ATOM 0 HD2 PHE A 10 -0.269 -19.317 -17.308 1.00 18.25 H new ATOM 0 HE1 PHE A 10 0.956 -23.062 -14.276 1.00 18.32 H new ATOM 0 HE2 PHE A 10 2.122 -19.868 -16.919 1.00 19.29 H new ATOM 0 HZ PHE A 10 2.735 -21.746 -15.410 1.00 19.33 H new ATOM 149 N GLN A 11 -4.038 -20.917 -13.466 1.00 14.10 N ATOM 150 CA GLN A 11 -4.334 -21.376 -12.108 1.00 13.29 C ATOM 151 C GLN A 11 -4.861 -20.198 -11.275 1.00 12.00 C ATOM 152 O GLN A 11 -4.921 -19.065 -11.757 1.00 12.29 O ATOM 153 CB GLN A 11 -3.100 -22.050 -11.459 1.00 14.38 C ATOM 154 CG GLN A 11 -3.369 -23.461 -10.912 1.00 14.97 C ATOM 155 CD GLN A 11 -4.253 -23.452 -9.669 1.00 14.77 C ATOM 156 OE1 GLN A 11 -5.462 -23.283 -9.775 1.00 14.19 O ATOM 157 NE2 GLN A 11 -3.671 -23.585 -8.481 1.00 15.53 N ATOM 0 H GLN A 11 -4.647 -21.326 -14.175 1.00 14.10 H new ATOM 0 HA GLN A 11 -5.111 -22.140 -12.148 1.00 13.29 H new ATOM 0 HB2 GLN A 11 -2.300 -22.105 -12.197 1.00 14.38 H new ATOM 0 HB3 GLN A 11 -2.741 -21.419 -10.646 1.00 14.38 H new ATOM 0 HG2 GLN A 11 -3.845 -24.062 -11.687 1.00 14.97 H new ATOM 0 HG3 GLN A 11 -2.420 -23.941 -10.674 1.00 14.97 H new ATOM 0 HE21 GLN A 11 -2.662 -23.725 -8.420 1.00 15.53 H new ATOM 0 HE22 GLN A 11 -4.233 -23.547 -7.631 1.00 15.53 H new ATOM 166 N THR A 12 -5.247 -20.459 -10.021 1.00 10.90 N ATOM 167 CA THR A 12 -5.819 -19.463 -9.122 1.00 9.70 C ATOM 168 C THR A 12 -7.062 -18.829 -9.765 1.00 8.49 C ATOM 169 O THR A 12 -7.602 -19.382 -10.722 1.00 8.75 O ATOM 170 CB THR A 12 -4.727 -18.494 -8.597 1.00 10.72 C ATOM 171 OG1 THR A 12 -3.763 -18.126 -9.566 1.00 11.59 O ATOM 172 CG2 THR A 12 -3.966 -19.156 -7.445 1.00 11.45 C ATOM 0 H THR A 12 -5.167 -21.385 -9.600 1.00 10.90 H new ATOM 0 HA THR A 12 -6.195 -19.927 -8.210 1.00 9.70 H new ATOM 0 HB THR A 12 -5.262 -17.595 -8.292 1.00 10.72 H new ATOM 0 HG1 THR A 12 -4.189 -18.072 -10.447 1.00 11.59 H new ATOM 0 HG21 THR A 12 -3.199 -18.475 -7.077 1.00 11.45 H new ATOM 0 HG22 THR A 12 -4.660 -19.391 -6.638 1.00 11.45 H new ATOM 0 HG23 THR A 12 -3.496 -20.074 -7.799 1.00 11.45 H new ATOM 180 N GLU A 13 -7.570 -17.733 -9.208 1.00 7.48 N ATOM 181 CA GLU A 13 -8.856 -17.136 -9.526 1.00 6.42 C ATOM 182 C GLU A 13 -8.868 -16.492 -10.921 1.00 7.56 C ATOM 183 O GLU A 13 -8.930 -15.269 -11.060 1.00 8.00 O ATOM 184 CB GLU A 13 -9.245 -16.158 -8.410 1.00 5.27 C ATOM 185 CG GLU A 13 -9.314 -16.828 -7.024 1.00 4.35 C ATOM 186 CD GLU A 13 -7.995 -16.822 -6.254 1.00 5.44 C ATOM 187 OE1 GLU A 13 -7.911 -16.068 -5.265 1.00 5.90 O ATOM 188 OE2 GLU A 13 -7.092 -17.599 -6.627 1.00 6.39 O ATOM 0 H GLU A 13 -7.068 -17.214 -8.487 1.00 7.48 H new ATOM 0 HA GLU A 13 -9.612 -17.919 -9.573 1.00 6.42 H new ATOM 0 HB2 GLU A 13 -8.521 -15.343 -8.379 1.00 5.27 H new ATOM 0 HB3 GLU A 13 -10.213 -15.715 -8.643 1.00 5.27 H new ATOM 0 HG2 GLU A 13 -10.072 -16.321 -6.426 1.00 4.35 H new ATOM 0 HG3 GLU A 13 -9.643 -17.860 -7.149 1.00 4.35 H new ATOM 195 N GLN A 14 -8.836 -17.342 -11.950 1.00 8.38 N ATOM 196 CA GLN A 14 -8.983 -16.986 -13.350 1.00 9.78 C ATOM 197 C GLN A 14 -10.396 -16.484 -13.650 1.00 9.92 C ATOM 198 O GLN A 14 -11.273 -16.508 -12.788 1.00 9.29 O ATOM 199 CB GLN A 14 -8.665 -18.221 -14.204 1.00 10.57 C ATOM 200 CG GLN A 14 -7.202 -18.657 -14.048 1.00 11.72 C ATOM 201 CD GLN A 14 -6.708 -19.449 -15.252 1.00 12.92 C ATOM 202 OE1 GLN A 14 -6.303 -20.604 -15.127 1.00 13.52 O ATOM 203 NE2 GLN A 14 -6.733 -18.839 -16.429 1.00 13.60 N ATOM 0 H GLN A 14 -8.700 -18.344 -11.815 1.00 8.38 H new ATOM 0 HA GLN A 14 -8.293 -16.177 -13.587 1.00 9.78 H new ATOM 0 HB2 GLN A 14 -9.322 -19.042 -13.916 1.00 10.57 H new ATOM 0 HB3 GLN A 14 -8.870 -18.001 -15.252 1.00 10.57 H new ATOM 0 HG2 GLN A 14 -6.574 -17.776 -13.912 1.00 11.72 H new ATOM 0 HG3 GLN A 14 -7.099 -19.264 -13.148 1.00 11.72 H new ATOM 0 HE21 GLN A 14 -7.075 -17.881 -16.500 1.00 13.60 H new ATOM 0 HE22 GLN A 14 -6.411 -19.328 -17.264 1.00 13.60 H new ATOM 212 N ILE A 15 -10.625 -16.065 -14.898 1.00 11.18 N ATOM 213 CA ILE A 15 -11.939 -15.713 -15.425 1.00 11.91 C ATOM 214 C ILE A 15 -12.112 -16.448 -16.758 1.00 12.55 C ATOM 215 O ILE A 15 -11.121 -16.759 -17.414 1.00 13.04 O ATOM 216 CB ILE A 15 -12.062 -14.176 -15.548 1.00 12.96 C ATOM 217 CG1 ILE A 15 -11.982 -13.558 -14.138 1.00 12.68 C ATOM 218 CG2 ILE A 15 -13.366 -13.759 -16.248 1.00 14.07 C ATOM 219 CD1 ILE A 15 -12.190 -12.041 -14.102 1.00 14.12 C ATOM 0 H ILE A 15 -9.879 -15.960 -15.585 1.00 11.18 H new ATOM 0 HA ILE A 15 -12.743 -16.022 -14.757 1.00 11.91 H new ATOM 0 HB ILE A 15 -11.242 -13.808 -16.165 1.00 12.96 H new ATOM 0 HG12 ILE A 15 -12.732 -14.031 -13.504 1.00 12.68 H new ATOM 0 HG13 ILE A 15 -11.008 -13.790 -13.707 1.00 12.68 H new ATOM 0 HG21 ILE A 15 -13.412 -12.672 -16.314 1.00 14.07 H new ATOM 0 HG22 ILE A 15 -13.393 -14.185 -17.251 1.00 14.07 H new ATOM 0 HG23 ILE A 15 -14.219 -14.125 -15.676 1.00 14.07 H new ATOM 0 HD11 ILE A 15 -12.118 -11.688 -13.073 1.00 14.12 H new ATOM 0 HD12 ILE A 15 -11.425 -11.554 -14.707 1.00 14.12 H new ATOM 0 HD13 ILE A 15 -13.175 -11.799 -14.500 1.00 14.12 H new ATOM 231 N GLN A 16 -13.365 -16.726 -17.141 1.00 12.87 N ATOM 232 CA GLN A 16 -13.754 -17.362 -18.398 1.00 13.75 C ATOM 233 C GLN A 16 -13.444 -18.867 -18.352 1.00 13.02 C ATOM 234 O GLN A 16 -12.296 -19.265 -18.535 1.00 13.18 O ATOM 235 CB GLN A 16 -13.108 -16.645 -19.605 1.00 15.54 C ATOM 236 CG GLN A 16 -14.030 -16.575 -20.832 1.00 16.78 C ATOM 237 CD GLN A 16 -14.668 -17.912 -21.191 1.00 17.01 C ATOM 238 OE1 GLN A 16 -15.888 -18.008 -21.261 1.00 17.59 O ATOM 239 NE2 GLN A 16 -13.858 -18.944 -21.383 1.00 16.83 N ATOM 0 H GLN A 16 -14.168 -16.502 -16.554 1.00 12.87 H new ATOM 0 HA GLN A 16 -14.832 -17.265 -18.531 1.00 13.75 H new ATOM 0 HB2 GLN A 16 -12.828 -15.633 -19.311 1.00 15.54 H new ATOM 0 HB3 GLN A 16 -12.189 -17.164 -19.878 1.00 15.54 H new ATOM 0 HG2 GLN A 16 -14.817 -15.845 -20.644 1.00 16.78 H new ATOM 0 HG3 GLN A 16 -13.458 -16.214 -21.686 1.00 16.78 H new ATOM 0 HE21 GLN A 16 -12.848 -18.819 -21.315 1.00 16.83 H new ATOM 0 HE22 GLN A 16 -14.245 -19.863 -21.599 1.00 16.83 H new ATOM 248 N ASP A 17 -14.470 -19.689 -18.091 1.00 12.58 N ATOM 249 CA ASP A 17 -14.413 -21.147 -17.943 1.00 12.15 C ATOM 250 C ASP A 17 -13.543 -21.561 -16.757 1.00 10.87 C ATOM 251 O ASP A 17 -14.064 -22.034 -15.746 1.00 9.93 O ATOM 252 CB ASP A 17 -13.991 -21.865 -19.235 1.00 13.56 C ATOM 253 CG ASP A 17 -15.112 -21.920 -20.260 1.00 14.36 C ATOM 254 OD1 ASP A 17 -14.877 -21.421 -21.383 1.00 15.40 O ATOM 255 OD2 ASP A 17 -16.180 -22.460 -19.902 1.00 14.16 O ATOM 0 H ASP A 17 -15.417 -19.331 -17.971 1.00 12.58 H new ATOM 0 HA ASP A 17 -15.432 -21.471 -17.734 1.00 12.15 H new ATOM 0 HB2 ASP A 17 -13.131 -21.353 -19.668 1.00 13.56 H new ATOM 0 HB3 ASP A 17 -13.671 -22.879 -18.996 1.00 13.56 H new ATOM 260 N SER A 18 -12.232 -21.343 -16.868 1.00 11.18 N ATOM 261 CA SER A 18 -11.236 -21.508 -15.820 1.00 10.48 C ATOM 262 C SER A 18 -11.723 -20.955 -14.478 1.00 8.92 C ATOM 263 O SER A 18 -11.418 -21.533 -13.436 1.00 8.26 O ATOM 264 CB SER A 18 -9.955 -20.803 -16.271 1.00 11.63 C ATOM 265 OG SER A 18 -9.603 -21.254 -17.564 1.00 12.74 O ATOM 0 H SER A 18 -11.817 -21.028 -17.745 1.00 11.18 H new ATOM 0 HA SER A 18 -11.048 -22.570 -15.663 1.00 10.48 H new ATOM 0 HB2 SER A 18 -10.104 -19.723 -16.278 1.00 11.63 H new ATOM 0 HB3 SER A 18 -9.147 -21.009 -15.569 1.00 11.63 H new ATOM 0 HG SER A 18 -8.784 -20.803 -17.856 1.00 12.74 H new ATOM 271 N GLU A 19 -12.503 -19.867 -14.530 1.00 8.71 N ATOM 272 CA GLU A 19 -13.292 -19.305 -13.436 1.00 7.63 C ATOM 273 C GLU A 19 -13.752 -20.395 -12.461 1.00 6.74 C ATOM 274 O GLU A 19 -13.408 -20.355 -11.283 1.00 6.00 O ATOM 275 CB GLU A 19 -14.476 -18.518 -14.036 1.00 8.42 C ATOM 276 CG GLU A 19 -14.971 -17.338 -13.178 1.00 8.87 C ATOM 277 CD GLU A 19 -15.991 -17.705 -12.102 1.00 8.83 C ATOM 278 OE1 GLU A 19 -16.176 -18.914 -11.855 1.00 8.65 O ATOM 279 OE2 GLU A 19 -16.577 -16.754 -11.539 1.00 9.53 O ATOM 0 H GLU A 19 -12.603 -19.327 -15.389 1.00 8.71 H new ATOM 0 HA GLU A 19 -12.677 -18.622 -12.851 1.00 7.63 H new ATOM 0 HB2 GLU A 19 -14.183 -18.139 -15.015 1.00 8.42 H new ATOM 0 HB3 GLU A 19 -15.307 -19.205 -14.196 1.00 8.42 H new ATOM 0 HG2 GLU A 19 -14.111 -16.872 -12.698 1.00 8.87 H new ATOM 0 HG3 GLU A 19 -15.413 -16.590 -13.836 1.00 8.87 H new ATOM 286 N HIS A 20 -14.455 -21.414 -12.970 1.00 7.33 N ATOM 287 CA HIS A 20 -15.019 -22.474 -12.143 1.00 7.35 C ATOM 288 C HIS A 20 -13.935 -23.145 -11.298 1.00 7.20 C ATOM 289 O HIS A 20 -14.120 -23.379 -10.104 1.00 7.17 O ATOM 290 CB HIS A 20 -15.720 -23.516 -13.022 1.00 8.56 C ATOM 291 CG HIS A 20 -16.833 -22.955 -13.868 1.00 9.52 C ATOM 292 ND1 HIS A 20 -16.717 -22.537 -15.173 1.00 10.49 N ATOM 293 CD2 HIS A 20 -18.144 -22.809 -13.501 1.00 10.06 C ATOM 294 CE1 HIS A 20 -17.935 -22.147 -15.585 1.00 11.52 C ATOM 295 NE2 HIS A 20 -18.840 -22.298 -14.603 1.00 11.33 N ATOM 0 H HIS A 20 -14.646 -21.522 -13.966 1.00 7.33 H new ATOM 0 HA HIS A 20 -15.750 -22.026 -11.470 1.00 7.35 H new ATOM 0 HB2 HIS A 20 -14.981 -23.982 -13.674 1.00 8.56 H new ATOM 0 HB3 HIS A 20 -16.123 -24.302 -12.384 1.00 8.56 H new ATOM 0 HD1 HIS A 20 -15.861 -22.525 -15.728 1.00 10.49 H new ATOM 0 HD2 HIS A 20 -18.565 -23.046 -12.535 1.00 10.06 H new ATOM 0 HE1 HIS A 20 -18.156 -21.765 -16.570 1.00 11.52 H new ATOM 303 N SER A 21 -12.797 -23.456 -11.926 1.00 7.76 N ATOM 304 CA SER A 21 -11.670 -24.059 -11.237 1.00 8.32 C ATOM 305 C SER A 21 -11.128 -23.066 -10.211 1.00 7.58 C ATOM 306 O SER A 21 -11.090 -23.352 -9.016 1.00 7.85 O ATOM 307 CB SER A 21 -10.595 -24.490 -12.241 1.00 9.58 C ATOM 308 OG SER A 21 -11.148 -25.413 -13.159 1.00 10.12 O ATOM 0 H SER A 21 -12.639 -23.295 -12.921 1.00 7.76 H new ATOM 0 HA SER A 21 -11.991 -24.959 -10.712 1.00 8.32 H new ATOM 0 HB2 SER A 21 -10.209 -23.620 -12.772 1.00 9.58 H new ATOM 0 HB3 SER A 21 -9.753 -24.943 -11.717 1.00 9.58 H new ATOM 0 HG SER A 21 -10.461 -25.687 -13.802 1.00 10.12 H new ATOM 314 N GLY A 22 -10.726 -21.894 -10.700 1.00 7.14 N ATOM 315 CA GLY A 22 -10.034 -20.882 -9.929 1.00 6.81 C ATOM 316 C GLY A 22 -10.792 -20.468 -8.675 1.00 5.88 C ATOM 317 O GLY A 22 -10.247 -20.487 -7.576 1.00 6.45 O ATOM 0 H GLY A 22 -10.881 -21.622 -11.671 1.00 7.14 H new ATOM 0 HA2 GLY A 22 -9.051 -21.258 -9.645 1.00 6.81 H new ATOM 0 HA3 GLY A 22 -9.871 -20.005 -10.555 1.00 6.81 H new ATOM 321 N LYS A 23 -12.052 -20.068 -8.854 1.00 5.10 N ATOM 322 CA LYS A 23 -12.885 -19.464 -7.845 1.00 5.00 C ATOM 323 C LYS A 23 -12.956 -20.315 -6.577 1.00 6.09 C ATOM 324 O LYS A 23 -12.915 -19.746 -5.490 1.00 6.85 O ATOM 325 CB LYS A 23 -14.248 -19.194 -8.495 1.00 5.23 C ATOM 326 CG LYS A 23 -15.068 -18.173 -7.718 1.00 5.92 C ATOM 327 CD LYS A 23 -16.111 -17.556 -8.659 1.00 7.18 C ATOM 328 CE LYS A 23 -17.288 -16.818 -8.006 1.00 8.62 C ATOM 329 NZ LYS A 23 -16.884 -15.859 -6.958 1.00 9.34 N ATOM 0 H LYS A 23 -12.529 -20.166 -9.750 1.00 5.10 H new ATOM 0 HA LYS A 23 -12.464 -18.521 -7.498 1.00 5.00 H new ATOM 0 HB2 LYS A 23 -14.098 -18.836 -9.514 1.00 5.23 H new ATOM 0 HB3 LYS A 23 -14.806 -20.128 -8.564 1.00 5.23 H new ATOM 0 HG2 LYS A 23 -15.560 -18.650 -6.871 1.00 5.92 H new ATOM 0 HG3 LYS A 23 -14.419 -17.397 -7.314 1.00 5.92 H new ATOM 0 HD2 LYS A 23 -15.599 -16.858 -9.321 1.00 7.18 H new ATOM 0 HD3 LYS A 23 -16.515 -18.351 -9.285 1.00 7.18 H new ATOM 0 HE2 LYS A 23 -17.844 -16.285 -8.778 1.00 8.62 H new ATOM 0 HE3 LYS A 23 -17.968 -17.551 -7.572 1.00 8.62 H new ATOM 0 HZ1 LYS A 23 -17.530 -15.044 -6.966 1.00 9.34 H new ATOM 0 HZ2 LYS A 23 -16.924 -16.323 -6.028 1.00 9.34 H new ATOM 0 HZ3 LYS A 23 -15.913 -15.533 -7.141 1.00 9.34 H new ATOM 343 N MET A 24 -13.060 -21.647 -6.729 1.00 6.68 N ATOM 344 CA MET A 24 -12.850 -22.666 -5.688 1.00 8.19 C ATOM 345 C MET A 24 -13.286 -24.069 -6.135 1.00 9.16 C ATOM 346 O MET A 24 -13.737 -24.866 -5.306 1.00 10.06 O ATOM 347 CB MET A 24 -13.507 -22.286 -4.345 1.00 8.74 C ATOM 348 CG MET A 24 -15.003 -21.980 -4.484 1.00 8.77 C ATOM 349 SD MET A 24 -15.858 -21.528 -2.956 1.00 10.35 S ATOM 350 CE MET A 24 -15.034 -19.968 -2.554 1.00 10.52 C ATOM 0 H MET A 24 -13.305 -22.062 -7.628 1.00 6.68 H new ATOM 0 HA MET A 24 -11.772 -22.698 -5.526 1.00 8.19 H new ATOM 0 HB2 MET A 24 -13.372 -23.102 -3.635 1.00 8.74 H new ATOM 0 HB3 MET A 24 -12.999 -21.415 -3.930 1.00 8.74 H new ATOM 0 HG2 MET A 24 -15.123 -21.167 -5.200 1.00 8.77 H new ATOM 0 HG3 MET A 24 -15.496 -22.854 -4.909 1.00 8.77 H new ATOM 0 HE1 MET A 24 -15.576 -19.466 -1.752 1.00 10.52 H new ATOM 0 HE2 MET A 24 -14.012 -20.169 -2.231 1.00 10.52 H new ATOM 0 HE3 MET A 24 -15.016 -19.328 -3.436 1.00 10.52 H new ATOM 360 N VAL A 25 -13.139 -24.392 -7.424 1.00 9.37 N ATOM 361 CA VAL A 25 -13.480 -25.677 -8.030 1.00 10.54 C ATOM 362 C VAL A 25 -14.986 -25.960 -8.087 1.00 11.17 C ATOM 363 O VAL A 25 -15.495 -26.317 -9.148 1.00 11.70 O ATOM 364 CB VAL A 25 -12.629 -26.819 -7.439 1.00 11.88 C ATOM 365 CG1 VAL A 25 -13.077 -28.195 -7.946 1.00 13.24 C ATOM 366 CG2 VAL A 25 -11.158 -26.614 -7.833 1.00 11.95 C ATOM 0 H VAL A 25 -12.761 -23.731 -8.103 1.00 9.37 H new ATOM 0 HA VAL A 25 -13.207 -25.614 -9.083 1.00 10.54 H new ATOM 0 HB VAL A 25 -12.755 -26.793 -6.357 1.00 11.88 H new ATOM 0 HG11 VAL A 25 -12.449 -28.968 -7.503 1.00 13.24 H new ATOM 0 HG12 VAL A 25 -14.116 -28.366 -7.664 1.00 13.24 H new ATOM 0 HG13 VAL A 25 -12.985 -28.231 -9.032 1.00 13.24 H new ATOM 0 HG21 VAL A 25 -10.554 -27.420 -7.416 1.00 11.95 H new ATOM 0 HG22 VAL A 25 -11.068 -26.618 -8.919 1.00 11.95 H new ATOM 0 HG23 VAL A 25 -10.807 -25.659 -7.443 1.00 11.95 H new ATOM 376 N ALA A 26 -15.713 -25.851 -6.971 1.00 11.60 N ATOM 377 CA ALA A 26 -17.127 -26.193 -6.916 1.00 12.69 C ATOM 378 C ALA A 26 -17.799 -25.474 -5.745 1.00 12.81 C ATOM 379 O ALA A 26 -17.180 -24.643 -5.086 1.00 12.49 O ATOM 380 CB ALA A 26 -17.267 -27.720 -6.820 1.00 13.94 C ATOM 0 H ALA A 26 -15.333 -25.523 -6.083 1.00 11.60 H new ATOM 0 HA ALA A 26 -17.633 -25.861 -7.823 1.00 12.69 H new ATOM 0 HB1 ALA A 26 -18.323 -27.987 -6.778 1.00 13.94 H new ATOM 0 HB2 ALA A 26 -16.810 -28.183 -7.695 1.00 13.94 H new ATOM 0 HB3 ALA A 26 -16.767 -28.075 -5.919 1.00 13.94 H new ATOM 386 N LYS A 27 -19.075 -25.782 -5.503 1.00 13.68 N ATOM 387 CA LYS A 27 -19.819 -25.401 -4.312 1.00 14.40 C ATOM 388 C LYS A 27 -20.326 -26.691 -3.657 1.00 15.35 C ATOM 389 O LYS A 27 -20.242 -27.768 -4.257 1.00 15.48 O ATOM 390 CB LYS A 27 -20.961 -24.434 -4.686 1.00 14.76 C ATOM 391 CG LYS A 27 -20.781 -23.015 -4.116 1.00 15.13 C ATOM 392 CD LYS A 27 -19.533 -22.291 -4.648 1.00 14.64 C ATOM 393 CE LYS A 27 -19.507 -20.831 -4.164 1.00 15.49 C ATOM 394 NZ LYS A 27 -18.264 -20.130 -4.554 1.00 15.68 N ATOM 0 H LYS A 27 -19.635 -26.325 -6.160 1.00 13.68 H new ATOM 0 HA LYS A 27 -19.190 -24.866 -3.600 1.00 14.40 H new ATOM 0 HB2 LYS A 27 -21.033 -24.373 -5.772 1.00 14.76 H new ATOM 0 HB3 LYS A 27 -21.905 -24.844 -4.326 1.00 14.76 H new ATOM 0 HG2 LYS A 27 -21.664 -22.422 -4.355 1.00 15.13 H new ATOM 0 HG3 LYS A 27 -20.721 -23.074 -3.029 1.00 15.13 H new ATOM 0 HD2 LYS A 27 -18.635 -22.808 -4.311 1.00 14.64 H new ATOM 0 HD3 LYS A 27 -19.527 -22.319 -5.738 1.00 14.64 H new ATOM 0 HE2 LYS A 27 -20.365 -20.299 -4.575 1.00 15.49 H new ATOM 0 HE3 LYS A 27 -19.608 -20.809 -3.079 1.00 15.49 H new ATOM 0 HZ1 LYS A 27 -18.343 -19.122 -4.311 1.00 15.68 H new ATOM 0 HZ2 LYS A 27 -17.457 -20.546 -4.047 1.00 15.68 H new ATOM 0 HZ3 LYS A 27 -18.117 -20.228 -5.579 1.00 15.68 H new ATOM 408 N ARG A 28 -20.833 -26.585 -2.423 1.00 16.30 N ATOM 409 CA ARG A 28 -21.138 -27.689 -1.508 1.00 17.47 C ATOM 410 C ARG A 28 -19.824 -28.219 -0.927 1.00 17.32 C ATOM 411 O ARG A 28 -19.603 -28.147 0.277 1.00 18.04 O ATOM 412 CB ARG A 28 -21.960 -28.827 -2.144 1.00 18.47 C ATOM 413 CG ARG A 28 -23.198 -28.364 -2.936 1.00 18.89 C ATOM 414 CD ARG A 28 -23.484 -29.323 -4.100 1.00 19.58 C ATOM 415 NE ARG A 28 -22.346 -29.341 -5.033 1.00 19.02 N ATOM 416 CZ ARG A 28 -22.191 -30.151 -6.088 1.00 19.32 C ATOM 417 NH1 ARG A 28 -23.188 -30.961 -6.461 1.00 20.11 N ATOM 418 NH2 ARG A 28 -21.032 -30.142 -6.757 1.00 19.07 N ATOM 0 H ARG A 28 -21.053 -25.677 -2.015 1.00 16.30 H new ATOM 0 HA ARG A 28 -21.777 -27.292 -0.719 1.00 17.47 H new ATOM 0 HB2 ARG A 28 -21.312 -29.396 -2.810 1.00 18.47 H new ATOM 0 HB3 ARG A 28 -22.283 -29.507 -1.356 1.00 18.47 H new ATOM 0 HG2 ARG A 28 -24.063 -28.318 -2.275 1.00 18.89 H new ATOM 0 HG3 ARG A 28 -23.036 -27.357 -3.319 1.00 18.89 H new ATOM 0 HD2 ARG A 28 -23.666 -30.327 -3.717 1.00 19.58 H new ATOM 0 HD3 ARG A 28 -24.388 -29.012 -4.623 1.00 19.58 H new ATOM 0 HE ARG A 28 -21.600 -28.668 -4.858 1.00 19.02 H new ATOM 0 HH11 ARG A 28 -24.066 -30.962 -5.942 1.00 20.11 H new ATOM 0 HH12 ARG A 28 -23.070 -31.578 -7.265 1.00 20.11 H new ATOM 0 HH21 ARG A 28 -20.278 -29.522 -6.462 1.00 19.07 H new ATOM 0 HH22 ARG A 28 -20.903 -30.755 -7.562 1.00 19.07 H new ATOM 432 N GLN A 29 -18.948 -28.706 -1.809 1.00 16.60 N ATOM 433 CA GLN A 29 -17.551 -28.999 -1.532 1.00 16.46 C ATOM 434 C GLN A 29 -16.739 -28.102 -2.466 1.00 15.43 C ATOM 435 O GLN A 29 -17.276 -27.611 -3.461 1.00 15.61 O ATOM 436 CB GLN A 29 -17.297 -30.495 -1.764 1.00 17.14 C ATOM 437 CG GLN A 29 -15.883 -30.932 -1.357 1.00 17.20 C ATOM 438 CD GLN A 29 -15.714 -32.443 -1.470 1.00 18.30 C ATOM 439 OE1 GLN A 29 -15.043 -32.933 -2.370 1.00 18.27 O ATOM 440 NE2 GLN A 29 -16.324 -33.198 -0.560 1.00 19.54 N ATOM 0 H GLN A 29 -19.209 -28.913 -2.773 1.00 16.60 H new ATOM 0 HA GLN A 29 -17.265 -28.797 -0.500 1.00 16.46 H new ATOM 0 HB2 GLN A 29 -18.027 -31.074 -1.199 1.00 17.14 H new ATOM 0 HB3 GLN A 29 -17.454 -30.726 -2.818 1.00 17.14 H new ATOM 0 HG2 GLN A 29 -15.150 -30.434 -1.991 1.00 17.20 H new ATOM 0 HG3 GLN A 29 -15.684 -30.618 -0.332 1.00 17.20 H new ATOM 0 HE21 GLN A 29 -16.876 -32.761 0.178 1.00 19.54 H new ATOM 0 HE22 GLN A 29 -16.239 -34.214 -0.600 1.00 19.54 H new ATOM 449 N PHE A 30 -15.477 -27.839 -2.133 1.00 14.63 N ATOM 450 CA PHE A 30 -14.657 -26.862 -2.831 1.00 13.88 C ATOM 451 C PHE A 30 -13.193 -27.117 -2.519 1.00 13.14 C ATOM 452 O PHE A 30 -12.857 -27.918 -1.646 1.00 13.60 O ATOM 453 CB PHE A 30 -15.052 -25.430 -2.430 1.00 13.85 C ATOM 454 CG PHE A 30 -15.701 -25.288 -1.067 1.00 15.02 C ATOM 455 CD1 PHE A 30 -14.903 -25.269 0.091 1.00 15.65 C ATOM 456 CD2 PHE A 30 -17.103 -25.308 -0.950 1.00 15.88 C ATOM 457 CE1 PHE A 30 -15.505 -25.287 1.361 1.00 17.03 C ATOM 458 CE2 PHE A 30 -17.705 -25.356 0.319 1.00 17.20 C ATOM 459 CZ PHE A 30 -16.905 -25.343 1.475 1.00 17.74 C ATOM 0 H PHE A 30 -14.995 -28.304 -1.364 1.00 14.63 H new ATOM 0 HA PHE A 30 -14.820 -26.965 -3.904 1.00 13.88 H new ATOM 0 HB2 PHE A 30 -14.159 -24.805 -2.454 1.00 13.85 H new ATOM 0 HB3 PHE A 30 -15.737 -25.037 -3.182 1.00 13.85 H new ATOM 0 HD1 PHE A 30 -13.827 -25.241 0.004 1.00 15.65 H new ATOM 0 HD2 PHE A 30 -17.718 -25.286 -1.838 1.00 15.88 H new ATOM 0 HE1 PHE A 30 -14.892 -25.258 2.250 1.00 17.03 H new ATOM 0 HE2 PHE A 30 -18.780 -25.403 0.406 1.00 17.20 H new ATOM 0 HZ PHE A 30 -17.366 -25.376 2.451 1.00 17.74 H new ATOM 469 N ARG A 31 -12.326 -26.410 -3.238 1.00 12.30 N ATOM 470 CA ARG A 31 -10.884 -26.496 -3.104 1.00 11.74 C ATOM 471 C ARG A 31 -10.418 -25.775 -1.851 1.00 10.92 C ATOM 472 O ARG A 31 -9.812 -24.711 -1.896 1.00 10.30 O ATOM 473 CB ARG A 31 -10.295 -25.969 -4.415 1.00 11.83 C ATOM 474 CG ARG A 31 -8.775 -26.003 -4.599 1.00 11.85 C ATOM 475 CD ARG A 31 -8.082 -27.325 -4.246 1.00 13.07 C ATOM 476 NE ARG A 31 -7.437 -27.252 -2.918 1.00 13.34 N ATOM 477 CZ ARG A 31 -6.158 -27.561 -2.641 1.00 14.16 C ATOM 478 NH1 ARG A 31 -5.386 -28.206 -3.523 1.00 14.88 N ATOM 479 NH2 ARG A 31 -5.662 -27.238 -1.447 1.00 14.56 N ATOM 0 H ARG A 31 -12.622 -25.742 -3.950 1.00 12.30 H new ATOM 0 HA ARG A 31 -10.532 -27.518 -2.960 1.00 11.74 H new ATOM 0 HB2 ARG A 31 -10.740 -26.538 -5.231 1.00 11.83 H new ATOM 0 HB3 ARG A 31 -10.620 -24.935 -4.533 1.00 11.83 H new ATOM 0 HG2 ARG A 31 -8.550 -25.764 -5.638 1.00 11.85 H new ATOM 0 HG3 ARG A 31 -8.338 -25.213 -3.989 1.00 11.85 H new ATOM 0 HD2 ARG A 31 -8.812 -28.135 -4.255 1.00 13.07 H new ATOM 0 HD3 ARG A 31 -7.335 -27.561 -5.004 1.00 13.07 H new ATOM 0 HE ARG A 31 -8.016 -26.938 -2.139 1.00 13.34 H new ATOM 0 HH11 ARG A 31 -5.765 -28.475 -4.431 1.00 14.88 H new ATOM 0 HH12 ARG A 31 -4.419 -28.428 -3.287 1.00 14.88 H new ATOM 0 HH21 ARG A 31 -6.250 -26.765 -0.761 1.00 14.56 H new ATOM 0 HH22 ARG A 31 -4.694 -27.464 -1.219 1.00 14.56 H new ATOM 493 N ILE A 32 -10.678 -26.423 -0.720 1.00 11.32 N ATOM 494 CA ILE A 32 -10.131 -26.072 0.573 1.00 11.02 C ATOM 495 C ILE A 32 -8.617 -25.811 0.540 1.00 10.52 C ATOM 496 O ILE A 32 -7.900 -26.352 -0.307 1.00 10.86 O ATOM 497 CB ILE A 32 -10.550 -27.100 1.618 1.00 12.15 C ATOM 498 CG1 ILE A 32 -9.730 -28.379 1.563 1.00 12.95 C ATOM 499 CG2 ILE A 32 -12.062 -27.350 1.700 1.00 12.36 C ATOM 500 CD1 ILE A 32 -9.898 -29.248 0.312 1.00 13.19 C ATOM 0 H ILE A 32 -11.297 -27.233 -0.684 1.00 11.32 H new ATOM 0 HA ILE A 32 -10.558 -25.113 0.868 1.00 11.02 H new ATOM 0 HB ILE A 32 -10.306 -26.630 2.571 1.00 12.15 H new ATOM 0 HG12 ILE A 32 -8.677 -28.113 1.654 1.00 12.95 H new ATOM 0 HG13 ILE A 32 -9.983 -28.983 2.434 1.00 12.95 H new ATOM 0 HG21 ILE A 32 -12.266 -28.095 2.469 1.00 12.36 H new ATOM 0 HG22 ILE A 32 -12.572 -26.420 1.951 1.00 12.36 H new ATOM 0 HG23 ILE A 32 -12.423 -27.713 0.738 1.00 12.36 H new ATOM 0 HD11 ILE A 32 -9.262 -30.129 0.393 1.00 13.19 H new ATOM 0 HD12 ILE A 32 -10.939 -29.559 0.222 1.00 13.19 H new ATOM 0 HD13 ILE A 32 -9.613 -28.675 -0.570 1.00 13.19 H new ATOM 512 N GLY A 33 -8.138 -25.016 1.506 1.00 10.18 N ATOM 513 CA GLY A 33 -6.724 -24.735 1.729 1.00 10.11 C ATOM 514 C GLY A 33 -6.033 -24.307 0.439 1.00 8.85 C ATOM 515 O GLY A 33 -5.086 -24.960 0.006 1.00 9.30 O ATOM 0 H GLY A 33 -8.747 -24.539 2.171 1.00 10.18 H new ATOM 0 HA2 GLY A 33 -6.621 -23.949 2.477 1.00 10.11 H new ATOM 0 HA3 GLY A 33 -6.234 -25.622 2.129 1.00 10.11 H new ATOM 519 N ASP A 34 -6.552 -23.247 -0.182 1.00 7.72 N ATOM 520 CA ASP A 34 -6.175 -22.746 -1.494 1.00 6.77 C ATOM 521 C ASP A 34 -6.908 -21.410 -1.661 1.00 5.61 C ATOM 522 O ASP A 34 -7.603 -21.005 -0.725 1.00 5.77 O ATOM 523 CB ASP A 34 -6.633 -23.749 -2.562 1.00 7.42 C ATOM 524 CG ASP A 34 -5.784 -23.731 -3.822 1.00 7.52 C ATOM 525 OD1 ASP A 34 -5.470 -24.846 -4.298 1.00 8.12 O ATOM 526 OD2 ASP A 34 -5.476 -22.611 -4.284 1.00 7.55 O ATOM 0 H ASP A 34 -7.289 -22.687 0.246 1.00 7.72 H new ATOM 0 HA ASP A 34 -5.098 -22.614 -1.595 1.00 6.77 H new ATOM 0 HB2 ASP A 34 -6.615 -24.752 -2.137 1.00 7.42 H new ATOM 0 HB3 ASP A 34 -7.668 -23.535 -2.829 1.00 7.42 H new ATOM 531 N ILE A 35 -6.809 -20.784 -2.838 1.00 5.09 N ATOM 532 CA ILE A 35 -7.526 -19.563 -3.223 1.00 4.33 C ATOM 533 C ILE A 35 -7.010 -18.362 -2.414 1.00 3.65 C ATOM 534 O ILE A 35 -6.428 -18.516 -1.340 1.00 4.34 O ATOM 535 CB ILE A 35 -9.059 -19.748 -3.073 1.00 4.95 C ATOM 536 CG1 ILE A 35 -9.574 -21.039 -3.745 1.00 6.30 C ATOM 537 CG2 ILE A 35 -9.883 -18.576 -3.628 1.00 4.94 C ATOM 538 CD1 ILE A 35 -10.458 -21.808 -2.763 1.00 7.35 C ATOM 0 H ILE A 35 -6.201 -21.129 -3.581 1.00 5.09 H new ATOM 0 HA ILE A 35 -7.331 -19.361 -4.276 1.00 4.33 H new ATOM 0 HB ILE A 35 -9.202 -19.803 -1.994 1.00 4.95 H new ATOM 0 HG12 ILE A 35 -10.139 -20.793 -4.644 1.00 6.30 H new ATOM 0 HG13 ILE A 35 -8.734 -21.659 -4.057 1.00 6.30 H new ATOM 0 HG21 ILE A 35 -10.945 -18.779 -3.487 1.00 4.94 H new ATOM 0 HG22 ILE A 35 -9.615 -17.661 -3.100 1.00 4.94 H new ATOM 0 HG23 ILE A 35 -9.675 -18.456 -4.691 1.00 4.94 H new ATOM 0 HD11 ILE A 35 -10.822 -22.719 -3.238 1.00 7.35 H new ATOM 0 HD12 ILE A 35 -9.878 -22.067 -1.877 1.00 7.35 H new ATOM 0 HD13 ILE A 35 -11.306 -21.187 -2.473 1.00 7.35 H new ATOM 550 N ALA A 36 -7.218 -17.141 -2.913 1.00 3.06 N ATOM 551 CA ALA A 36 -6.941 -15.927 -2.173 1.00 3.24 C ATOM 552 C ALA A 36 -8.011 -14.874 -2.465 1.00 2.55 C ATOM 553 O ALA A 36 -8.956 -14.712 -1.694 1.00 3.21 O ATOM 554 CB ALA A 36 -5.531 -15.434 -2.511 1.00 4.37 C ATOM 0 H ALA A 36 -7.586 -16.976 -3.850 1.00 3.06 H new ATOM 0 HA ALA A 36 -6.976 -16.127 -1.102 1.00 3.24 H new ATOM 0 HB1 ALA A 36 -5.322 -14.520 -1.954 1.00 4.37 H new ATOM 0 HB2 ALA A 36 -4.803 -16.199 -2.240 1.00 4.37 H new ATOM 0 HB3 ALA A 36 -5.463 -15.231 -3.580 1.00 4.37 H new ATOM 560 N GLY A 37 -7.865 -14.126 -3.551 1.00 2.34 N ATOM 561 CA GLY A 37 -8.554 -12.869 -3.774 1.00 1.92 C ATOM 562 C GLY A 37 -9.906 -13.062 -4.448 1.00 1.65 C ATOM 563 O GLY A 37 -10.200 -12.336 -5.392 1.00 1.97 O ATOM 0 H GLY A 37 -7.247 -14.387 -4.319 1.00 2.34 H new ATOM 0 HA2 GLY A 37 -8.695 -12.361 -2.820 1.00 1.92 H new ATOM 0 HA3 GLY A 37 -7.932 -12.221 -4.391 1.00 1.92 H new ATOM 567 N GLU A 38 -10.742 -13.975 -3.936 1.00 1.99 N ATOM 568 CA GLU A 38 -12.021 -14.349 -4.550 1.00 2.04 C ATOM 569 C GLU A 38 -12.776 -13.116 -5.060 1.00 1.76 C ATOM 570 O GLU A 38 -12.760 -12.832 -6.256 1.00 1.72 O ATOM 571 CB GLU A 38 -12.862 -15.203 -3.572 1.00 2.37 C ATOM 572 CG GLU A 38 -13.453 -16.475 -4.197 1.00 2.52 C ATOM 573 CD GLU A 38 -14.687 -16.204 -5.042 1.00 3.53 C ATOM 574 OE1 GLU A 38 -14.627 -15.320 -5.925 1.00 4.64 O ATOM 575 OE2 GLU A 38 -15.721 -16.889 -4.851 1.00 4.20 O ATOM 0 H GLU A 38 -10.545 -14.481 -3.072 1.00 1.99 H new ATOM 0 HA GLU A 38 -11.821 -14.967 -5.425 1.00 2.04 H new ATOM 0 HB2 GLU A 38 -12.238 -15.484 -2.724 1.00 2.37 H new ATOM 0 HB3 GLU A 38 -13.675 -14.592 -3.181 1.00 2.37 H new ATOM 0 HG2 GLU A 38 -12.695 -16.955 -4.815 1.00 2.52 H new ATOM 0 HG3 GLU A 38 -13.710 -17.177 -3.404 1.00 2.52 H new ATOM 582 N HIS A 39 -13.388 -12.322 -4.167 1.00 1.71 N ATOM 583 CA HIS A 39 -14.156 -11.169 -4.582 1.00 1.70 C ATOM 584 C HIS A 39 -13.297 -10.024 -5.113 1.00 1.50 C ATOM 585 O HIS A 39 -13.873 -9.076 -5.625 1.00 1.67 O ATOM 586 CB HIS A 39 -15.173 -10.768 -3.506 1.00 2.02 C ATOM 587 CG HIS A 39 -16.436 -11.605 -3.558 1.00 2.86 C ATOM 588 ND1 HIS A 39 -17.718 -11.130 -3.397 1.00 3.44 N ATOM 589 CD2 HIS A 39 -16.537 -12.925 -3.918 1.00 4.29 C ATOM 590 CE1 HIS A 39 -18.565 -12.142 -3.646 1.00 4.42 C ATOM 591 NE2 HIS A 39 -17.893 -13.257 -3.976 1.00 4.94 N ATOM 0 H HIS A 39 -13.358 -12.469 -3.158 1.00 1.71 H new ATOM 0 HA HIS A 39 -14.742 -11.460 -5.454 1.00 1.70 H new ATOM 0 HB2 HIS A 39 -14.715 -10.869 -2.522 1.00 2.02 H new ATOM 0 HB3 HIS A 39 -15.433 -9.717 -3.630 1.00 2.02 H new ATOM 0 HD1 HIS A 39 -17.978 -10.179 -3.135 1.00 3.44 H new ATOM 0 HD2 HIS A 39 -15.712 -13.592 -4.121 1.00 4.29 H new ATOM 0 HE1 HIS A 39 -19.641 -12.069 -3.589 1.00 4.42 H new ATOM 599 N THR A 40 -11.959 -10.086 -5.027 1.00 1.37 N ATOM 600 CA THR A 40 -11.159 -9.238 -5.900 1.00 1.29 C ATOM 601 C THR A 40 -11.399 -9.710 -7.327 1.00 1.36 C ATOM 602 O THR A 40 -12.181 -9.124 -8.067 1.00 1.96 O ATOM 603 CB THR A 40 -9.670 -9.244 -5.506 1.00 1.41 C ATOM 604 OG1 THR A 40 -9.530 -8.713 -4.207 1.00 2.35 O ATOM 605 CG2 THR A 40 -8.834 -8.413 -6.476 1.00 2.49 C ATOM 0 H THR A 40 -11.435 -10.687 -4.391 1.00 1.37 H new ATOM 0 HA THR A 40 -11.461 -8.195 -5.804 1.00 1.29 H new ATOM 0 HB THR A 40 -9.314 -10.274 -5.539 1.00 1.41 H new ATOM 0 HG1 THR A 40 -8.673 -8.999 -3.828 1.00 2.35 H new ATOM 0 HG21 THR A 40 -7.788 -8.438 -6.169 1.00 2.49 H new ATOM 0 HG22 THR A 40 -8.927 -8.824 -7.481 1.00 2.49 H new ATOM 0 HG23 THR A 40 -9.189 -7.382 -6.471 1.00 2.49 H new ATOM 613 N SER A 41 -10.740 -10.793 -7.703 1.00 1.15 N ATOM 614 CA SER A 41 -10.723 -11.299 -9.064 1.00 1.19 C ATOM 615 C SER A 41 -12.143 -11.360 -9.647 1.00 1.45 C ATOM 616 O SER A 41 -12.439 -10.740 -10.671 1.00 1.51 O ATOM 617 CB SER A 41 -9.982 -12.634 -9.018 1.00 1.29 C ATOM 618 OG SER A 41 -8.781 -12.404 -8.301 1.00 2.19 O ATOM 0 H SER A 41 -10.190 -11.357 -7.055 1.00 1.15 H new ATOM 0 HA SER A 41 -10.196 -10.638 -9.752 1.00 1.19 H new ATOM 0 HB2 SER A 41 -10.587 -13.396 -8.527 1.00 1.29 H new ATOM 0 HB3 SER A 41 -9.770 -12.995 -10.024 1.00 1.29 H new ATOM 0 HG SER A 41 -8.185 -13.175 -8.405 1.00 2.19 H new ATOM 624 N PHE A 42 -13.050 -12.031 -8.929 1.00 1.71 N ATOM 625 CA PHE A 42 -14.441 -12.194 -9.328 1.00 2.04 C ATOM 626 C PHE A 42 -15.203 -10.868 -9.480 1.00 2.26 C ATOM 627 O PHE A 42 -16.104 -10.814 -10.315 1.00 2.50 O ATOM 628 CB PHE A 42 -15.149 -13.169 -8.368 1.00 2.62 C ATOM 629 CG PHE A 42 -16.653 -13.015 -8.295 1.00 2.89 C ATOM 630 CD1 PHE A 42 -17.194 -12.094 -7.379 1.00 3.39 C ATOM 631 CD2 PHE A 42 -17.473 -13.575 -9.291 1.00 3.56 C ATOM 632 CE1 PHE A 42 -18.531 -11.690 -7.488 1.00 3.55 C ATOM 633 CE2 PHE A 42 -18.833 -13.225 -9.351 1.00 3.63 C ATOM 634 CZ PHE A 42 -19.363 -12.280 -8.454 1.00 3.16 C ATOM 0 H PHE A 42 -12.829 -12.481 -8.041 1.00 1.71 H new ATOM 0 HA PHE A 42 -14.441 -12.623 -10.330 1.00 2.04 H new ATOM 0 HB2 PHE A 42 -14.918 -14.189 -8.674 1.00 2.62 H new ATOM 0 HB3 PHE A 42 -14.736 -13.035 -7.368 1.00 2.62 H new ATOM 0 HD1 PHE A 42 -16.575 -11.697 -6.588 1.00 3.39 H new ATOM 0 HD2 PHE A 42 -17.060 -14.271 -10.006 1.00 3.56 H new ATOM 0 HE1 PHE A 42 -18.921 -10.927 -6.831 1.00 3.55 H new ATOM 0 HE2 PHE A 42 -19.474 -13.684 -10.089 1.00 3.63 H new ATOM 0 HZ PHE A 42 -20.407 -12.009 -8.508 1.00 3.16 H new ATOM 644 N ASP A 43 -14.906 -9.821 -8.690 1.00 2.32 N ATOM 645 CA ASP A 43 -15.669 -8.570 -8.757 1.00 2.73 C ATOM 646 C ASP A 43 -15.747 -8.100 -10.207 1.00 2.74 C ATOM 647 O ASP A 43 -16.838 -7.956 -10.769 1.00 3.41 O ATOM 648 CB ASP A 43 -15.057 -7.482 -7.849 1.00 2.78 C ATOM 649 CG ASP A 43 -15.379 -6.060 -8.286 1.00 2.52 C ATOM 650 OD1 ASP A 43 -16.589 -5.760 -8.370 1.00 3.21 O ATOM 651 OD2 ASP A 43 -14.428 -5.303 -8.570 1.00 2.50 O ATOM 0 H ASP A 43 -14.150 -9.819 -8.005 1.00 2.32 H new ATOM 0 HA ASP A 43 -16.678 -8.756 -8.389 1.00 2.73 H new ATOM 0 HB2 ASP A 43 -15.416 -7.629 -6.830 1.00 2.78 H new ATOM 0 HB3 ASP A 43 -13.975 -7.608 -7.826 1.00 2.78 H new ATOM 656 N LYS A 44 -14.561 -7.873 -10.772 1.00 2.16 N ATOM 657 CA LYS A 44 -14.292 -7.490 -12.148 1.00 2.14 C ATOM 658 C LYS A 44 -12.814 -7.095 -12.242 1.00 2.13 C ATOM 659 O LYS A 44 -12.498 -5.995 -12.702 1.00 2.52 O ATOM 660 CB LYS A 44 -15.221 -6.356 -12.637 1.00 2.56 C ATOM 661 CG LYS A 44 -15.374 -5.231 -11.601 1.00 3.32 C ATOM 662 CD LYS A 44 -15.951 -3.910 -12.125 1.00 3.35 C ATOM 663 CE LYS A 44 -15.077 -3.229 -13.191 1.00 3.62 C ATOM 664 NZ LYS A 44 -15.470 -3.597 -14.567 1.00 3.37 N ATOM 0 H LYS A 44 -13.700 -7.960 -10.233 1.00 2.16 H new ATOM 0 HA LYS A 44 -14.498 -8.333 -12.807 1.00 2.14 H new ATOM 0 HB2 LYS A 44 -14.825 -5.941 -13.564 1.00 2.56 H new ATOM 0 HB3 LYS A 44 -16.203 -6.769 -12.867 1.00 2.56 H new ATOM 0 HG2 LYS A 44 -16.014 -5.590 -10.795 1.00 3.32 H new ATOM 0 HG3 LYS A 44 -14.396 -5.030 -11.165 1.00 3.32 H new ATOM 0 HD2 LYS A 44 -16.939 -4.097 -12.545 1.00 3.35 H new ATOM 0 HD3 LYS A 44 -16.085 -3.226 -11.287 1.00 3.35 H new ATOM 0 HE2 LYS A 44 -15.145 -2.147 -13.075 1.00 3.62 H new ATOM 0 HE3 LYS A 44 -14.034 -3.502 -13.029 1.00 3.62 H new ATOM 0 HZ1 LYS A 44 -14.619 -3.799 -15.129 1.00 3.37 H new ATOM 0 HZ2 LYS A 44 -16.076 -4.442 -14.541 1.00 3.37 H new ATOM 0 HZ3 LYS A 44 -15.993 -2.810 -15.001 1.00 3.37 H new ATOM 678 N LEU A 45 -11.911 -7.978 -11.797 1.00 1.87 N ATOM 679 CA LEU A 45 -10.472 -7.746 -11.874 1.00 1.86 C ATOM 680 C LEU A 45 -9.822 -8.901 -12.637 1.00 1.68 C ATOM 681 O LEU A 45 -10.160 -10.055 -12.389 1.00 2.21 O ATOM 682 CB LEU A 45 -9.866 -7.572 -10.475 1.00 2.01 C ATOM 683 CG LEU A 45 -10.280 -6.235 -9.838 1.00 2.02 C ATOM 684 CD1 LEU A 45 -11.446 -6.372 -8.862 1.00 2.54 C ATOM 685 CD2 LEU A 45 -9.094 -5.626 -9.091 1.00 2.96 C ATOM 0 H LEU A 45 -12.162 -8.872 -11.374 1.00 1.87 H new ATOM 0 HA LEU A 45 -10.280 -6.818 -12.413 1.00 1.86 H new ATOM 0 HB2 LEU A 45 -10.186 -8.394 -9.835 1.00 2.01 H new ATOM 0 HB3 LEU A 45 -8.779 -7.623 -10.540 1.00 2.01 H new ATOM 0 HG LEU A 45 -10.603 -5.592 -10.657 1.00 2.02 H new ATOM 0 HD11 LEU A 45 -11.690 -5.394 -8.447 1.00 2.54 H new ATOM 0 HD12 LEU A 45 -12.315 -6.770 -9.386 1.00 2.54 H new ATOM 0 HD13 LEU A 45 -11.167 -7.049 -8.055 1.00 2.54 H new ATOM 0 HD21 LEU A 45 -9.394 -4.679 -8.642 1.00 2.96 H new ATOM 0 HD22 LEU A 45 -8.766 -6.311 -8.309 1.00 2.96 H new ATOM 0 HD23 LEU A 45 -8.274 -5.453 -9.789 1.00 2.96 H new ATOM 697 N PRO A 46 -8.924 -8.618 -13.593 1.00 1.44 N ATOM 698 CA PRO A 46 -8.333 -9.645 -14.436 1.00 1.57 C ATOM 699 C PRO A 46 -7.383 -10.517 -13.622 1.00 1.51 C ATOM 700 O PRO A 46 -6.878 -10.087 -12.589 1.00 1.55 O ATOM 701 CB PRO A 46 -7.556 -8.873 -15.507 1.00 1.99 C ATOM 702 CG PRO A 46 -7.168 -7.574 -14.800 1.00 2.11 C ATOM 703 CD PRO A 46 -8.375 -7.308 -13.901 1.00 1.77 C ATOM 0 HA PRO A 46 -9.084 -10.308 -14.866 1.00 1.57 H new ATOM 0 HB2 PRO A 46 -6.678 -9.425 -15.842 1.00 1.99 H new ATOM 0 HB3 PRO A 46 -8.169 -8.683 -16.388 1.00 1.99 H new ATOM 0 HG2 PRO A 46 -6.250 -7.686 -14.223 1.00 2.11 H new ATOM 0 HG3 PRO A 46 -7.003 -6.761 -15.508 1.00 2.11 H new ATOM 0 HD2 PRO A 46 -8.080 -6.782 -12.993 1.00 1.77 H new ATOM 0 HD3 PRO A 46 -9.111 -6.683 -14.406 1.00 1.77 H new ATOM 711 N GLU A 47 -7.011 -11.684 -14.148 1.00 2.04 N ATOM 712 CA GLU A 47 -5.903 -12.469 -13.616 1.00 2.41 C ATOM 713 C GLU A 47 -4.561 -11.866 -14.067 1.00 2.05 C ATOM 714 O GLU A 47 -3.672 -12.545 -14.573 1.00 2.76 O ATOM 715 CB GLU A 47 -6.084 -13.947 -13.991 1.00 3.38 C ATOM 716 CG GLU A 47 -6.365 -14.176 -15.484 1.00 3.79 C ATOM 717 CD GLU A 47 -6.329 -15.660 -15.815 1.00 4.84 C ATOM 718 OE1 GLU A 47 -7.390 -16.200 -16.197 1.00 5.86 O ATOM 719 OE2 GLU A 47 -5.247 -16.259 -15.652 1.00 5.07 O ATOM 0 H GLU A 47 -7.470 -12.109 -14.954 1.00 2.04 H new ATOM 0 HA GLU A 47 -5.896 -12.430 -12.527 1.00 2.41 H new ATOM 0 HB2 GLU A 47 -5.185 -14.496 -13.711 1.00 3.38 H new ATOM 0 HB3 GLU A 47 -6.906 -14.363 -13.408 1.00 3.38 H new ATOM 0 HG2 GLU A 47 -7.340 -13.764 -15.743 1.00 3.79 H new ATOM 0 HG3 GLU A 47 -5.625 -13.646 -16.084 1.00 3.79 H new ATOM 726 N GLY A 48 -4.425 -10.551 -13.901 1.00 1.68 N ATOM 727 CA GLY A 48 -3.298 -9.770 -14.366 1.00 1.97 C ATOM 728 C GLY A 48 -2.171 -9.760 -13.336 1.00 1.33 C ATOM 729 O GLY A 48 -2.405 -9.801 -12.131 1.00 2.16 O ATOM 0 H GLY A 48 -5.126 -9.987 -13.421 1.00 1.68 H new ATOM 0 HA2 GLY A 48 -2.931 -10.181 -15.307 1.00 1.97 H new ATOM 0 HA3 GLY A 48 -3.619 -8.748 -14.568 1.00 1.97 H new ATOM 733 N GLY A 49 -0.941 -9.683 -13.839 1.00 1.33 N ATOM 734 CA GLY A 49 0.280 -9.750 -13.047 1.00 1.04 C ATOM 735 C GLY A 49 0.592 -8.447 -12.309 1.00 1.05 C ATOM 736 O GLY A 49 1.245 -8.478 -11.269 1.00 1.54 O ATOM 0 H GLY A 49 -0.764 -9.569 -14.837 1.00 1.33 H new ATOM 0 HA2 GLY A 49 0.191 -10.559 -12.321 1.00 1.04 H new ATOM 0 HA3 GLY A 49 1.116 -9.999 -13.701 1.00 1.04 H new ATOM 740 N ARG A 50 0.170 -7.299 -12.851 1.00 0.98 N ATOM 741 CA ARG A 50 0.357 -5.996 -12.227 1.00 1.05 C ATOM 742 C ARG A 50 -0.807 -5.075 -12.575 1.00 1.13 C ATOM 743 O ARG A 50 -1.333 -5.131 -13.685 1.00 1.50 O ATOM 744 CB ARG A 50 1.693 -5.360 -12.637 1.00 1.08 C ATOM 745 CG ARG A 50 2.888 -6.033 -11.948 1.00 1.81 C ATOM 746 CD ARG A 50 4.106 -5.106 -11.959 1.00 2.36 C ATOM 747 NE ARG A 50 5.236 -5.703 -11.233 1.00 3.35 N ATOM 748 CZ ARG A 50 6.387 -5.064 -10.966 1.00 4.47 C ATOM 749 NH1 ARG A 50 6.570 -3.814 -11.408 1.00 4.97 N ATOM 750 NH2 ARG A 50 7.349 -5.682 -10.273 1.00 5.61 N ATOM 0 H ARG A 50 -0.316 -7.254 -13.746 1.00 0.98 H new ATOM 0 HA ARG A 50 0.382 -6.141 -11.147 1.00 1.05 H new ATOM 0 HB2 ARG A 50 1.811 -5.431 -13.718 1.00 1.08 H new ATOM 0 HB3 ARG A 50 1.681 -4.299 -12.387 1.00 1.08 H new ATOM 0 HG2 ARG A 50 2.627 -6.288 -10.921 1.00 1.81 H new ATOM 0 HG3 ARG A 50 3.130 -6.967 -12.456 1.00 1.81 H new ATOM 0 HD2 ARG A 50 4.400 -4.900 -12.988 1.00 2.36 H new ATOM 0 HD3 ARG A 50 3.843 -4.151 -11.505 1.00 2.36 H new ATOM 0 HE ARG A 50 5.140 -6.666 -10.911 1.00 3.35 H new ATOM 0 HH11 ARG A 50 5.837 -3.351 -11.945 1.00 4.97 H new ATOM 0 HH12 ARG A 50 7.442 -3.325 -11.208 1.00 4.97 H new ATOM 0 HH21 ARG A 50 7.209 -6.638 -9.947 1.00 5.61 H new ATOM 0 HH22 ARG A 50 8.223 -5.197 -10.070 1.00 5.61 H new ATOM 764 N ALA A 51 -1.153 -4.198 -11.628 1.00 1.05 N ATOM 765 CA ALA A 51 -1.920 -2.988 -11.873 1.00 1.04 C ATOM 766 C ALA A 51 -1.000 -1.922 -12.463 1.00 0.99 C ATOM 767 O ALA A 51 0.182 -2.173 -12.669 1.00 1.49 O ATOM 768 CB ALA A 51 -2.574 -2.499 -10.576 1.00 1.45 C ATOM 0 H ALA A 51 -0.898 -4.319 -10.648 1.00 1.05 H new ATOM 0 HA ALA A 51 -2.718 -3.198 -12.586 1.00 1.04 H new ATOM 0 HB1 ALA A 51 -3.145 -1.592 -10.776 1.00 1.45 H new ATOM 0 HB2 ALA A 51 -3.241 -3.270 -10.192 1.00 1.45 H new ATOM 0 HB3 ALA A 51 -1.802 -2.286 -9.837 1.00 1.45 H new ATOM 774 N THR A 52 -1.543 -0.746 -12.772 1.00 0.97 N ATOM 775 CA THR A 52 -0.773 0.403 -13.215 1.00 1.15 C ATOM 776 C THR A 52 -1.182 1.594 -12.347 1.00 1.49 C ATOM 777 O THR A 52 -2.315 2.056 -12.455 1.00 1.68 O ATOM 778 CB THR A 52 -0.993 0.619 -14.726 1.00 1.57 C ATOM 779 OG1 THR A 52 -0.422 1.840 -15.149 1.00 1.99 O ATOM 780 CG2 THR A 52 -2.458 0.549 -15.184 1.00 1.83 C ATOM 0 H THR A 52 -2.546 -0.567 -12.719 1.00 0.97 H new ATOM 0 HA THR A 52 0.300 0.257 -13.093 1.00 1.15 H new ATOM 0 HB THR A 52 -0.489 -0.223 -15.200 1.00 1.57 H new ATOM 0 HG1 THR A 52 -0.572 1.956 -16.111 1.00 1.99 H new ATOM 0 HG21 THR A 52 -2.511 0.713 -16.260 1.00 1.83 H new ATOM 0 HG22 THR A 52 -2.867 -0.433 -14.946 1.00 1.83 H new ATOM 0 HG23 THR A 52 -3.037 1.317 -14.671 1.00 1.83 H new ATOM 788 N TYR A 53 -0.292 2.070 -11.465 1.00 1.93 N ATOM 789 CA TYR A 53 -0.522 3.327 -10.753 1.00 2.53 C ATOM 790 C TYR A 53 0.740 4.038 -10.262 1.00 2.13 C ATOM 791 O TYR A 53 1.845 3.490 -10.226 1.00 2.48 O ATOM 792 CB TYR A 53 -1.571 3.167 -9.644 1.00 3.08 C ATOM 793 CG TYR A 53 -1.285 2.122 -8.591 1.00 2.65 C ATOM 794 CD1 TYR A 53 -0.356 2.382 -7.566 1.00 3.76 C ATOM 795 CD2 TYR A 53 -2.080 0.963 -8.536 1.00 2.60 C ATOM 796 CE1 TYR A 53 -0.221 1.481 -6.497 1.00 4.33 C ATOM 797 CE2 TYR A 53 -1.979 0.089 -7.443 1.00 2.71 C ATOM 798 CZ TYR A 53 -1.046 0.347 -6.423 1.00 3.50 C ATOM 799 OH TYR A 53 -0.931 -0.498 -5.360 1.00 4.38 O ATOM 0 H TYR A 53 0.586 1.606 -11.231 1.00 1.93 H new ATOM 0 HA TYR A 53 -0.927 4.002 -11.507 1.00 2.53 H new ATOM 0 HB2 TYR A 53 -1.690 4.129 -9.146 1.00 3.08 H new ATOM 0 HB3 TYR A 53 -2.527 2.929 -10.110 1.00 3.08 H new ATOM 0 HD1 TYR A 53 0.252 3.274 -7.601 1.00 3.76 H new ATOM 0 HD2 TYR A 53 -2.770 0.745 -9.338 1.00 2.60 H new ATOM 0 HE1 TYR A 53 0.519 1.661 -5.731 1.00 4.33 H new ATOM 0 HE2 TYR A 53 -2.617 -0.781 -7.385 1.00 2.71 H new ATOM 0 HH TYR A 53 -1.711 -1.090 -5.327 1.00 4.38 H new ATOM 809 N ARG A 54 0.565 5.310 -9.908 1.00 1.75 N ATOM 810 CA ARG A 54 1.603 6.237 -9.493 1.00 1.59 C ATOM 811 C ARG A 54 1.116 6.877 -8.196 1.00 1.43 C ATOM 812 O ARG A 54 0.588 7.986 -8.206 1.00 2.16 O ATOM 813 CB ARG A 54 1.788 7.277 -10.617 1.00 1.92 C ATOM 814 CG ARG A 54 2.091 6.683 -12.006 1.00 1.88 C ATOM 815 CD ARG A 54 3.546 6.253 -12.189 1.00 2.00 C ATOM 816 NE ARG A 54 3.821 5.071 -11.369 1.00 3.34 N ATOM 817 CZ ARG A 54 5.006 4.742 -10.850 1.00 5.04 C ATOM 818 NH1 ARG A 54 6.126 5.319 -11.300 1.00 5.22 N ATOM 819 NH2 ARG A 54 5.039 3.843 -9.866 1.00 6.95 N ATOM 0 H ARG A 54 -0.360 5.741 -9.905 1.00 1.75 H new ATOM 0 HA ARG A 54 2.566 5.757 -9.320 1.00 1.59 H new ATOM 0 HB2 ARG A 54 0.883 7.881 -10.686 1.00 1.92 H new ATOM 0 HB3 ARG A 54 2.600 7.949 -10.340 1.00 1.92 H new ATOM 0 HG2 ARG A 54 1.444 5.822 -12.172 1.00 1.88 H new ATOM 0 HG3 ARG A 54 1.841 7.421 -12.769 1.00 1.88 H new ATOM 0 HD2 ARG A 54 3.740 6.032 -13.239 1.00 2.00 H new ATOM 0 HD3 ARG A 54 4.214 7.067 -11.906 1.00 2.00 H new ATOM 0 HE ARG A 54 3.039 4.445 -11.178 1.00 3.34 H new ATOM 0 HH11 ARG A 54 6.078 6.015 -12.044 1.00 5.22 H new ATOM 0 HH12 ARG A 54 7.028 5.063 -10.899 1.00 5.22 H new ATOM 0 HH21 ARG A 54 4.172 3.425 -9.528 1.00 6.95 H new ATOM 0 HH22 ARG A 54 5.931 3.573 -9.451 1.00 6.95 H new ATOM 833 N GLY A 55 1.217 6.148 -7.080 1.00 0.71 N ATOM 834 CA GLY A 55 0.558 6.568 -5.857 1.00 0.62 C ATOM 835 C GLY A 55 1.426 7.511 -5.039 1.00 0.55 C ATOM 836 O GLY A 55 2.654 7.450 -5.087 1.00 0.59 O ATOM 0 H GLY A 55 1.743 5.277 -7.006 1.00 0.71 H new ATOM 0 HA2 GLY A 55 -0.382 7.062 -6.103 1.00 0.62 H new ATOM 0 HA3 GLY A 55 0.311 5.691 -5.258 1.00 0.62 H new ATOM 840 N THR A 56 0.779 8.370 -4.259 1.00 0.75 N ATOM 841 CA THR A 56 1.420 9.329 -3.382 1.00 1.04 C ATOM 842 C THR A 56 0.950 9.027 -1.969 1.00 1.07 C ATOM 843 O THR A 56 -0.260 9.064 -1.725 1.00 1.20 O ATOM 844 CB THR A 56 0.999 10.740 -3.803 1.00 1.34 C ATOM 845 OG1 THR A 56 -0.407 10.783 -3.959 1.00 2.44 O ATOM 846 CG2 THR A 56 1.671 11.123 -5.123 1.00 2.13 C ATOM 0 H THR A 56 -0.239 8.415 -4.222 1.00 0.75 H new ATOM 0 HA THR A 56 2.507 9.265 -3.435 1.00 1.04 H new ATOM 0 HB THR A 56 1.307 11.447 -3.033 1.00 1.34 H new ATOM 0 HG1 THR A 56 -0.830 10.239 -3.262 1.00 2.44 H new ATOM 0 HG21 THR A 56 1.363 12.128 -5.410 1.00 2.13 H new ATOM 0 HG22 THR A 56 2.754 11.097 -5.001 1.00 2.13 H new ATOM 0 HG23 THR A 56 1.376 10.417 -5.900 1.00 2.13 H new ATOM 854 N ALA A 57 1.888 8.739 -1.063 1.00 1.09 N ATOM 855 CA ALA A 57 1.623 8.636 0.357 1.00 1.24 C ATOM 856 C ALA A 57 2.245 9.849 1.041 1.00 1.30 C ATOM 857 O ALA A 57 3.345 10.271 0.678 1.00 2.15 O ATOM 858 CB ALA A 57 2.168 7.307 0.885 1.00 1.23 C ATOM 0 H ALA A 57 2.864 8.570 -1.308 1.00 1.09 H new ATOM 0 HA ALA A 57 0.554 8.638 0.568 1.00 1.24 H new ATOM 0 HB1 ALA A 57 1.968 7.231 1.954 1.00 1.23 H new ATOM 0 HB2 ALA A 57 1.681 6.482 0.365 1.00 1.23 H new ATOM 0 HB3 ALA A 57 3.243 7.261 0.713 1.00 1.23 H new ATOM 864 N PHE A 58 1.530 10.431 2.002 1.00 0.84 N ATOM 865 CA PHE A 58 1.989 11.578 2.762 1.00 0.90 C ATOM 866 C PHE A 58 1.897 11.249 4.246 1.00 0.74 C ATOM 867 O PHE A 58 0.864 10.774 4.719 1.00 0.71 O ATOM 868 CB PHE A 58 1.208 12.844 2.400 1.00 1.22 C ATOM 869 CG PHE A 58 -0.251 12.827 2.811 1.00 1.25 C ATOM 870 CD1 PHE A 58 -1.207 12.176 2.010 1.00 1.71 C ATOM 871 CD2 PHE A 58 -0.623 13.338 4.069 1.00 2.45 C ATOM 872 CE1 PHE A 58 -2.529 12.031 2.468 1.00 1.97 C ATOM 873 CE2 PHE A 58 -1.937 13.173 4.535 1.00 2.51 C ATOM 874 CZ PHE A 58 -2.894 12.528 3.731 1.00 1.69 C ATOM 0 H PHE A 58 0.601 10.109 2.274 1.00 0.84 H new ATOM 0 HA PHE A 58 3.029 11.789 2.511 1.00 0.90 H new ATOM 0 HB2 PHE A 58 1.693 13.700 2.868 1.00 1.22 H new ATOM 0 HB3 PHE A 58 1.266 12.995 1.322 1.00 1.22 H new ATOM 0 HD1 PHE A 58 -0.926 11.787 1.043 1.00 1.71 H new ATOM 0 HD2 PHE A 58 0.103 13.858 4.676 1.00 2.45 H new ATOM 0 HE1 PHE A 58 -3.264 11.538 1.849 1.00 1.97 H new ATOM 0 HE2 PHE A 58 -2.213 13.542 5.512 1.00 2.51 H new ATOM 0 HZ PHE A 58 -3.908 12.415 4.084 1.00 1.69 H new ATOM 884 N GLY A 59 2.997 11.473 4.961 1.00 0.76 N ATOM 885 CA GLY A 59 3.049 11.408 6.411 1.00 0.80 C ATOM 886 C GLY A 59 2.591 12.729 7.020 1.00 1.04 C ATOM 887 O GLY A 59 2.464 13.733 6.322 1.00 1.15 O ATOM 0 H GLY A 59 3.893 11.709 4.535 1.00 0.76 H new ATOM 0 HA2 GLY A 59 2.415 10.597 6.768 1.00 0.80 H new ATOM 0 HA3 GLY A 59 4.065 11.184 6.735 1.00 0.80 H new ATOM 891 N SER A 60 2.409 12.757 8.341 1.00 1.27 N ATOM 892 CA SER A 60 2.181 14.004 9.071 1.00 1.62 C ATOM 893 C SER A 60 3.268 15.044 8.738 1.00 1.64 C ATOM 894 O SER A 60 2.961 16.204 8.480 1.00 1.86 O ATOM 895 CB SER A 60 2.092 13.705 10.574 1.00 1.87 C ATOM 896 OG SER A 60 1.707 14.852 11.303 1.00 2.50 O ATOM 0 H SER A 60 2.415 11.924 8.930 1.00 1.27 H new ATOM 0 HA SER A 60 1.233 14.443 8.760 1.00 1.62 H new ATOM 0 HB2 SER A 60 1.373 12.904 10.746 1.00 1.87 H new ATOM 0 HB3 SER A 60 3.057 13.350 10.934 1.00 1.87 H new ATOM 0 HG SER A 60 1.657 14.632 12.257 1.00 2.50 H new ATOM 902 N ASP A 61 4.533 14.608 8.680 1.00 1.54 N ATOM 903 CA ASP A 61 5.689 15.442 8.336 1.00 1.70 C ATOM 904 C ASP A 61 5.788 15.736 6.823 1.00 1.39 C ATOM 905 O ASP A 61 6.764 16.324 6.367 1.00 1.45 O ATOM 906 CB ASP A 61 6.944 14.690 8.827 1.00 1.92 C ATOM 907 CG ASP A 61 8.250 15.459 8.639 1.00 2.38 C ATOM 908 OD1 ASP A 61 8.350 16.560 9.215 1.00 2.21 O ATOM 909 OD2 ASP A 61 9.162 14.907 7.974 1.00 3.75 O ATOM 0 H ASP A 61 4.786 13.640 8.876 1.00 1.54 H new ATOM 0 HA ASP A 61 5.589 16.415 8.816 1.00 1.70 H new ATOM 0 HB2 ASP A 61 6.823 14.456 9.885 1.00 1.92 H new ATOM 0 HB3 ASP A 61 7.015 13.740 8.297 1.00 1.92 H new ATOM 914 N ASP A 62 4.844 15.229 6.018 1.00 1.17 N ATOM 915 CA ASP A 62 5.198 14.453 4.836 1.00 1.20 C ATOM 916 C ASP A 62 6.601 13.855 4.903 1.00 1.37 C ATOM 917 O ASP A 62 7.537 14.258 4.211 1.00 1.69 O ATOM 918 CB ASP A 62 4.867 15.058 3.469 1.00 1.49 C ATOM 919 CG ASP A 62 5.034 13.984 2.383 1.00 2.21 C ATOM 920 OD1 ASP A 62 5.170 12.794 2.758 1.00 3.24 O ATOM 921 OD2 ASP A 62 4.996 14.345 1.189 1.00 2.64 O ATOM 0 H ASP A 62 3.841 15.344 6.167 1.00 1.17 H new ATOM 0 HA ASP A 62 4.489 13.627 4.895 1.00 1.20 H new ATOM 0 HB2 ASP A 62 3.846 15.439 3.465 1.00 1.49 H new ATOM 0 HB3 ASP A 62 5.524 15.903 3.264 1.00 1.49 H new ATOM 926 N ALA A 63 6.693 12.802 5.710 1.00 1.31 N ATOM 927 CA ALA A 63 7.638 11.744 5.452 1.00 1.54 C ATOM 928 C ALA A 63 6.823 10.500 5.128 1.00 1.44 C ATOM 929 O ALA A 63 7.021 9.446 5.721 1.00 1.59 O ATOM 930 CB ALA A 63 8.492 11.569 6.703 1.00 1.76 C ATOM 0 H ALA A 63 6.122 12.668 6.544 1.00 1.31 H new ATOM 0 HA ALA A 63 8.307 11.954 4.618 1.00 1.54 H new ATOM 0 HB1 ALA A 63 9.219 10.773 6.539 1.00 1.76 H new ATOM 0 HB2 ALA A 63 9.016 12.500 6.919 1.00 1.76 H new ATOM 0 HB3 ALA A 63 7.853 11.308 7.546 1.00 1.76 H new ATOM 936 N GLY A 64 5.938 10.613 4.140 1.00 1.34 N ATOM 937 CA GLY A 64 5.233 9.479 3.584 1.00 1.30 C ATOM 938 C GLY A 64 5.969 9.068 2.311 1.00 1.22 C ATOM 939 O GLY A 64 6.826 9.799 1.809 1.00 1.31 O ATOM 0 H GLY A 64 5.694 11.503 3.706 1.00 1.34 H new ATOM 0 HA2 GLY A 64 5.208 8.655 4.297 1.00 1.30 H new ATOM 0 HA3 GLY A 64 4.198 9.740 3.363 1.00 1.30 H new ATOM 943 N GLY A 65 5.648 7.900 1.769 1.00 1.25 N ATOM 944 CA GLY A 65 6.328 7.334 0.614 1.00 1.19 C ATOM 945 C GLY A 65 5.684 7.721 -0.711 1.00 0.65 C ATOM 946 O GLY A 65 4.728 8.494 -0.748 1.00 0.71 O ATOM 0 H GLY A 65 4.896 7.311 2.126 1.00 1.25 H new ATOM 0 HA2 GLY A 65 7.367 7.663 0.615 1.00 1.19 H new ATOM 0 HA3 GLY A 65 6.337 6.248 0.702 1.00 1.19 H new ATOM 950 N LYS A 66 6.255 7.284 -1.829 1.00 0.61 N ATOM 951 CA LYS A 66 5.562 7.357 -3.103 1.00 0.62 C ATOM 952 C LYS A 66 5.367 5.927 -3.610 1.00 0.80 C ATOM 953 O LYS A 66 6.319 5.160 -3.728 1.00 1.45 O ATOM 954 CB LYS A 66 6.289 8.317 -4.042 1.00 1.31 C ATOM 955 CG LYS A 66 6.138 9.774 -3.550 1.00 1.88 C ATOM 956 CD LYS A 66 7.370 10.383 -2.849 1.00 3.23 C ATOM 957 CE LYS A 66 7.485 10.276 -1.318 1.00 4.48 C ATOM 958 NZ LYS A 66 6.281 10.755 -0.583 1.00 6.57 N ATOM 0 H LYS A 66 7.190 6.879 -1.875 1.00 0.61 H new ATOM 0 HA LYS A 66 4.564 7.788 -3.020 1.00 0.62 H new ATOM 0 HB2 LYS A 66 7.345 8.053 -4.095 1.00 1.31 H new ATOM 0 HB3 LYS A 66 5.886 8.224 -5.050 1.00 1.31 H new ATOM 0 HG2 LYS A 66 5.885 10.401 -4.405 1.00 1.88 H new ATOM 0 HG3 LYS A 66 5.294 9.818 -2.861 1.00 1.88 H new ATOM 0 HD2 LYS A 66 8.257 9.918 -3.279 1.00 3.23 H new ATOM 0 HD3 LYS A 66 7.407 11.441 -3.109 1.00 3.23 H new ATOM 0 HE2 LYS A 66 7.671 9.236 -1.050 1.00 4.48 H new ATOM 0 HE3 LYS A 66 8.351 10.850 -0.988 1.00 4.48 H new ATOM 0 HZ1 LYS A 66 6.472 10.747 0.439 1.00 6.57 H new ATOM 0 HZ2 LYS A 66 6.053 11.724 -0.885 1.00 6.57 H new ATOM 0 HZ3 LYS A 66 5.476 10.129 -0.790 1.00 6.57 H new ATOM 972 N LEU A 67 4.100 5.545 -3.783 1.00 0.56 N ATOM 973 CA LEU A 67 3.658 4.165 -3.818 1.00 0.55 C ATOM 974 C LEU A 67 3.777 3.617 -5.238 1.00 0.57 C ATOM 975 O LEU A 67 3.050 4.017 -6.154 1.00 0.85 O ATOM 976 CB LEU A 67 2.227 4.064 -3.266 1.00 0.58 C ATOM 977 CG LEU A 67 1.805 2.618 -2.955 1.00 0.72 C ATOM 978 CD1 LEU A 67 2.397 2.157 -1.619 1.00 0.94 C ATOM 979 CD2 LEU A 67 0.279 2.514 -2.864 1.00 0.93 C ATOM 0 H LEU A 67 3.338 6.212 -3.905 1.00 0.56 H new ATOM 0 HA LEU A 67 4.296 3.551 -3.182 1.00 0.55 H new ATOM 0 HB2 LEU A 67 2.150 4.663 -2.358 1.00 0.58 H new ATOM 0 HB3 LEU A 67 1.533 4.492 -3.990 1.00 0.58 H new ATOM 0 HG LEU A 67 2.176 1.986 -3.762 1.00 0.72 H new ATOM 0 HD11 LEU A 67 2.086 1.132 -1.418 1.00 0.94 H new ATOM 0 HD12 LEU A 67 3.485 2.204 -1.668 1.00 0.94 H new ATOM 0 HD13 LEU A 67 2.041 2.807 -0.820 1.00 0.94 H new ATOM 0 HD21 LEU A 67 -0.003 1.484 -2.643 1.00 0.93 H new ATOM 0 HD22 LEU A 67 -0.084 3.167 -2.071 1.00 0.93 H new ATOM 0 HD23 LEU A 67 -0.164 2.816 -3.813 1.00 0.93 H new ATOM 991 N THR A 68 4.699 2.673 -5.403 1.00 0.52 N ATOM 992 CA THR A 68 4.970 1.978 -6.640 1.00 0.58 C ATOM 993 C THR A 68 3.917 0.900 -6.850 1.00 0.66 C ATOM 994 O THR A 68 3.654 0.136 -5.923 1.00 0.81 O ATOM 995 CB THR A 68 6.350 1.332 -6.483 1.00 0.80 C ATOM 996 OG1 THR A 68 6.373 0.635 -5.249 1.00 2.17 O ATOM 997 CG2 THR A 68 7.445 2.403 -6.478 1.00 1.40 C ATOM 0 H THR A 68 5.300 2.364 -4.639 1.00 0.52 H new ATOM 0 HA THR A 68 4.948 2.654 -7.495 1.00 0.58 H new ATOM 0 HB THR A 68 6.533 0.653 -7.316 1.00 0.80 H new ATOM 0 HG1 THR A 68 5.503 0.210 -5.097 1.00 2.17 H new ATOM 0 HG21 THR A 68 8.419 1.927 -6.366 1.00 1.40 H new ATOM 0 HG22 THR A 68 7.417 2.956 -7.417 1.00 1.40 H new ATOM 0 HG23 THR A 68 7.279 3.089 -5.648 1.00 1.40 H new ATOM 1005 N TYR A 69 3.387 0.761 -8.068 1.00 0.70 N ATOM 1006 CA TYR A 69 2.390 -0.257 -8.319 1.00 0.72 C ATOM 1007 C TYR A 69 3.057 -1.632 -8.350 1.00 0.60 C ATOM 1008 O TYR A 69 4.037 -1.851 -9.061 1.00 0.65 O ATOM 1009 CB TYR A 69 1.703 0.041 -9.657 1.00 0.83 C ATOM 1010 CG TYR A 69 2.570 -0.132 -10.901 1.00 0.93 C ATOM 1011 CD1 TYR A 69 2.639 -1.389 -11.528 1.00 2.36 C ATOM 1012 CD2 TYR A 69 3.389 0.910 -11.376 1.00 1.46 C ATOM 1013 CE1 TYR A 69 3.459 -1.584 -12.651 1.00 2.59 C ATOM 1014 CE2 TYR A 69 4.229 0.712 -12.485 1.00 1.43 C ATOM 1015 CZ TYR A 69 4.255 -0.536 -13.130 1.00 1.38 C ATOM 1016 OH TYR A 69 5.118 -0.770 -14.157 1.00 1.72 O ATOM 0 H TYR A 69 3.632 1.334 -8.876 1.00 0.70 H new ATOM 0 HA TYR A 69 1.643 -0.255 -7.525 1.00 0.72 H new ATOM 0 HB2 TYR A 69 0.833 -0.609 -9.750 1.00 0.83 H new ATOM 0 HB3 TYR A 69 1.334 1.066 -9.634 1.00 0.83 H new ATOM 0 HD1 TYR A 69 2.056 -2.212 -11.142 1.00 2.36 H new ATOM 0 HD2 TYR A 69 3.372 1.871 -10.883 1.00 1.46 H new ATOM 0 HE1 TYR A 69 3.476 -2.544 -13.146 1.00 2.59 H new ATOM 0 HE2 TYR A 69 4.854 1.518 -12.841 1.00 1.43 H new ATOM 0 HH TYR A 69 5.598 0.056 -14.376 1.00 1.72 H new ATOM 1026 N THR A 70 2.533 -2.556 -7.551 1.00 0.57 N ATOM 1027 CA THR A 70 2.800 -3.981 -7.632 1.00 0.62 C ATOM 1028 C THR A 70 1.604 -4.681 -6.984 1.00 0.64 C ATOM 1029 O THR A 70 1.570 -4.839 -5.765 1.00 0.69 O ATOM 1030 CB THR A 70 4.149 -4.318 -6.963 1.00 0.79 C ATOM 1031 OG1 THR A 70 5.213 -3.924 -7.811 1.00 1.16 O ATOM 1032 CG2 THR A 70 4.351 -5.817 -6.714 1.00 0.97 C ATOM 0 H THR A 70 1.885 -2.319 -6.800 1.00 0.57 H new ATOM 0 HA THR A 70 2.903 -4.325 -8.661 1.00 0.62 H new ATOM 0 HB THR A 70 4.139 -3.790 -6.009 1.00 0.79 H new ATOM 0 HG1 THR A 70 4.866 -3.353 -8.527 1.00 1.16 H new ATOM 0 HG21 THR A 70 5.320 -5.980 -6.242 1.00 0.97 H new ATOM 0 HG22 THR A 70 3.561 -6.187 -6.060 1.00 0.97 H new ATOM 0 HG23 THR A 70 4.316 -6.352 -7.663 1.00 0.97 H new ATOM 1040 N ILE A 71 0.597 -5.044 -7.793 1.00 0.71 N ATOM 1041 CA ILE A 71 -0.507 -5.893 -7.347 1.00 0.82 C ATOM 1042 C ILE A 71 -0.810 -6.977 -8.395 1.00 0.95 C ATOM 1043 O ILE A 71 -1.199 -6.673 -9.521 1.00 1.31 O ATOM 1044 CB ILE A 71 -1.749 -5.073 -6.905 1.00 0.85 C ATOM 1045 CG1 ILE A 71 -2.921 -5.111 -7.901 1.00 1.03 C ATOM 1046 CG2 ILE A 71 -1.423 -3.633 -6.495 1.00 0.93 C ATOM 1047 CD1 ILE A 71 -4.090 -4.196 -7.523 1.00 2.00 C ATOM 0 H ILE A 71 0.529 -4.756 -8.769 1.00 0.71 H new ATOM 0 HA ILE A 71 -0.195 -6.414 -6.442 1.00 0.82 H new ATOM 0 HB ILE A 71 -2.087 -5.594 -6.010 1.00 0.85 H new ATOM 0 HG12 ILE A 71 -2.555 -4.827 -8.888 1.00 1.03 H new ATOM 0 HG13 ILE A 71 -3.285 -6.135 -7.979 1.00 1.03 H new ATOM 0 HG21 ILE A 71 -2.340 -3.123 -6.199 1.00 0.93 H new ATOM 0 HG22 ILE A 71 -0.726 -3.642 -5.657 1.00 0.93 H new ATOM 0 HG23 ILE A 71 -0.971 -3.108 -7.337 1.00 0.93 H new ATOM 0 HD11 ILE A 71 -4.875 -4.280 -8.274 1.00 2.00 H new ATOM 0 HD12 ILE A 71 -4.485 -4.492 -6.551 1.00 2.00 H new ATOM 0 HD13 ILE A 71 -3.743 -3.164 -7.474 1.00 2.00 H new ATOM 1059 N ASP A 72 -0.646 -8.243 -8.023 1.00 0.76 N ATOM 1060 CA ASP A 72 -1.009 -9.409 -8.814 1.00 0.78 C ATOM 1061 C ASP A 72 -2.526 -9.585 -8.782 1.00 0.86 C ATOM 1062 O ASP A 72 -3.040 -10.410 -8.044 1.00 1.13 O ATOM 1063 CB ASP A 72 -0.298 -10.636 -8.214 1.00 1.01 C ATOM 1064 CG ASP A 72 -0.644 -10.799 -6.739 1.00 3.20 C ATOM 1065 OD1 ASP A 72 -0.266 -9.878 -5.982 1.00 4.40 O ATOM 1066 OD2 ASP A 72 -1.388 -11.742 -6.398 1.00 4.54 O ATOM 0 H ASP A 72 -0.238 -8.493 -7.122 1.00 0.76 H new ATOM 0 HA ASP A 72 -0.702 -9.288 -9.853 1.00 0.78 H new ATOM 0 HB2 ASP A 72 -0.589 -11.533 -8.761 1.00 1.01 H new ATOM 0 HB3 ASP A 72 0.781 -10.528 -8.329 1.00 1.01 H new ATOM 1071 N PHE A 73 -3.279 -8.820 -9.569 1.00 1.11 N ATOM 1072 CA PHE A 73 -4.744 -8.841 -9.571 1.00 1.20 C ATOM 1073 C PHE A 73 -5.424 -10.198 -9.339 1.00 1.37 C ATOM 1074 O PHE A 73 -6.495 -10.224 -8.738 1.00 1.56 O ATOM 1075 CB PHE A 73 -5.265 -8.320 -10.901 1.00 1.27 C ATOM 1076 CG PHE A 73 -5.034 -6.856 -11.174 1.00 1.36 C ATOM 1077 CD1 PHE A 73 -5.735 -5.905 -10.419 1.00 2.86 C ATOM 1078 CD2 PHE A 73 -4.344 -6.458 -12.331 1.00 1.58 C ATOM 1079 CE1 PHE A 73 -5.839 -4.581 -10.873 1.00 3.16 C ATOM 1080 CE2 PHE A 73 -4.480 -5.148 -12.809 1.00 1.66 C ATOM 1081 CZ PHE A 73 -5.234 -4.208 -12.086 1.00 1.97 C ATOM 0 H PHE A 73 -2.884 -8.156 -10.235 1.00 1.11 H new ATOM 0 HA PHE A 73 -4.998 -8.216 -8.715 1.00 1.20 H new ATOM 0 HB2 PHE A 73 -4.800 -8.896 -11.701 1.00 1.27 H new ATOM 0 HB3 PHE A 73 -6.337 -8.514 -10.950 1.00 1.27 H new ATOM 0 HD1 PHE A 73 -6.196 -6.192 -9.486 1.00 2.86 H new ATOM 0 HD2 PHE A 73 -3.710 -7.161 -12.851 1.00 1.58 H new ATOM 0 HE1 PHE A 73 -6.382 -3.851 -10.292 1.00 3.16 H new ATOM 0 HE2 PHE A 73 -4.004 -4.860 -13.735 1.00 1.66 H new ATOM 0 HZ PHE A 73 -5.348 -3.202 -12.461 1.00 1.97 H new ATOM 1091 N ALA A 74 -4.834 -11.294 -9.829 1.00 1.48 N ATOM 1092 CA ALA A 74 -5.368 -12.645 -9.694 1.00 1.73 C ATOM 1093 C ALA A 74 -5.636 -13.022 -8.233 1.00 1.43 C ATOM 1094 O ALA A 74 -6.517 -13.835 -7.964 1.00 1.47 O ATOM 1095 CB ALA A 74 -4.380 -13.640 -10.311 1.00 2.06 C ATOM 0 H ALA A 74 -3.953 -11.261 -10.341 1.00 1.48 H new ATOM 0 HA ALA A 74 -6.323 -12.680 -10.217 1.00 1.73 H new ATOM 0 HB1 ALA A 74 -4.774 -14.652 -10.213 1.00 2.06 H new ATOM 0 HB2 ALA A 74 -4.239 -13.406 -11.366 1.00 2.06 H new ATOM 0 HB3 ALA A 74 -3.423 -13.571 -9.793 1.00 2.06 H new ATOM 1101 N ALA A 75 -4.862 -12.452 -7.308 1.00 1.20 N ATOM 1102 CA ALA A 75 -4.933 -12.734 -5.878 1.00 0.99 C ATOM 1103 C ALA A 75 -4.719 -11.443 -5.080 1.00 0.84 C ATOM 1104 O ALA A 75 -5.447 -11.181 -4.124 1.00 1.12 O ATOM 1105 CB ALA A 75 -3.931 -13.836 -5.525 1.00 1.23 C ATOM 0 H ALA A 75 -4.149 -11.762 -7.543 1.00 1.20 H new ATOM 0 HA ALA A 75 -5.922 -13.104 -5.610 1.00 0.99 H new ATOM 0 HB1 ALA A 75 -3.984 -14.047 -4.457 1.00 1.23 H new ATOM 0 HB2 ALA A 75 -4.171 -14.739 -6.086 1.00 1.23 H new ATOM 0 HB3 ALA A 75 -2.924 -13.507 -5.781 1.00 1.23 H new ATOM 1111 N LYS A 76 -3.769 -10.609 -5.509 1.00 0.73 N ATOM 1112 CA LYS A 76 -3.671 -9.196 -5.205 1.00 0.73 C ATOM 1113 C LYS A 76 -2.986 -8.958 -3.870 1.00 0.76 C ATOM 1114 O LYS A 76 -3.541 -8.342 -2.962 1.00 0.93 O ATOM 1115 CB LYS A 76 -5.019 -8.484 -5.358 1.00 0.83 C ATOM 1116 CG LYS A 76 -4.789 -6.975 -5.521 1.00 1.50 C ATOM 1117 CD LYS A 76 -5.497 -6.109 -4.473 1.00 2.42 C ATOM 1118 CE LYS A 76 -7.000 -5.952 -4.697 1.00 3.02 C ATOM 1119 NZ LYS A 76 -7.348 -5.480 -6.051 1.00 3.69 N ATOM 0 H LYS A 76 -3.010 -10.928 -6.111 1.00 0.73 H new ATOM 0 HA LYS A 76 -3.022 -8.733 -5.949 1.00 0.73 H new ATOM 0 HB2 LYS A 76 -5.553 -8.876 -6.224 1.00 0.83 H new ATOM 0 HB3 LYS A 76 -5.644 -8.675 -4.485 1.00 0.83 H new ATOM 0 HG2 LYS A 76 -3.718 -6.776 -5.475 1.00 1.50 H new ATOM 0 HG3 LYS A 76 -5.127 -6.673 -6.512 1.00 1.50 H new ATOM 0 HD2 LYS A 76 -5.332 -6.545 -3.488 1.00 2.42 H new ATOM 0 HD3 LYS A 76 -5.038 -5.121 -4.465 1.00 2.42 H new ATOM 0 HE2 LYS A 76 -7.488 -6.910 -4.519 1.00 3.02 H new ATOM 0 HE3 LYS A 76 -7.397 -5.251 -3.963 1.00 3.02 H new ATOM 0 HZ1 LYS A 76 -8.278 -5.016 -6.028 1.00 3.69 H new ATOM 0 HZ2 LYS A 76 -6.630 -4.802 -6.377 1.00 3.69 H new ATOM 0 HZ3 LYS A 76 -7.381 -6.290 -6.703 1.00 3.69 H new ATOM 1133 N GLN A 77 -1.721 -9.352 -3.796 1.00 0.85 N ATOM 1134 CA GLN A 77 -0.859 -9.064 -2.659 1.00 0.90 C ATOM 1135 C GLN A 77 -0.332 -7.643 -2.842 1.00 0.98 C ATOM 1136 O GLN A 77 0.871 -7.398 -2.930 1.00 1.70 O ATOM 1137 CB GLN A 77 0.272 -10.092 -2.517 1.00 1.25 C ATOM 1138 CG GLN A 77 -0.204 -11.496 -2.121 1.00 2.40 C ATOM 1139 CD GLN A 77 -0.564 -12.313 -3.355 1.00 1.60 C ATOM 1140 OE1 GLN A 77 -1.794 -12.170 -3.833 1.00 1.83 O flip ATOM 1141 NE2 GLN A 77 0.278 -13.021 -3.898 1.00 1.72 N flip ATOM 0 H GLN A 77 -1.260 -9.886 -4.533 1.00 0.85 H new ATOM 0 HA GLN A 77 -1.423 -9.137 -1.729 1.00 0.90 H new ATOM 0 HB2 GLN A 77 0.811 -10.156 -3.462 1.00 1.25 H new ATOM 0 HB3 GLN A 77 0.981 -9.736 -1.769 1.00 1.25 H new ATOM 0 HG2 GLN A 77 0.578 -12.005 -1.558 1.00 2.40 H new ATOM 0 HG3 GLN A 77 -1.071 -11.419 -1.464 1.00 2.40 H new ATOM 0 HE21 GLN A 77 1.212 -13.102 -3.496 1.00 1.72 H new ATOM 0 HE22 GLN A 77 0.044 -13.528 -4.751 1.00 1.72 H new ATOM 1150 N GLY A 78 -1.269 -6.706 -2.969 1.00 0.96 N ATOM 1151 CA GLY A 78 -0.998 -5.364 -3.437 1.00 1.17 C ATOM 1152 C GLY A 78 -0.115 -4.633 -2.446 1.00 0.95 C ATOM 1153 O GLY A 78 -0.440 -4.563 -1.261 1.00 1.27 O ATOM 0 H GLY A 78 -2.251 -6.868 -2.744 1.00 0.96 H new ATOM 0 HA2 GLY A 78 -0.510 -5.402 -4.411 1.00 1.17 H new ATOM 0 HA3 GLY A 78 -1.934 -4.822 -3.570 1.00 1.17 H new ATOM 1157 N ASN A 79 1.011 -4.096 -2.910 1.00 0.70 N ATOM 1158 CA ASN A 79 1.937 -3.413 -2.038 1.00 0.69 C ATOM 1159 C ASN A 79 2.720 -2.427 -2.879 1.00 0.90 C ATOM 1160 O ASN A 79 2.767 -2.537 -4.105 1.00 1.60 O ATOM 1161 CB ASN A 79 2.875 -4.433 -1.373 1.00 0.82 C ATOM 1162 CG ASN A 79 2.760 -4.445 0.142 1.00 1.58 C ATOM 1163 OD1 ASN A 79 3.751 -4.253 0.834 1.00 3.15 O ATOM 1164 ND2 ASN A 79 1.568 -4.685 0.673 1.00 1.04 N ATOM 0 H ASN A 79 1.296 -4.126 -3.889 1.00 0.70 H new ATOM 0 HA ASN A 79 1.407 -2.884 -1.246 1.00 0.69 H new ATOM 0 HB2 ASN A 79 2.651 -5.428 -1.757 1.00 0.82 H new ATOM 0 HB3 ASN A 79 3.904 -4.208 -1.652 1.00 0.82 H new ATOM 0 HD21 ASN A 79 1.458 -4.714 1.687 1.00 1.04 H new ATOM 0 HD22 ASN A 79 0.762 -4.841 0.068 1.00 1.04 H new ATOM 1171 N GLY A 80 3.338 -1.466 -2.204 1.00 0.60 N ATOM 1172 CA GLY A 80 4.280 -0.561 -2.815 1.00 0.67 C ATOM 1173 C GLY A 80 5.157 -0.074 -1.685 1.00 0.74 C ATOM 1174 O GLY A 80 4.649 0.186 -0.595 1.00 0.94 O ATOM 0 H GLY A 80 3.192 -1.298 -1.208 1.00 0.60 H new ATOM 0 HA2 GLY A 80 4.869 -1.065 -3.581 1.00 0.67 H new ATOM 0 HA3 GLY A 80 3.768 0.269 -3.302 1.00 0.67 H new ATOM 1178 N LYS A 81 6.461 0.005 -1.914 1.00 0.78 N ATOM 1179 CA LYS A 81 7.368 0.368 -0.840 1.00 0.90 C ATOM 1180 C LYS A 81 7.328 1.877 -0.605 1.00 1.14 C ATOM 1181 O LYS A 81 7.258 2.660 -1.552 1.00 1.27 O ATOM 1182 CB LYS A 81 8.773 -0.166 -1.113 1.00 1.02 C ATOM 1183 CG LYS A 81 9.430 0.259 -2.430 1.00 1.48 C ATOM 1184 CD LYS A 81 10.898 -0.162 -2.304 1.00 2.25 C ATOM 1185 CE LYS A 81 11.705 0.029 -3.588 1.00 3.02 C ATOM 1186 NZ LYS A 81 13.143 -0.144 -3.309 1.00 4.05 N ATOM 0 H LYS A 81 6.905 -0.174 -2.815 1.00 0.78 H new ATOM 0 HA LYS A 81 7.042 -0.103 0.087 1.00 0.90 H new ATOM 0 HB2 LYS A 81 9.420 0.147 -0.294 1.00 1.02 H new ATOM 0 HB3 LYS A 81 8.733 -1.255 -1.089 1.00 1.02 H new ATOM 0 HG2 LYS A 81 8.953 -0.226 -3.282 1.00 1.48 H new ATOM 0 HG3 LYS A 81 9.341 1.334 -2.585 1.00 1.48 H new ATOM 0 HD2 LYS A 81 11.364 0.413 -1.504 1.00 2.25 H new ATOM 0 HD3 LYS A 81 10.942 -1.211 -2.010 1.00 2.25 H new ATOM 0 HE2 LYS A 81 11.383 -0.691 -4.341 1.00 3.02 H new ATOM 0 HE3 LYS A 81 11.522 1.022 -3.998 1.00 3.02 H new ATOM 0 HZ1 LYS A 81 13.664 -0.216 -4.206 1.00 4.05 H new ATOM 0 HZ2 LYS A 81 13.493 0.673 -2.769 1.00 4.05 H new ATOM 0 HZ3 LYS A 81 13.287 -1.012 -2.755 1.00 4.05 H new ATOM 1200 N ILE A 82 7.383 2.294 0.660 1.00 1.31 N ATOM 1201 CA ILE A 82 7.472 3.699 1.038 1.00 1.47 C ATOM 1202 C ILE A 82 8.946 4.089 0.923 1.00 1.32 C ATOM 1203 O ILE A 82 9.618 4.433 1.891 1.00 1.51 O ATOM 1204 CB ILE A 82 6.833 3.920 2.433 1.00 1.59 C ATOM 1205 CG1 ILE A 82 5.299 3.843 2.376 1.00 1.95 C ATOM 1206 CG2 ILE A 82 7.253 5.230 3.136 1.00 1.98 C ATOM 1207 CD1 ILE A 82 4.723 3.532 3.766 1.00 2.41 C ATOM 0 H ILE A 82 7.367 1.657 1.457 1.00 1.31 H new ATOM 0 HA ILE A 82 6.902 4.357 0.381 1.00 1.47 H new ATOM 0 HB ILE A 82 7.226 3.101 3.035 1.00 1.59 H new ATOM 0 HG12 ILE A 82 4.895 4.788 2.012 1.00 1.95 H new ATOM 0 HG13 ILE A 82 4.994 3.072 1.669 1.00 1.95 H new ATOM 0 HG21 ILE A 82 6.757 5.299 4.104 1.00 1.98 H new ATOM 0 HG22 ILE A 82 8.333 5.235 3.281 1.00 1.98 H new ATOM 0 HG23 ILE A 82 6.965 6.082 2.520 1.00 1.98 H new ATOM 0 HD11 ILE A 82 3.636 3.481 3.706 1.00 2.41 H new ATOM 0 HD12 ILE A 82 5.112 2.576 4.116 1.00 2.41 H new ATOM 0 HD13 ILE A 82 5.012 4.318 4.464 1.00 2.41 H new ATOM 1219 N GLU A 83 9.425 4.075 -0.319 1.00 1.27 N ATOM 1220 CA GLU A 83 10.587 4.834 -0.735 1.00 1.30 C ATOM 1221 C GLU A 83 10.060 6.270 -0.939 1.00 2.13 C ATOM 1222 O GLU A 83 8.845 6.469 -1.021 1.00 3.66 O ATOM 1223 CB GLU A 83 11.166 4.106 -1.956 1.00 1.40 C ATOM 1224 CG GLU A 83 12.682 4.270 -2.093 1.00 1.50 C ATOM 1225 CD GLU A 83 13.240 3.374 -3.180 1.00 1.96 C ATOM 1226 OE1 GLU A 83 13.077 3.763 -4.357 1.00 3.04 O ATOM 1227 OE2 GLU A 83 13.770 2.298 -2.828 1.00 2.07 O ATOM 0 H GLU A 83 9.006 3.526 -1.070 1.00 1.27 H new ATOM 0 HA GLU A 83 11.421 4.908 -0.038 1.00 1.30 H new ATOM 0 HB2 GLU A 83 10.927 3.045 -1.885 1.00 1.40 H new ATOM 0 HB3 GLU A 83 10.683 4.482 -2.858 1.00 1.40 H new ATOM 0 HG2 GLU A 83 12.918 5.310 -2.320 1.00 1.50 H new ATOM 0 HG3 GLU A 83 13.162 4.034 -1.143 1.00 1.50 H new ATOM 1234 N HIS A 84 10.867 7.335 -0.893 1.00 1.39 N ATOM 1235 CA HIS A 84 12.265 7.505 -1.246 1.00 1.06 C ATOM 1236 C HIS A 84 12.737 8.706 -0.425 1.00 0.90 C ATOM 1237 O HIS A 84 12.838 9.829 -0.911 1.00 1.24 O ATOM 1238 CB HIS A 84 12.449 7.737 -2.767 1.00 1.81 C ATOM 1239 CG HIS A 84 11.452 7.082 -3.694 1.00 2.96 C ATOM 1240 ND1 HIS A 84 11.670 6.034 -4.567 1.00 4.86 N ATOM 1241 CD2 HIS A 84 10.172 7.515 -3.886 1.00 2.88 C ATOM 1242 CE1 HIS A 84 10.534 5.848 -5.258 1.00 5.84 C ATOM 1243 NE2 HIS A 84 9.590 6.727 -4.882 1.00 4.68 N ATOM 0 H HIS A 84 10.490 8.221 -0.557 1.00 1.39 H new ATOM 0 HA HIS A 84 12.850 6.612 -1.026 1.00 1.06 H new ATOM 0 HB2 HIS A 84 12.424 8.811 -2.950 1.00 1.81 H new ATOM 0 HB3 HIS A 84 13.445 7.390 -3.043 1.00 1.81 H new ATOM 0 HD1 HIS A 84 12.534 5.501 -4.668 1.00 4.86 H new ATOM 0 HD2 HIS A 84 9.692 8.326 -3.359 1.00 2.88 H new ATOM 0 HE1 HIS A 84 10.397 5.091 -6.016 1.00 5.84 H new ATOM 1251 N LEU A 85 12.850 8.492 0.881 1.00 0.91 N ATOM 1252 CA LEU A 85 12.797 9.559 1.858 1.00 1.00 C ATOM 1253 C LEU A 85 14.179 10.096 2.177 1.00 1.17 C ATOM 1254 O LEU A 85 15.187 9.485 1.823 1.00 1.33 O ATOM 1255 CB LEU A 85 12.069 9.062 3.114 1.00 1.03 C ATOM 1256 CG LEU A 85 10.617 8.730 2.785 1.00 1.05 C ATOM 1257 CD1 LEU A 85 10.362 7.259 2.469 1.00 1.52 C ATOM 1258 CD2 LEU A 85 9.667 9.167 3.900 1.00 1.69 C ATOM 0 H LEU A 85 12.982 7.566 1.288 1.00 0.91 H new ATOM 0 HA LEU A 85 12.237 10.395 1.439 1.00 1.00 H new ATOM 0 HB2 LEU A 85 12.571 8.179 3.509 1.00 1.03 H new ATOM 0 HB3 LEU A 85 12.108 9.825 3.892 1.00 1.03 H new ATOM 0 HG LEU A 85 10.416 9.297 1.876 1.00 1.05 H new ATOM 0 HD11 LEU A 85 9.305 7.112 2.247 1.00 1.52 H new ATOM 0 HD12 LEU A 85 10.958 6.964 1.606 1.00 1.52 H new ATOM 0 HD13 LEU A 85 10.640 6.649 3.328 1.00 1.52 H new ATOM 0 HD21 LEU A 85 8.643 8.912 3.626 1.00 1.69 H new ATOM 0 HD22 LEU A 85 9.933 8.656 4.826 1.00 1.69 H new ATOM 0 HD23 LEU A 85 9.747 10.244 4.044 1.00 1.69 H new ATOM 1270 N LYS A 86 14.184 11.231 2.890 1.00 1.40 N ATOM 1271 CA LYS A 86 15.348 12.026 3.249 1.00 1.70 C ATOM 1272 C LYS A 86 16.470 11.195 3.874 1.00 1.45 C ATOM 1273 O LYS A 86 17.609 11.659 3.934 1.00 1.81 O ATOM 1274 CB LYS A 86 14.937 13.181 4.183 1.00 2.08 C ATOM 1275 CG LYS A 86 14.400 12.707 5.546 1.00 1.92 C ATOM 1276 CD LYS A 86 12.871 12.753 5.664 1.00 2.68 C ATOM 1277 CE LYS A 86 12.372 14.124 6.175 1.00 3.24 C ATOM 1278 NZ LYS A 86 10.907 14.156 6.372 1.00 4.49 N ATOM 0 H LYS A 86 13.319 11.636 3.249 1.00 1.40 H new ATOM 0 HA LYS A 86 15.750 12.437 2.323 1.00 1.70 H new ATOM 0 HB2 LYS A 86 15.798 13.830 4.346 1.00 2.08 H new ATOM 0 HB3 LYS A 86 14.173 13.782 3.690 1.00 2.08 H new ATOM 0 HG2 LYS A 86 14.737 11.686 5.723 1.00 1.92 H new ATOM 0 HG3 LYS A 86 14.834 13.326 6.331 1.00 1.92 H new ATOM 0 HD2 LYS A 86 12.426 12.544 4.691 1.00 2.68 H new ATOM 0 HD3 LYS A 86 12.536 11.969 6.343 1.00 2.68 H new ATOM 0 HE2 LYS A 86 12.867 14.359 7.117 1.00 3.24 H new ATOM 0 HE3 LYS A 86 12.657 14.899 5.463 1.00 3.24 H new ATOM 0 HZ1 LYS A 86 10.514 15.003 5.915 1.00 4.49 H new ATOM 0 HZ2 LYS A 86 10.481 13.306 5.951 1.00 4.49 H new ATOM 0 HZ3 LYS A 86 10.694 14.182 7.390 1.00 4.49 H new ATOM 1292 N SER A 87 16.152 10.010 4.407 1.00 1.05 N ATOM 1293 CA SER A 87 17.190 9.142 4.958 1.00 1.15 C ATOM 1294 C SER A 87 16.848 7.668 4.709 1.00 1.00 C ATOM 1295 O SER A 87 15.668 7.310 4.767 1.00 0.85 O ATOM 1296 CB SER A 87 17.420 9.485 6.438 1.00 1.42 C ATOM 1297 OG SER A 87 17.348 10.888 6.633 1.00 1.70 O ATOM 0 H SER A 87 15.204 9.639 4.467 1.00 1.05 H new ATOM 0 HA SER A 87 18.137 9.316 4.446 1.00 1.15 H new ATOM 0 HB2 SER A 87 16.673 8.986 7.055 1.00 1.42 H new ATOM 0 HB3 SER A 87 18.395 9.116 6.757 1.00 1.42 H new ATOM 0 HG SER A 87 17.495 11.095 7.580 1.00 1.70 H new ATOM 1303 N PRO A 88 17.832 6.815 4.373 1.00 1.23 N ATOM 1304 CA PRO A 88 17.597 5.433 3.966 1.00 1.26 C ATOM 1305 C PRO A 88 16.797 4.660 5.012 1.00 1.14 C ATOM 1306 O PRO A 88 15.958 3.835 4.658 1.00 1.37 O ATOM 1307 CB PRO A 88 18.980 4.819 3.719 1.00 1.64 C ATOM 1308 CG PRO A 88 19.925 5.713 4.520 1.00 1.79 C ATOM 1309 CD PRO A 88 19.261 7.085 4.422 1.00 1.59 C ATOM 0 HA PRO A 88 16.990 5.388 3.062 1.00 1.26 H new ATOM 0 HB2 PRO A 88 19.025 3.784 4.059 1.00 1.64 H new ATOM 0 HB3 PRO A 88 19.233 4.818 2.659 1.00 1.64 H new ATOM 0 HG2 PRO A 88 20.016 5.381 5.554 1.00 1.79 H new ATOM 0 HG3 PRO A 88 20.930 5.719 4.098 1.00 1.79 H new ATOM 0 HD2 PRO A 88 19.515 7.707 5.280 1.00 1.59 H new ATOM 0 HD3 PRO A 88 19.591 7.620 3.531 1.00 1.59 H new ATOM 1317 N GLU A 89 17.019 4.951 6.290 1.00 1.19 N ATOM 1318 CA GLU A 89 16.285 4.385 7.405 1.00 1.29 C ATOM 1319 C GLU A 89 14.780 4.591 7.221 1.00 1.15 C ATOM 1320 O GLU A 89 13.994 3.699 7.527 1.00 1.43 O ATOM 1321 CB GLU A 89 16.756 5.006 8.730 1.00 1.64 C ATOM 1322 CG GLU A 89 18.286 4.995 8.916 1.00 2.14 C ATOM 1323 CD GLU A 89 19.002 6.209 8.326 1.00 2.95 C ATOM 1324 OE1 GLU A 89 20.168 6.428 8.708 1.00 3.78 O ATOM 1325 OE2 GLU A 89 18.379 6.884 7.475 1.00 3.66 O ATOM 0 H GLU A 89 17.740 5.610 6.582 1.00 1.19 H new ATOM 0 HA GLU A 89 16.482 3.313 7.437 1.00 1.29 H new ATOM 0 HB2 GLU A 89 16.401 6.035 8.784 1.00 1.64 H new ATOM 0 HB3 GLU A 89 16.295 4.466 9.557 1.00 1.64 H new ATOM 0 HG2 GLU A 89 18.510 4.939 9.981 1.00 2.14 H new ATOM 0 HG3 GLU A 89 18.689 4.092 8.457 1.00 2.14 H new ATOM 1332 N LEU A 90 14.384 5.770 6.725 1.00 1.05 N ATOM 1333 CA LEU A 90 12.986 6.108 6.493 1.00 0.94 C ATOM 1334 C LEU A 90 12.438 5.390 5.258 1.00 0.79 C ATOM 1335 O LEU A 90 11.226 5.212 5.171 1.00 0.90 O ATOM 1336 CB LEU A 90 12.787 7.628 6.348 1.00 0.96 C ATOM 1337 CG LEU A 90 12.597 8.410 7.656 1.00 1.18 C ATOM 1338 CD1 LEU A 90 11.247 8.097 8.313 1.00 1.42 C ATOM 1339 CD2 LEU A 90 13.746 8.179 8.641 1.00 2.10 C ATOM 0 H LEU A 90 15.033 6.516 6.474 1.00 1.05 H new ATOM 0 HA LEU A 90 12.429 5.771 7.368 1.00 0.94 H new ATOM 0 HB2 LEU A 90 13.650 8.039 5.824 1.00 0.96 H new ATOM 0 HB3 LEU A 90 11.917 7.802 5.714 1.00 0.96 H new ATOM 0 HG LEU A 90 12.604 9.466 7.387 1.00 1.18 H new ATOM 0 HD11 LEU A 90 11.150 8.669 9.236 1.00 1.42 H new ATOM 0 HD12 LEU A 90 10.440 8.367 7.632 1.00 1.42 H new ATOM 0 HD13 LEU A 90 11.191 7.032 8.539 1.00 1.42 H new ATOM 0 HD21 LEU A 90 13.567 8.753 9.550 1.00 2.10 H new ATOM 0 HD22 LEU A 90 13.807 7.119 8.887 1.00 2.10 H new ATOM 0 HD23 LEU A 90 14.684 8.501 8.188 1.00 2.10 H new ATOM 1351 N ASN A 91 13.286 5.017 4.292 1.00 0.75 N ATOM 1352 CA ASN A 91 12.853 4.341 3.080 1.00 0.73 C ATOM 1353 C ASN A 91 12.362 2.945 3.484 1.00 0.74 C ATOM 1354 O ASN A 91 13.157 2.046 3.749 1.00 1.10 O ATOM 1355 CB ASN A 91 13.987 4.287 2.043 1.00 0.99 C ATOM 1356 CG ASN A 91 14.466 5.632 1.488 1.00 1.18 C ATOM 1357 OD1 ASN A 91 14.640 5.767 0.284 1.00 1.82 O ATOM 1358 ND2 ASN A 91 14.706 6.658 2.305 1.00 1.22 N ATOM 0 H ASN A 91 14.292 5.179 4.336 1.00 0.75 H new ATOM 0 HA ASN A 91 12.041 4.886 2.600 1.00 0.73 H new ATOM 0 HB2 ASN A 91 14.840 3.781 2.495 1.00 0.99 H new ATOM 0 HB3 ASN A 91 13.657 3.670 1.207 1.00 0.99 H new ATOM 0 HD21 ASN A 91 15.032 7.547 1.925 1.00 1.22 H new ATOM 0 HD22 ASN A 91 14.564 6.554 3.310 1.00 1.22 H new ATOM 1365 N VAL A 92 11.041 2.800 3.594 1.00 0.63 N ATOM 1366 CA VAL A 92 10.339 1.645 4.133 1.00 0.71 C ATOM 1367 C VAL A 92 9.951 0.708 2.997 1.00 0.66 C ATOM 1368 O VAL A 92 9.469 1.172 1.964 1.00 0.74 O ATOM 1369 CB VAL A 92 9.076 2.159 4.854 1.00 0.73 C ATOM 1370 CG1 VAL A 92 7.909 1.173 4.927 1.00 1.03 C ATOM 1371 CG2 VAL A 92 9.354 2.605 6.275 1.00 1.08 C ATOM 0 H VAL A 92 10.399 3.532 3.290 1.00 0.63 H new ATOM 0 HA VAL A 92 10.973 1.096 4.829 1.00 0.71 H new ATOM 0 HB VAL A 92 8.783 2.996 4.220 1.00 0.73 H new ATOM 0 HG11 VAL A 92 7.074 1.636 5.453 1.00 1.03 H new ATOM 0 HG12 VAL A 92 7.597 0.903 3.918 1.00 1.03 H new ATOM 0 HG13 VAL A 92 8.223 0.276 5.462 1.00 1.03 H new ATOM 0 HG21 VAL A 92 8.430 2.957 6.733 1.00 1.08 H new ATOM 0 HG22 VAL A 92 9.748 1.766 6.849 1.00 1.08 H new ATOM 0 HG23 VAL A 92 10.085 3.413 6.266 1.00 1.08 H new ATOM 1381 N ASP A 93 10.047 -0.602 3.230 1.00 0.59 N ATOM 1382 CA ASP A 93 9.415 -1.617 2.392 1.00 0.54 C ATOM 1383 C ASP A 93 8.296 -2.248 3.216 1.00 0.67 C ATOM 1384 O ASP A 93 8.326 -2.162 4.440 1.00 0.82 O ATOM 1385 CB ASP A 93 10.451 -2.663 1.941 1.00 0.56 C ATOM 1386 CG ASP A 93 10.934 -2.417 0.516 1.00 1.20 C ATOM 1387 OD1 ASP A 93 10.357 -3.055 -0.388 1.00 1.70 O ATOM 1388 OD2 ASP A 93 11.860 -1.595 0.338 1.00 2.76 O ATOM 0 H ASP A 93 10.571 -0.990 4.014 1.00 0.59 H new ATOM 0 HA ASP A 93 9.003 -1.177 1.484 1.00 0.54 H new ATOM 0 HB2 ASP A 93 11.303 -2.644 2.620 1.00 0.56 H new ATOM 0 HB3 ASP A 93 10.012 -3.659 2.008 1.00 0.56 H new ATOM 1393 N LEU A 94 7.288 -2.843 2.573 1.00 0.80 N ATOM 1394 CA LEU A 94 6.175 -3.485 3.270 1.00 1.08 C ATOM 1395 C LEU A 94 5.925 -4.906 2.773 1.00 0.91 C ATOM 1396 O LEU A 94 6.420 -5.315 1.724 1.00 1.01 O ATOM 1397 CB LEU A 94 4.886 -2.631 3.299 1.00 1.59 C ATOM 1398 CG LEU A 94 4.725 -1.535 2.237 1.00 1.00 C ATOM 1399 CD1 LEU A 94 3.232 -1.211 2.082 1.00 1.47 C ATOM 1400 CD2 LEU A 94 5.424 -0.235 2.641 1.00 2.14 C ATOM 0 H LEU A 94 7.222 -2.892 1.556 1.00 0.80 H new ATOM 0 HA LEU A 94 6.488 -3.565 4.311 1.00 1.08 H new ATOM 0 HB2 LEU A 94 4.035 -3.307 3.213 1.00 1.59 H new ATOM 0 HB3 LEU A 94 4.820 -2.159 4.279 1.00 1.59 H new ATOM 0 HG LEU A 94 5.168 -1.909 1.314 1.00 1.00 H new ATOM 0 HD11 LEU A 94 3.105 -0.433 1.329 1.00 1.47 H new ATOM 0 HD12 LEU A 94 2.695 -2.107 1.771 1.00 1.47 H new ATOM 0 HD13 LEU A 94 2.834 -0.862 3.035 1.00 1.47 H new ATOM 0 HD21 LEU A 94 5.283 0.512 1.860 1.00 2.14 H new ATOM 0 HD22 LEU A 94 4.998 0.132 3.575 1.00 2.14 H new ATOM 0 HD23 LEU A 94 6.489 -0.422 2.777 1.00 2.14 H new ATOM 1412 N ALA A 95 5.188 -5.666 3.586 1.00 0.84 N ATOM 1413 CA ALA A 95 4.859 -7.053 3.325 1.00 0.92 C ATOM 1414 C ALA A 95 3.709 -7.132 2.325 1.00 0.81 C ATOM 1415 O ALA A 95 2.658 -6.518 2.525 1.00 0.94 O ATOM 1416 CB ALA A 95 4.481 -7.747 4.636 1.00 1.16 C ATOM 0 H ALA A 95 4.798 -5.318 4.462 1.00 0.84 H new ATOM 0 HA ALA A 95 5.725 -7.559 2.898 1.00 0.92 H new ATOM 0 HB1 ALA A 95 4.234 -8.790 4.438 1.00 1.16 H new ATOM 0 HB2 ALA A 95 5.321 -7.699 5.329 1.00 1.16 H new ATOM 0 HB3 ALA A 95 3.618 -7.247 5.077 1.00 1.16 H new ATOM 1422 N ALA A 96 3.899 -7.942 1.281 1.00 0.86 N ATOM 1423 CA ALA A 96 2.932 -8.139 0.217 1.00 1.02 C ATOM 1424 C ALA A 96 1.837 -9.064 0.744 1.00 0.92 C ATOM 1425 O ALA A 96 1.889 -10.281 0.586 1.00 1.73 O ATOM 1426 CB ALA A 96 3.646 -8.703 -1.013 1.00 1.45 C ATOM 0 H ALA A 96 4.751 -8.488 1.156 1.00 0.86 H new ATOM 0 HA ALA A 96 2.467 -7.202 -0.090 1.00 1.02 H new ATOM 0 HB1 ALA A 96 2.924 -8.853 -1.816 1.00 1.45 H new ATOM 0 HB2 ALA A 96 4.413 -8.002 -1.341 1.00 1.45 H new ATOM 0 HB3 ALA A 96 4.110 -9.656 -0.759 1.00 1.45 H new ATOM 1432 N ALA A 97 0.882 -8.449 1.436 1.00 0.79 N ATOM 1433 CA ALA A 97 -0.172 -9.104 2.189 1.00 0.67 C ATOM 1434 C ALA A 97 -1.472 -9.157 1.396 1.00 0.84 C ATOM 1435 O ALA A 97 -1.690 -8.356 0.489 1.00 1.13 O ATOM 1436 CB ALA A 97 -0.406 -8.324 3.477 1.00 0.91 C ATOM 0 H ALA A 97 0.823 -7.432 1.486 1.00 0.79 H new ATOM 0 HA ALA A 97 0.137 -10.127 2.403 1.00 0.67 H new ATOM 0 HB1 ALA A 97 -1.196 -8.804 4.055 1.00 0.91 H new ATOM 0 HB2 ALA A 97 0.513 -8.306 4.063 1.00 0.91 H new ATOM 0 HB3 ALA A 97 -0.702 -7.303 3.235 1.00 0.91 H new ATOM 1442 N ASP A 98 -2.344 -10.091 1.777 1.00 0.99 N ATOM 1443 CA ASP A 98 -3.557 -10.399 1.044 1.00 1.16 C ATOM 1444 C ASP A 98 -4.670 -9.384 1.326 1.00 1.27 C ATOM 1445 O ASP A 98 -4.591 -8.573 2.251 1.00 1.62 O ATOM 1446 CB ASP A 98 -4.074 -11.788 1.448 1.00 1.62 C ATOM 1447 CG ASP A 98 -3.084 -12.935 1.308 1.00 2.01 C ATOM 1448 OD1 ASP A 98 -3.258 -13.903 2.086 1.00 3.01 O ATOM 1449 OD2 ASP A 98 -2.209 -12.849 0.425 1.00 2.93 O ATOM 0 H ASP A 98 -2.220 -10.658 2.615 1.00 0.99 H new ATOM 0 HA ASP A 98 -3.305 -10.366 -0.016 1.00 1.16 H new ATOM 0 HB2 ASP A 98 -4.403 -11.743 2.486 1.00 1.62 H new ATOM 0 HB3 ASP A 98 -4.952 -12.017 0.844 1.00 1.62 H new ATOM 1454 N ILE A 99 -5.745 -9.520 0.545 1.00 1.15 N ATOM 1455 CA ILE A 99 -7.040 -8.886 0.713 1.00 1.20 C ATOM 1456 C ILE A 99 -8.055 -9.972 1.083 1.00 1.56 C ATOM 1457 O ILE A 99 -8.597 -9.948 2.186 1.00 3.45 O ATOM 1458 CB ILE A 99 -7.387 -8.078 -0.555 1.00 0.85 C ATOM 1459 CG1 ILE A 99 -8.891 -7.881 -0.786 1.00 0.95 C ATOM 1460 CG2 ILE A 99 -6.752 -8.629 -1.840 1.00 0.99 C ATOM 1461 CD1 ILE A 99 -9.133 -6.484 -1.359 1.00 1.14 C ATOM 0 H ILE A 99 -5.723 -10.121 -0.279 1.00 1.15 H new ATOM 0 HA ILE A 99 -7.045 -8.160 1.526 1.00 1.20 H new ATOM 0 HB ILE A 99 -6.946 -7.105 -0.341 1.00 0.85 H new ATOM 0 HG12 ILE A 99 -9.268 -8.639 -1.473 1.00 0.95 H new ATOM 0 HG13 ILE A 99 -9.434 -8.002 0.151 1.00 0.95 H new ATOM 0 HG21 ILE A 99 -7.044 -8.006 -2.686 1.00 0.99 H new ATOM 0 HG22 ILE A 99 -5.666 -8.622 -1.741 1.00 0.99 H new ATOM 0 HG23 ILE A 99 -7.095 -9.650 -2.006 1.00 0.99 H new ATOM 0 HD11 ILE A 99 -10.200 -6.339 -1.525 1.00 1.14 H new ATOM 0 HD12 ILE A 99 -8.770 -5.734 -0.656 1.00 1.14 H new ATOM 0 HD13 ILE A 99 -8.601 -6.382 -2.305 1.00 1.14 H new ATOM 1473 N LYS A 100 -8.275 -10.946 0.188 1.00 1.42 N ATOM 1474 CA LYS A 100 -9.201 -12.060 0.391 1.00 1.51 C ATOM 1475 C LYS A 100 -10.662 -11.587 0.496 1.00 1.54 C ATOM 1476 O LYS A 100 -10.917 -10.383 0.532 1.00 2.25 O ATOM 1477 CB LYS A 100 -8.681 -12.970 1.532 1.00 2.04 C ATOM 1478 CG LYS A 100 -7.643 -13.950 0.949 1.00 3.49 C ATOM 1479 CD LYS A 100 -6.359 -14.101 1.769 1.00 4.51 C ATOM 1480 CE LYS A 100 -6.275 -15.346 2.654 1.00 5.54 C ATOM 1481 NZ LYS A 100 -4.960 -15.386 3.330 1.00 7.02 N ATOM 0 H LYS A 100 -7.802 -10.978 -0.715 1.00 1.42 H new ATOM 0 HA LYS A 100 -9.227 -12.699 -0.492 1.00 1.51 H new ATOM 0 HB2 LYS A 100 -8.230 -12.367 2.320 1.00 2.04 H new ATOM 0 HB3 LYS A 100 -9.507 -13.519 1.984 1.00 2.04 H new ATOM 0 HG2 LYS A 100 -8.109 -14.930 0.848 1.00 3.49 H new ATOM 0 HG3 LYS A 100 -7.378 -13.619 -0.055 1.00 3.49 H new ATOM 0 HD2 LYS A 100 -5.512 -14.108 1.083 1.00 4.51 H new ATOM 0 HD3 LYS A 100 -6.249 -13.221 2.402 1.00 4.51 H new ATOM 0 HE2 LYS A 100 -7.075 -15.333 3.394 1.00 5.54 H new ATOM 0 HE3 LYS A 100 -6.413 -16.243 2.051 1.00 5.54 H new ATOM 0 HZ1 LYS A 100 -4.457 -16.255 3.059 1.00 7.02 H new ATOM 0 HZ2 LYS A 100 -4.398 -14.558 3.046 1.00 7.02 H new ATOM 0 HZ3 LYS A 100 -5.099 -15.373 4.361 1.00 7.02 H new ATOM 1495 N PRO A 101 -11.653 -12.496 0.409 1.00 2.22 N ATOM 1496 CA PRO A 101 -13.053 -12.106 0.322 1.00 2.79 C ATOM 1497 C PRO A 101 -13.594 -11.522 1.631 1.00 1.92 C ATOM 1498 O PRO A 101 -14.385 -12.153 2.327 1.00 2.83 O ATOM 1499 CB PRO A 101 -13.820 -13.349 -0.151 1.00 4.51 C ATOM 1500 CG PRO A 101 -12.919 -14.501 0.285 1.00 4.83 C ATOM 1501 CD PRO A 101 -11.526 -13.911 0.082 1.00 3.60 C ATOM 0 HA PRO A 101 -13.181 -11.289 -0.389 1.00 2.79 H new ATOM 0 HB2 PRO A 101 -14.806 -13.413 0.309 1.00 4.51 H new ATOM 0 HB3 PRO A 101 -13.971 -13.342 -1.230 1.00 4.51 H new ATOM 0 HG2 PRO A 101 -13.094 -14.785 1.323 1.00 4.83 H new ATOM 0 HG3 PRO A 101 -13.076 -15.393 -0.321 1.00 4.83 H new ATOM 0 HD2 PRO A 101 -10.795 -14.399 0.727 1.00 3.60 H new ATOM 0 HD3 PRO A 101 -11.187 -14.048 -0.945 1.00 3.60 H new ATOM 1509 N ASP A 102 -13.268 -10.251 1.879 1.00 1.29 N ATOM 1510 CA ASP A 102 -14.173 -9.317 2.538 1.00 1.44 C ATOM 1511 C ASP A 102 -15.564 -9.457 1.901 1.00 1.50 C ATOM 1512 O ASP A 102 -16.572 -9.564 2.595 1.00 2.41 O ATOM 1513 CB ASP A 102 -13.610 -7.896 2.372 1.00 2.10 C ATOM 1514 CG ASP A 102 -14.658 -6.827 2.624 1.00 3.52 C ATOM 1515 OD1 ASP A 102 -15.570 -6.704 1.777 1.00 4.55 O ATOM 1516 OD2 ASP A 102 -14.563 -6.074 3.617 1.00 4.43 O ATOM 0 H ASP A 102 -12.367 -9.844 1.627 1.00 1.29 H new ATOM 0 HA ASP A 102 -14.262 -9.528 3.604 1.00 1.44 H new ATOM 0 HB2 ASP A 102 -12.777 -7.755 3.061 1.00 2.10 H new ATOM 0 HB3 ASP A 102 -13.212 -7.781 1.364 1.00 2.10 H new ATOM 1521 N GLY A 103 -15.587 -9.479 0.562 1.00 1.93 N ATOM 1522 CA GLY A 103 -16.765 -9.797 -0.229 1.00 2.63 C ATOM 1523 C GLY A 103 -17.332 -8.590 -0.971 1.00 2.44 C ATOM 1524 O GLY A 103 -18.022 -8.746 -1.981 1.00 3.90 O ATOM 0 H GLY A 103 -14.766 -9.271 -0.006 1.00 1.93 H new ATOM 0 HA2 GLY A 103 -16.512 -10.574 -0.951 1.00 2.63 H new ATOM 0 HA3 GLY A 103 -17.534 -10.208 0.425 1.00 2.63 H new ATOM 1528 N LYS A 104 -17.054 -7.382 -0.486 1.00 1.41 N ATOM 1529 CA LYS A 104 -17.847 -6.186 -0.761 1.00 1.53 C ATOM 1530 C LYS A 104 -17.400 -5.499 -2.036 1.00 1.68 C ATOM 1531 O LYS A 104 -16.978 -4.346 -2.050 1.00 2.62 O ATOM 1532 CB LYS A 104 -17.663 -5.285 0.437 1.00 1.80 C ATOM 1533 CG LYS A 104 -18.392 -3.955 0.418 1.00 2.58 C ATOM 1534 CD LYS A 104 -18.470 -3.489 1.861 1.00 2.99 C ATOM 1535 CE LYS A 104 -17.131 -3.451 2.640 1.00 3.95 C ATOM 1536 NZ LYS A 104 -16.708 -4.771 3.176 1.00 4.73 N ATOM 0 H LYS A 104 -16.255 -7.203 0.122 1.00 1.41 H new ATOM 0 HA LYS A 104 -18.896 -6.439 -0.914 1.00 1.53 H new ATOM 0 HB2 LYS A 104 -17.981 -5.833 1.324 1.00 1.80 H new ATOM 0 HB3 LYS A 104 -16.597 -5.085 0.550 1.00 1.80 H new ATOM 0 HG2 LYS A 104 -17.860 -3.229 -0.196 1.00 2.58 H new ATOM 0 HG3 LYS A 104 -19.389 -4.064 -0.009 1.00 2.58 H new ATOM 0 HD2 LYS A 104 -18.903 -2.489 1.875 1.00 2.99 H new ATOM 0 HD3 LYS A 104 -19.159 -4.143 2.396 1.00 2.99 H new ATOM 0 HE2 LYS A 104 -16.350 -3.070 1.982 1.00 3.95 H new ATOM 0 HE3 LYS A 104 -17.223 -2.747 3.467 1.00 3.95 H new ATOM 0 HZ1 LYS A 104 -15.767 -4.684 3.610 1.00 4.73 H new ATOM 0 HZ2 LYS A 104 -17.391 -5.090 3.892 1.00 4.73 H new ATOM 0 HZ3 LYS A 104 -16.670 -5.464 2.402 1.00 4.73 H new ATOM 1550 N ARG A 105 -17.430 -6.261 -3.113 1.00 1.62 N ATOM 1551 CA ARG A 105 -16.661 -5.939 -4.285 1.00 1.77 C ATOM 1552 C ARG A 105 -15.225 -5.520 -3.956 1.00 1.63 C ATOM 1553 O ARG A 105 -14.682 -4.619 -4.588 1.00 2.28 O ATOM 1554 CB ARG A 105 -17.380 -4.967 -5.231 1.00 2.23 C ATOM 1555 CG ARG A 105 -18.767 -5.440 -5.703 1.00 3.01 C ATOM 1556 CD ARG A 105 -18.751 -6.900 -6.185 1.00 4.56 C ATOM 1557 NE ARG A 105 -19.883 -7.229 -7.074 1.00 5.60 N ATOM 1558 CZ ARG A 105 -19.776 -7.498 -8.390 1.00 6.67 C ATOM 1559 NH1 ARG A 105 -18.693 -7.124 -9.069 1.00 6.87 N ATOM 1560 NH2 ARG A 105 -20.755 -8.153 -9.024 1.00 7.93 N ATOM 0 H ARG A 105 -17.986 -7.113 -3.194 1.00 1.62 H new ATOM 0 HA ARG A 105 -16.572 -6.868 -4.848 1.00 1.77 H new ATOM 0 HB2 ARG A 105 -17.490 -4.006 -4.728 1.00 2.23 H new ATOM 0 HB3 ARG A 105 -16.751 -4.799 -6.105 1.00 2.23 H new ATOM 0 HG2 ARG A 105 -19.481 -5.337 -4.886 1.00 3.01 H new ATOM 0 HG3 ARG A 105 -19.113 -4.796 -6.512 1.00 3.01 H new ATOM 0 HD2 ARG A 105 -17.816 -7.092 -6.711 1.00 4.56 H new ATOM 0 HD3 ARG A 105 -18.772 -7.562 -5.320 1.00 4.56 H new ATOM 0 HE ARG A 105 -20.815 -7.255 -6.661 1.00 5.60 H new ATOM 0 HH11 ARG A 105 -17.938 -6.631 -8.593 1.00 6.87 H new ATOM 0 HH12 ARG A 105 -18.619 -7.331 -10.065 1.00 6.87 H new ATOM 0 HH21 ARG A 105 -21.585 -8.450 -8.511 1.00 7.93 H new ATOM 0 HH22 ARG A 105 -20.671 -8.355 -10.020 1.00 7.93 H new ATOM 1574 N HIS A 106 -14.631 -6.228 -2.989 1.00 1.57 N ATOM 1575 CA HIS A 106 -13.237 -6.162 -2.581 1.00 1.65 C ATOM 1576 C HIS A 106 -12.858 -4.835 -1.911 1.00 1.51 C ATOM 1577 O HIS A 106 -12.870 -3.771 -2.524 1.00 2.73 O ATOM 1578 CB HIS A 106 -12.319 -6.635 -3.713 1.00 2.45 C ATOM 1579 CG HIS A 106 -11.603 -5.595 -4.533 1.00 3.31 C ATOM 1580 ND1 HIS A 106 -12.148 -4.737 -5.459 1.00 4.51 N ATOM 1581 CD2 HIS A 106 -10.253 -5.550 -4.697 1.00 4.26 C ATOM 1582 CE1 HIS A 106 -11.135 -4.179 -6.145 1.00 5.62 C ATOM 1583 NE2 HIS A 106 -9.948 -4.668 -5.738 1.00 5.46 N ATOM 0 H HIS A 106 -15.155 -6.907 -2.437 1.00 1.57 H new ATOM 0 HA HIS A 106 -13.080 -6.873 -1.770 1.00 1.65 H new ATOM 0 HB2 HIS A 106 -11.566 -7.292 -3.278 1.00 2.45 H new ATOM 0 HB3 HIS A 106 -12.916 -7.242 -4.394 1.00 2.45 H new ATOM 0 HD1 HIS A 106 -13.142 -4.556 -5.600 1.00 4.51 H new ATOM 0 HD2 HIS A 106 -9.532 -6.107 -4.116 1.00 4.26 H new ATOM 0 HE1 HIS A 106 -11.257 -3.437 -6.920 1.00 5.62 H new ATOM 1591 N ALA A 107 -12.551 -4.908 -0.612 1.00 0.99 N ATOM 1592 CA ALA A 107 -12.417 -3.741 0.244 1.00 1.47 C ATOM 1593 C ALA A 107 -10.957 -3.306 0.373 1.00 1.24 C ATOM 1594 O ALA A 107 -10.556 -2.331 -0.259 1.00 1.46 O ATOM 1595 CB ALA A 107 -13.066 -4.048 1.594 1.00 2.40 C ATOM 0 H ALA A 107 -12.388 -5.791 -0.127 1.00 0.99 H new ATOM 0 HA ALA A 107 -12.934 -2.892 -0.203 1.00 1.47 H new ATOM 0 HB1 ALA A 107 -12.973 -3.181 2.248 1.00 2.40 H new ATOM 0 HB2 ALA A 107 -14.121 -4.280 1.446 1.00 2.40 H new ATOM 0 HB3 ALA A 107 -12.567 -4.902 2.052 1.00 2.40 H new ATOM 1601 N VAL A 108 -10.173 -3.994 1.213 1.00 1.02 N ATOM 1602 CA VAL A 108 -8.830 -3.562 1.580 1.00 0.89 C ATOM 1603 C VAL A 108 -7.888 -4.736 1.816 1.00 0.81 C ATOM 1604 O VAL A 108 -8.318 -5.842 2.140 1.00 0.94 O ATOM 1605 CB VAL A 108 -8.848 -2.684 2.844 1.00 1.01 C ATOM 1606 CG1 VAL A 108 -9.264 -1.254 2.518 1.00 1.28 C ATOM 1607 CG2 VAL A 108 -9.722 -3.261 3.967 1.00 1.12 C ATOM 0 H VAL A 108 -10.459 -4.868 1.655 1.00 1.02 H new ATOM 0 HA VAL A 108 -8.462 -2.982 0.734 1.00 0.89 H new ATOM 0 HB VAL A 108 -7.824 -2.674 3.218 1.00 1.01 H new ATOM 0 HG11 VAL A 108 -9.267 -0.659 3.431 1.00 1.28 H new ATOM 0 HG12 VAL A 108 -8.559 -0.823 1.807 1.00 1.28 H new ATOM 0 HG13 VAL A 108 -10.263 -1.256 2.083 1.00 1.28 H new ATOM 0 HG21 VAL A 108 -9.692 -2.595 4.830 1.00 1.12 H new ATOM 0 HG22 VAL A 108 -10.750 -3.355 3.616 1.00 1.12 H new ATOM 0 HG23 VAL A 108 -9.345 -4.243 4.253 1.00 1.12 H new ATOM 1617 N ILE A 109 -6.594 -4.446 1.683 1.00 0.80 N ATOM 1618 CA ILE A 109 -5.476 -5.251 2.131 1.00 0.75 C ATOM 1619 C ILE A 109 -5.161 -4.902 3.585 1.00 0.72 C ATOM 1620 O ILE A 109 -5.490 -3.805 4.041 1.00 0.90 O ATOM 1621 CB ILE A 109 -4.278 -4.965 1.204 1.00 0.90 C ATOM 1622 CG1 ILE A 109 -4.598 -5.532 -0.183 1.00 1.59 C ATOM 1623 CG2 ILE A 109 -2.934 -5.488 1.739 1.00 1.91 C ATOM 1624 CD1 ILE A 109 -3.506 -5.202 -1.189 1.00 2.22 C ATOM 0 H ILE A 109 -6.287 -3.585 1.229 1.00 0.80 H new ATOM 0 HA ILE A 109 -5.708 -6.315 2.086 1.00 0.75 H new ATOM 0 HB ILE A 109 -4.143 -3.885 1.151 1.00 0.90 H new ATOM 0 HG12 ILE A 109 -4.717 -6.613 -0.116 1.00 1.59 H new ATOM 0 HG13 ILE A 109 -5.548 -5.128 -0.531 1.00 1.59 H new ATOM 0 HG21 ILE A 109 -2.142 -5.247 1.030 1.00 1.91 H new ATOM 0 HG22 ILE A 109 -2.717 -5.019 2.699 1.00 1.91 H new ATOM 0 HG23 ILE A 109 -2.990 -6.569 1.868 1.00 1.91 H new ATOM 0 HD11 ILE A 109 -3.768 -5.620 -2.161 1.00 2.22 H new ATOM 0 HD12 ILE A 109 -3.405 -4.120 -1.275 1.00 2.22 H new ATOM 0 HD13 ILE A 109 -2.561 -5.629 -0.853 1.00 2.22 H new ATOM 1636 N SER A 110 -4.495 -5.817 4.295 1.00 0.65 N ATOM 1637 CA SER A 110 -3.939 -5.576 5.622 1.00 0.65 C ATOM 1638 C SER A 110 -2.450 -5.933 5.588 1.00 0.63 C ATOM 1639 O SER A 110 -2.081 -7.077 5.845 1.00 0.89 O ATOM 1640 CB SER A 110 -4.724 -6.398 6.653 1.00 0.78 C ATOM 1641 OG SER A 110 -4.381 -5.993 7.964 1.00 1.67 O ATOM 0 H SER A 110 -4.326 -6.763 3.954 1.00 0.65 H new ATOM 0 HA SER A 110 -4.028 -4.529 5.913 1.00 0.65 H new ATOM 0 HB2 SER A 110 -5.794 -6.269 6.493 1.00 0.78 H new ATOM 0 HB3 SER A 110 -4.508 -7.459 6.524 1.00 0.78 H new ATOM 0 HG SER A 110 -4.889 -6.523 8.613 1.00 1.67 H new ATOM 1647 N GLY A 111 -1.599 -4.972 5.213 1.00 0.60 N ATOM 1648 CA GLY A 111 -0.153 -5.133 5.174 1.00 0.72 C ATOM 1649 C GLY A 111 0.505 -4.610 6.449 1.00 0.60 C ATOM 1650 O GLY A 111 -0.150 -4.109 7.363 1.00 0.76 O ATOM 0 H GLY A 111 -1.909 -4.044 4.923 1.00 0.60 H new ATOM 0 HA2 GLY A 111 0.093 -6.187 5.043 1.00 0.72 H new ATOM 0 HA3 GLY A 111 0.250 -4.602 4.312 1.00 0.72 H new ATOM 1654 N SER A 112 1.824 -4.757 6.541 1.00 0.91 N ATOM 1655 CA SER A 112 2.630 -4.206 7.620 1.00 0.84 C ATOM 1656 C SER A 112 4.000 -3.868 7.041 1.00 0.60 C ATOM 1657 O SER A 112 4.351 -4.396 5.984 1.00 0.74 O ATOM 1658 CB SER A 112 2.695 -5.201 8.782 1.00 1.18 C ATOM 1659 OG SER A 112 1.422 -5.305 9.394 1.00 2.19 O ATOM 0 H SER A 112 2.371 -5.273 5.852 1.00 0.91 H new ATOM 0 HA SER A 112 2.193 -3.295 8.029 1.00 0.84 H new ATOM 0 HB2 SER A 112 3.016 -6.178 8.419 1.00 1.18 H new ATOM 0 HB3 SER A 112 3.435 -4.874 9.513 1.00 1.18 H new ATOM 0 HG SER A 112 0.766 -4.797 8.872 1.00 2.19 H new ATOM 1665 N VAL A 113 4.724 -2.945 7.681 1.00 0.60 N ATOM 1666 CA VAL A 113 5.876 -2.271 7.100 1.00 0.66 C ATOM 1667 C VAL A 113 7.150 -2.516 7.902 1.00 0.63 C ATOM 1668 O VAL A 113 7.108 -2.719 9.116 1.00 0.75 O ATOM 1669 CB VAL A 113 5.607 -0.768 6.863 1.00 0.87 C ATOM 1670 CG1 VAL A 113 4.113 -0.427 6.746 1.00 1.06 C ATOM 1671 CG2 VAL A 113 6.276 0.140 7.907 1.00 1.09 C ATOM 0 H VAL A 113 4.518 -2.644 8.634 1.00 0.60 H new ATOM 0 HA VAL A 113 6.042 -2.715 6.118 1.00 0.66 H new ATOM 0 HB VAL A 113 6.070 -0.564 5.898 1.00 0.87 H new ATOM 0 HG11 VAL A 113 3.996 0.644 6.580 1.00 1.06 H new ATOM 0 HG12 VAL A 113 3.680 -0.973 5.908 1.00 1.06 H new ATOM 0 HG13 VAL A 113 3.602 -0.710 7.666 1.00 1.06 H new ATOM 0 HG21 VAL A 113 6.048 1.182 7.683 1.00 1.09 H new ATOM 0 HG22 VAL A 113 5.900 -0.108 8.900 1.00 1.09 H new ATOM 0 HG23 VAL A 113 7.355 -0.009 7.880 1.00 1.09 H new ATOM 1681 N LEU A 114 8.277 -2.434 7.194 1.00 0.65 N ATOM 1682 CA LEU A 114 9.628 -2.515 7.714 1.00 0.75 C ATOM 1683 C LEU A 114 10.352 -1.212 7.382 1.00 0.78 C ATOM 1684 O LEU A 114 10.572 -0.864 6.221 1.00 0.84 O ATOM 1685 CB LEU A 114 10.289 -3.774 7.150 1.00 0.89 C ATOM 1686 CG LEU A 114 11.797 -3.982 7.332 1.00 1.07 C ATOM 1687 CD1 LEU A 114 12.602 -3.532 6.110 1.00 1.80 C ATOM 1688 CD2 LEU A 114 12.378 -3.474 8.647 1.00 3.12 C ATOM 0 H LEU A 114 8.262 -2.301 6.183 1.00 0.65 H new ATOM 0 HA LEU A 114 9.657 -2.614 8.799 1.00 0.75 H new ATOM 0 HB2 LEU A 114 9.785 -4.633 7.592 1.00 0.89 H new ATOM 0 HB3 LEU A 114 10.083 -3.800 6.080 1.00 0.89 H new ATOM 0 HG LEU A 114 11.906 -5.064 7.409 1.00 1.07 H new ATOM 0 HD11 LEU A 114 13.663 -3.701 6.291 1.00 1.80 H new ATOM 0 HD12 LEU A 114 12.288 -4.103 5.237 1.00 1.80 H new ATOM 0 HD13 LEU A 114 12.429 -2.471 5.931 1.00 1.80 H new ATOM 0 HD21 LEU A 114 13.450 -3.671 8.672 1.00 3.12 H new ATOM 0 HD22 LEU A 114 12.205 -2.401 8.731 1.00 3.12 H new ATOM 0 HD23 LEU A 114 11.896 -3.986 9.480 1.00 3.12 H new ATOM 1700 N TYR A 115 10.727 -0.505 8.445 1.00 0.90 N ATOM 1701 CA TYR A 115 11.512 0.719 8.440 1.00 1.07 C ATOM 1702 C TYR A 115 12.966 0.329 8.266 1.00 1.06 C ATOM 1703 O TYR A 115 13.742 0.419 9.212 1.00 1.20 O ATOM 1704 CB TYR A 115 11.274 1.538 9.732 1.00 1.31 C ATOM 1705 CG TYR A 115 10.344 2.717 9.570 1.00 1.86 C ATOM 1706 CD1 TYR A 115 10.757 3.795 8.774 1.00 3.26 C ATOM 1707 CD2 TYR A 115 9.120 2.784 10.257 1.00 2.95 C ATOM 1708 CE1 TYR A 115 9.870 4.844 8.500 1.00 4.45 C ATOM 1709 CE2 TYR A 115 8.315 3.927 10.124 1.00 4.19 C ATOM 1710 CZ TYR A 115 8.650 4.913 9.180 1.00 4.65 C ATOM 1711 OH TYR A 115 7.780 5.916 8.891 1.00 6.15 O ATOM 0 H TYR A 115 10.473 -0.793 9.390 1.00 0.90 H new ATOM 0 HA TYR A 115 11.210 1.367 7.618 1.00 1.07 H new ATOM 0 HB2 TYR A 115 10.869 0.875 10.496 1.00 1.31 H new ATOM 0 HB3 TYR A 115 12.235 1.898 10.100 1.00 1.31 H new ATOM 0 HD1 TYR A 115 11.759 3.817 8.372 1.00 3.26 H new ATOM 0 HD2 TYR A 115 8.801 1.963 10.882 1.00 2.95 H new ATOM 0 HE1 TYR A 115 10.127 5.595 7.768 1.00 4.45 H new ATOM 0 HE2 TYR A 115 7.440 4.048 10.746 1.00 4.19 H new ATOM 0 HH TYR A 115 7.528 5.868 7.945 1.00 6.15 H new ATOM 1721 N ASN A 116 13.305 -0.135 7.059 1.00 1.01 N ATOM 1722 CA ASN A 116 14.662 -0.405 6.586 1.00 1.11 C ATOM 1723 C ASN A 116 15.333 -1.579 7.316 1.00 1.02 C ATOM 1724 O ASN A 116 15.736 -2.547 6.677 1.00 1.14 O ATOM 1725 CB ASN A 116 15.473 0.896 6.621 1.00 1.42 C ATOM 1726 CG ASN A 116 16.911 0.723 6.142 1.00 2.17 C ATOM 1727 OD1 ASN A 116 17.704 0.023 6.765 1.00 2.96 O ATOM 1728 ND2 ASN A 116 17.276 1.401 5.060 1.00 2.81 N ATOM 0 H ASN A 116 12.602 -0.342 6.350 1.00 1.01 H new ATOM 0 HA ASN A 116 14.615 -0.744 5.551 1.00 1.11 H new ATOM 0 HB2 ASN A 116 14.977 1.642 5.999 1.00 1.42 H new ATOM 0 HB3 ASN A 116 15.481 1.284 7.640 1.00 1.42 H new ATOM 0 HD21 ASN A 116 18.238 1.348 4.726 1.00 2.81 H new ATOM 0 HD22 ASN A 116 16.594 1.974 4.563 1.00 2.81 H new ATOM 1735 N GLN A 117 15.438 -1.512 8.644 1.00 0.97 N ATOM 1736 CA GLN A 117 15.982 -2.538 9.518 1.00 1.08 C ATOM 1737 C GLN A 117 15.188 -2.663 10.832 1.00 1.47 C ATOM 1738 O GLN A 117 15.657 -3.320 11.757 1.00 2.22 O ATOM 1739 CB GLN A 117 17.480 -2.260 9.743 1.00 1.43 C ATOM 1740 CG GLN A 117 17.821 -1.155 10.760 1.00 1.80 C ATOM 1741 CD GLN A 117 17.099 0.175 10.548 1.00 1.92 C ATOM 1742 OE1 GLN A 117 16.384 0.634 11.432 1.00 3.16 O ATOM 1743 NE2 GLN A 117 17.271 0.815 9.396 1.00 1.69 N ATOM 0 H GLN A 117 15.126 -0.691 9.163 1.00 0.97 H new ATOM 0 HA GLN A 117 15.882 -3.511 9.037 1.00 1.08 H new ATOM 0 HB2 GLN A 117 17.955 -3.185 10.070 1.00 1.43 H new ATOM 0 HB3 GLN A 117 17.927 -1.994 8.785 1.00 1.43 H new ATOM 0 HG2 GLN A 117 17.588 -1.520 11.760 1.00 1.80 H new ATOM 0 HG3 GLN A 117 18.896 -0.975 10.729 1.00 1.80 H new ATOM 0 HE21 GLN A 117 17.871 0.414 8.675 1.00 1.69 H new ATOM 0 HE22 GLN A 117 16.804 1.707 9.233 1.00 1.69 H new ATOM 1752 N ALA A 118 13.998 -2.051 10.929 1.00 1.17 N ATOM 1753 CA ALA A 118 13.165 -2.066 12.130 1.00 1.38 C ATOM 1754 C ALA A 118 11.706 -2.281 11.742 1.00 1.21 C ATOM 1755 O ALA A 118 11.167 -1.501 10.964 1.00 1.27 O ATOM 1756 CB ALA A 118 13.295 -0.728 12.860 1.00 1.61 C ATOM 0 H ALA A 118 13.585 -1.524 10.159 1.00 1.17 H new ATOM 0 HA ALA A 118 13.494 -2.876 12.782 1.00 1.38 H new ATOM 0 HB1 ALA A 118 12.673 -0.740 13.755 1.00 1.61 H new ATOM 0 HB2 ALA A 118 14.335 -0.567 13.143 1.00 1.61 H new ATOM 0 HB3 ALA A 118 12.969 0.078 12.203 1.00 1.61 H new ATOM 1762 N GLU A 119 11.046 -3.313 12.271 1.00 1.30 N ATOM 1763 CA GLU A 119 9.631 -3.545 12.019 1.00 1.32 C ATOM 1764 C GLU A 119 8.821 -3.027 13.209 1.00 1.37 C ATOM 1765 O GLU A 119 8.882 -3.640 14.269 1.00 2.09 O ATOM 1766 CB GLU A 119 9.385 -5.049 11.811 1.00 1.72 C ATOM 1767 CG GLU A 119 7.981 -5.327 11.250 1.00 1.90 C ATOM 1768 CD GLU A 119 7.506 -6.729 11.608 1.00 2.68 C ATOM 1769 OE1 GLU A 119 8.074 -7.686 11.047 1.00 3.16 O ATOM 1770 OE2 GLU A 119 6.600 -6.816 12.470 1.00 3.61 O ATOM 0 H GLU A 119 11.479 -4.006 12.882 1.00 1.30 H new ATOM 0 HA GLU A 119 9.319 -3.015 11.119 1.00 1.32 H new ATOM 0 HB2 GLU A 119 10.135 -5.449 11.128 1.00 1.72 H new ATOM 0 HB3 GLU A 119 9.507 -5.572 12.760 1.00 1.72 H new ATOM 0 HG2 GLU A 119 7.279 -4.592 11.643 1.00 1.90 H new ATOM 0 HG3 GLU A 119 7.991 -5.210 10.166 1.00 1.90 H new ATOM 1777 N LYS A 120 8.044 -1.952 13.023 1.00 0.77 N ATOM 1778 CA LYS A 120 6.713 -1.744 13.585 1.00 0.66 C ATOM 1779 C LYS A 120 5.927 -0.710 12.774 1.00 0.68 C ATOM 1780 O LYS A 120 5.947 0.486 13.066 1.00 0.99 O ATOM 1781 CB LYS A 120 6.721 -1.400 15.082 1.00 1.01 C ATOM 1782 CG LYS A 120 6.755 -2.607 16.035 1.00 1.61 C ATOM 1783 CD LYS A 120 5.786 -3.743 15.682 1.00 1.92 C ATOM 1784 CE LYS A 120 6.379 -4.901 14.854 1.00 3.17 C ATOM 1785 NZ LYS A 120 5.445 -6.022 14.634 1.00 3.89 N ATOM 0 H LYS A 120 8.347 -1.167 12.446 1.00 0.77 H new ATOM 0 HA LYS A 120 6.201 -2.703 13.509 1.00 0.66 H new ATOM 0 HB2 LYS A 120 7.587 -0.771 15.288 1.00 1.01 H new ATOM 0 HB3 LYS A 120 5.835 -0.806 15.306 1.00 1.01 H new ATOM 0 HG2 LYS A 120 7.769 -3.007 16.053 1.00 1.61 H new ATOM 0 HG3 LYS A 120 6.531 -2.260 17.044 1.00 1.61 H new ATOM 0 HD2 LYS A 120 5.384 -4.153 16.609 1.00 1.92 H new ATOM 0 HD3 LYS A 120 4.946 -3.320 15.130 1.00 1.92 H new ATOM 0 HE2 LYS A 120 6.701 -4.515 13.887 1.00 3.17 H new ATOM 0 HE3 LYS A 120 7.269 -5.277 15.359 1.00 3.17 H new ATOM 0 HZ1 LYS A 120 5.726 -6.545 13.780 1.00 3.89 H new ATOM 0 HZ2 LYS A 120 5.469 -6.660 15.455 1.00 3.89 H new ATOM 0 HZ3 LYS A 120 4.481 -5.652 14.512 1.00 3.89 H new ATOM 1799 N GLY A 121 5.163 -1.186 11.790 1.00 0.51 N ATOM 1800 CA GLY A 121 4.061 -0.423 11.241 1.00 0.51 C ATOM 1801 C GLY A 121 3.038 -1.341 10.592 1.00 0.42 C ATOM 1802 O GLY A 121 3.417 -2.389 10.074 1.00 0.50 O ATOM 0 H GLY A 121 5.295 -2.102 11.361 1.00 0.51 H new ATOM 0 HA2 GLY A 121 3.585 0.157 12.032 1.00 0.51 H new ATOM 0 HA3 GLY A 121 4.436 0.288 10.505 1.00 0.51 H new ATOM 1806 N SER A 122 1.769 -0.942 10.608 1.00 0.62 N ATOM 1807 CA SER A 122 0.669 -1.561 9.885 1.00 0.63 C ATOM 1808 C SER A 122 0.305 -0.680 8.678 1.00 0.49 C ATOM 1809 O SER A 122 0.488 0.537 8.726 1.00 0.64 O ATOM 1810 CB SER A 122 -0.508 -1.755 10.849 1.00 0.91 C ATOM 1811 OG SER A 122 -0.379 -0.939 12.005 1.00 0.98 O ATOM 0 H SER A 122 1.468 -0.136 11.155 1.00 0.62 H new ATOM 0 HA SER A 122 0.948 -2.542 9.501 1.00 0.63 H new ATOM 0 HB2 SER A 122 -1.441 -1.517 10.338 1.00 0.91 H new ATOM 0 HB3 SER A 122 -0.566 -2.802 11.147 1.00 0.91 H new ATOM 0 HG SER A 122 -1.269 -0.675 12.320 1.00 0.98 H new ATOM 1817 N TYR A 123 -0.196 -1.276 7.587 1.00 0.53 N ATOM 1818 CA TYR A 123 -0.646 -0.556 6.397 1.00 0.68 C ATOM 1819 C TYR A 123 -1.922 -1.196 5.860 1.00 0.66 C ATOM 1820 O TYR A 123 -2.139 -2.393 6.034 1.00 0.62 O ATOM 1821 CB TYR A 123 0.486 -0.495 5.351 1.00 0.95 C ATOM 1822 CG TYR A 123 0.100 -0.484 3.874 1.00 0.74 C ATOM 1823 CD1 TYR A 123 0.369 0.645 3.076 1.00 1.97 C ATOM 1824 CD2 TYR A 123 -0.295 -1.683 3.249 1.00 1.57 C ATOM 1825 CE1 TYR A 123 0.302 0.558 1.674 1.00 2.28 C ATOM 1826 CE2 TYR A 123 -0.396 -1.762 1.849 1.00 1.76 C ATOM 1827 CZ TYR A 123 -0.061 -0.651 1.059 1.00 1.57 C ATOM 1828 OH TYR A 123 -0.073 -0.752 -0.300 1.00 2.10 O ATOM 0 H TYR A 123 -0.300 -2.288 7.510 1.00 0.53 H new ATOM 0 HA TYR A 123 -0.888 0.476 6.653 1.00 0.68 H new ATOM 0 HB2 TYR A 123 1.075 0.401 5.549 1.00 0.95 H new ATOM 0 HB3 TYR A 123 1.141 -1.350 5.518 1.00 0.95 H new ATOM 0 HD1 TYR A 123 0.628 1.583 3.544 1.00 1.97 H new ATOM 0 HD2 TYR A 123 -0.523 -2.550 3.851 1.00 1.57 H new ATOM 0 HE1 TYR A 123 0.530 1.423 1.069 1.00 2.28 H new ATOM 0 HE2 TYR A 123 -0.731 -2.676 1.382 1.00 1.76 H new ATOM 0 HH TYR A 123 -0.346 -1.657 -0.558 1.00 2.10 H new ATOM 1838 N SER A 124 -2.766 -0.409 5.189 1.00 0.83 N ATOM 1839 CA SER A 124 -3.986 -0.897 4.584 1.00 0.94 C ATOM 1840 C SER A 124 -4.229 -0.079 3.324 1.00 0.94 C ATOM 1841 O SER A 124 -3.980 1.127 3.302 1.00 1.19 O ATOM 1842 CB SER A 124 -5.147 -0.798 5.579 1.00 0.98 C ATOM 1843 OG SER A 124 -6.315 -1.371 5.030 1.00 2.21 O ATOM 0 H SER A 124 -2.612 0.590 5.055 1.00 0.83 H new ATOM 0 HA SER A 124 -3.903 -1.950 4.315 1.00 0.94 H new ATOM 0 HB2 SER A 124 -4.885 -1.308 6.506 1.00 0.98 H new ATOM 0 HB3 SER A 124 -5.330 0.246 5.831 1.00 0.98 H new ATOM 0 HG SER A 124 -6.112 -2.269 4.694 1.00 2.21 H new ATOM 1849 N LEU A 125 -4.656 -0.760 2.264 1.00 0.78 N ATOM 1850 CA LEU A 125 -4.806 -0.187 0.939 1.00 0.77 C ATOM 1851 C LEU A 125 -6.009 -0.829 0.272 1.00 0.76 C ATOM 1852 O LEU A 125 -6.184 -2.040 0.371 1.00 0.81 O ATOM 1853 CB LEU A 125 -3.503 -0.430 0.172 1.00 0.77 C ATOM 1854 CG LEU A 125 -3.501 -0.064 -1.320 1.00 0.77 C ATOM 1855 CD1 LEU A 125 -4.128 -1.130 -2.223 1.00 0.80 C ATOM 1856 CD2 LEU A 125 -4.017 1.336 -1.630 1.00 0.86 C ATOM 0 H LEU A 125 -4.912 -1.746 2.308 1.00 0.78 H new ATOM 0 HA LEU A 125 -4.984 0.888 0.969 1.00 0.77 H new ATOM 0 HB2 LEU A 125 -2.710 0.135 0.662 1.00 0.77 H new ATOM 0 HB3 LEU A 125 -3.246 -1.485 0.264 1.00 0.77 H new ATOM 0 HG LEU A 125 -2.441 -0.042 -1.572 1.00 0.77 H new ATOM 0 HD11 LEU A 125 -4.088 -0.797 -3.260 1.00 0.80 H new ATOM 0 HD12 LEU A 125 -3.576 -2.064 -2.120 1.00 0.80 H new ATOM 0 HD13 LEU A 125 -5.166 -1.288 -1.932 1.00 0.80 H new ATOM 0 HD21 LEU A 125 -3.980 1.508 -2.706 1.00 0.86 H new ATOM 0 HD22 LEU A 125 -5.046 1.430 -1.283 1.00 0.86 H new ATOM 0 HD23 LEU A 125 -3.395 2.074 -1.123 1.00 0.86 H new ATOM 1868 N GLY A 126 -6.820 -0.022 -0.408 1.00 0.77 N ATOM 1869 CA GLY A 126 -8.005 -0.436 -1.145 1.00 0.79 C ATOM 1870 C GLY A 126 -7.958 0.207 -2.527 1.00 0.95 C ATOM 1871 O GLY A 126 -7.496 1.340 -2.665 1.00 1.38 O ATOM 0 H GLY A 126 -6.659 0.984 -0.461 1.00 0.77 H new ATOM 0 HA2 GLY A 126 -8.038 -1.522 -1.232 1.00 0.79 H new ATOM 0 HA3 GLY A 126 -8.907 -0.132 -0.615 1.00 0.79 H new ATOM 1875 N ILE A 127 -8.380 -0.527 -3.556 1.00 0.95 N ATOM 1876 CA ILE A 127 -8.215 -0.177 -4.958 1.00 1.05 C ATOM 1877 C ILE A 127 -9.558 -0.406 -5.629 1.00 1.11 C ATOM 1878 O ILE A 127 -10.202 -1.419 -5.364 1.00 1.70 O ATOM 1879 CB ILE A 127 -7.049 -0.979 -5.571 1.00 1.89 C ATOM 1880 CG1 ILE A 127 -7.018 -0.957 -7.114 1.00 1.75 C ATOM 1881 CG2 ILE A 127 -6.960 -2.408 -5.024 1.00 2.79 C ATOM 1882 CD1 ILE A 127 -7.832 -2.058 -7.807 1.00 2.07 C ATOM 0 H ILE A 127 -8.864 -1.415 -3.426 1.00 0.95 H new ATOM 0 HA ILE A 127 -7.938 0.867 -5.101 1.00 1.05 H new ATOM 0 HB ILE A 127 -6.152 -0.452 -5.246 1.00 1.89 H new ATOM 0 HG12 ILE A 127 -7.386 0.011 -7.454 1.00 1.75 H new ATOM 0 HG13 ILE A 127 -5.981 -1.036 -7.440 1.00 1.75 H new ATOM 0 HG21 ILE A 127 -6.122 -2.925 -5.491 1.00 2.79 H new ATOM 0 HG22 ILE A 127 -6.811 -2.376 -3.945 1.00 2.79 H new ATOM 0 HG23 ILE A 127 -7.884 -2.941 -5.247 1.00 2.79 H new ATOM 0 HD11 ILE A 127 -7.742 -1.951 -8.888 1.00 2.07 H new ATOM 0 HD12 ILE A 127 -7.453 -3.035 -7.506 1.00 2.07 H new ATOM 0 HD13 ILE A 127 -8.880 -1.971 -7.520 1.00 2.07 H new ATOM 1894 N PHE A 128 -9.995 0.548 -6.456 1.00 0.93 N ATOM 1895 CA PHE A 128 -11.380 0.641 -6.885 1.00 1.13 C ATOM 1896 C PHE A 128 -11.475 0.956 -8.374 1.00 1.34 C ATOM 1897 O PHE A 128 -10.504 1.394 -9.001 1.00 1.62 O ATOM 1898 CB PHE A 128 -12.098 1.677 -6.009 1.00 1.69 C ATOM 1899 CG PHE A 128 -11.972 1.388 -4.521 1.00 2.93 C ATOM 1900 CD1 PHE A 128 -11.131 2.180 -3.713 1.00 4.12 C ATOM 1901 CD2 PHE A 128 -12.538 0.213 -3.990 1.00 4.25 C ATOM 1902 CE1 PHE A 128 -10.883 1.811 -2.379 1.00 6.07 C ATOM 1903 CE2 PHE A 128 -12.257 -0.175 -2.670 1.00 6.02 C ATOM 1904 CZ PHE A 128 -11.445 0.632 -1.858 1.00 6.83 C ATOM 0 H PHE A 128 -9.393 1.275 -6.843 1.00 0.93 H new ATOM 0 HA PHE A 128 -11.878 -0.320 -6.755 1.00 1.13 H new ATOM 0 HB2 PHE A 128 -11.690 2.666 -6.217 1.00 1.69 H new ATOM 0 HB3 PHE A 128 -13.153 1.705 -6.280 1.00 1.69 H new ATOM 0 HD1 PHE A 128 -10.677 3.072 -4.119 1.00 4.12 H new ATOM 0 HD2 PHE A 128 -13.191 -0.393 -4.601 1.00 4.25 H new ATOM 0 HE1 PHE A 128 -10.260 2.434 -1.754 1.00 6.07 H new ATOM 0 HE2 PHE A 128 -12.666 -1.095 -2.279 1.00 6.02 H new ATOM 0 HZ PHE A 128 -11.252 0.348 -0.834 1.00 6.83 H new ATOM 1914 N GLY A 129 -12.646 0.646 -8.942 1.00 1.94 N ATOM 1915 CA GLY A 129 -12.881 0.666 -10.381 1.00 2.74 C ATOM 1916 C GLY A 129 -12.452 -0.646 -11.048 1.00 2.75 C ATOM 1917 O GLY A 129 -12.609 -0.823 -12.257 1.00 3.81 O ATOM 0 H GLY A 129 -13.466 0.371 -8.402 1.00 1.94 H new ATOM 0 HA2 GLY A 129 -13.939 0.842 -10.574 1.00 2.74 H new ATOM 0 HA3 GLY A 129 -12.333 1.496 -10.827 1.00 2.74 H new ATOM 1921 N GLY A 130 -11.918 -1.585 -10.263 1.00 2.45 N ATOM 1922 CA GLY A 130 -11.622 -2.937 -10.695 1.00 3.56 C ATOM 1923 C GLY A 130 -10.320 -2.963 -11.481 1.00 3.61 C ATOM 1924 O GLY A 130 -9.298 -3.425 -10.985 1.00 4.73 O ATOM 0 H GLY A 130 -11.677 -1.414 -9.287 1.00 2.45 H new ATOM 0 HA2 GLY A 130 -11.546 -3.595 -9.829 1.00 3.56 H new ATOM 0 HA3 GLY A 130 -12.436 -3.316 -11.313 1.00 3.56 H new ATOM 1928 N LYS A 131 -10.322 -2.389 -12.685 1.00 2.88 N ATOM 1929 CA LYS A 131 -9.117 -2.328 -13.507 1.00 2.72 C ATOM 1930 C LYS A 131 -7.988 -1.510 -12.857 1.00 2.31 C ATOM 1931 O LYS A 131 -6.879 -1.495 -13.383 1.00 2.75 O ATOM 1932 CB LYS A 131 -9.456 -1.832 -14.920 1.00 2.74 C ATOM 1933 CG LYS A 131 -9.982 -0.389 -14.933 1.00 2.36 C ATOM 1934 CD LYS A 131 -10.201 0.146 -16.356 1.00 2.39 C ATOM 1935 CE LYS A 131 -8.870 0.372 -17.094 1.00 3.98 C ATOM 1936 NZ LYS A 131 -9.057 1.094 -18.369 1.00 4.25 N ATOM 0 H LYS A 131 -11.144 -1.961 -13.110 1.00 2.88 H new ATOM 0 HA LYS A 131 -8.727 -3.343 -13.589 1.00 2.72 H new ATOM 0 HB2 LYS A 131 -8.566 -1.895 -15.546 1.00 2.74 H new ATOM 0 HB3 LYS A 131 -10.204 -2.491 -15.362 1.00 2.74 H new ATOM 0 HG2 LYS A 131 -10.922 -0.344 -14.383 1.00 2.36 H new ATOM 0 HG3 LYS A 131 -9.276 0.256 -14.411 1.00 2.36 H new ATOM 0 HD2 LYS A 131 -10.813 -0.559 -16.919 1.00 2.39 H new ATOM 0 HD3 LYS A 131 -10.755 1.084 -16.310 1.00 2.39 H new ATOM 0 HE2 LYS A 131 -8.193 0.937 -16.454 1.00 3.98 H new ATOM 0 HE3 LYS A 131 -8.396 -0.590 -17.289 1.00 3.98 H new ATOM 0 HZ1 LYS A 131 -8.135 1.224 -18.832 1.00 4.25 H new ATOM 0 HZ2 LYS A 131 -9.683 0.543 -18.991 1.00 4.25 H new ATOM 0 HZ3 LYS A 131 -9.485 2.023 -18.182 1.00 4.25 H new ATOM 1950 N ALA A 132 -8.291 -0.822 -11.748 1.00 1.67 N ATOM 1951 CA ALA A 132 -7.465 0.105 -10.996 1.00 1.33 C ATOM 1952 C ALA A 132 -7.728 1.464 -11.615 1.00 1.18 C ATOM 1953 O ALA A 132 -7.281 1.734 -12.727 1.00 1.77 O ATOM 1954 CB ALA A 132 -5.976 -0.265 -10.950 1.00 1.79 C ATOM 0 H ALA A 132 -9.213 -0.917 -11.322 1.00 1.67 H new ATOM 0 HA ALA A 132 -7.733 0.085 -9.940 1.00 1.33 H new ATOM 0 HB1 ALA A 132 -5.434 0.481 -10.368 1.00 1.79 H new ATOM 0 HB2 ALA A 132 -5.859 -1.244 -10.485 1.00 1.79 H new ATOM 0 HB3 ALA A 132 -5.577 -0.295 -11.964 1.00 1.79 H new ATOM 1960 N GLN A 133 -8.564 2.259 -10.948 1.00 0.84 N ATOM 1961 CA GLN A 133 -8.972 3.582 -11.403 1.00 1.03 C ATOM 1962 C GLN A 133 -8.506 4.595 -10.370 1.00 1.17 C ATOM 1963 O GLN A 133 -7.763 5.517 -10.698 1.00 1.49 O ATOM 1964 CB GLN A 133 -10.480 3.636 -11.672 1.00 1.35 C ATOM 1965 CG GLN A 133 -10.921 2.677 -12.794 1.00 1.73 C ATOM 1966 CD GLN A 133 -10.419 3.096 -14.176 1.00 2.35 C ATOM 1967 OE1 GLN A 133 -11.172 3.626 -14.983 1.00 2.61 O ATOM 1968 NE2 GLN A 133 -9.157 2.833 -14.494 1.00 3.63 N ATOM 0 H GLN A 133 -8.984 1.993 -10.057 1.00 0.84 H new ATOM 0 HA GLN A 133 -8.507 3.823 -12.359 1.00 1.03 H new ATOM 0 HB2 GLN A 133 -11.017 3.388 -10.756 1.00 1.35 H new ATOM 0 HB3 GLN A 133 -10.760 4.655 -11.940 1.00 1.35 H new ATOM 0 HG2 GLN A 133 -10.556 1.674 -12.571 1.00 1.73 H new ATOM 0 HG3 GLN A 133 -12.010 2.624 -12.811 1.00 1.73 H new ATOM 0 HE21 GLN A 133 -8.541 2.391 -13.812 1.00 3.63 H new ATOM 0 HE22 GLN A 133 -8.804 3.073 -15.420 1.00 3.63 H new ATOM 1977 N GLU A 134 -8.823 4.338 -9.105 1.00 0.99 N ATOM 1978 CA GLU A 134 -8.218 5.025 -7.985 1.00 1.05 C ATOM 1979 C GLU A 134 -7.851 3.975 -6.947 1.00 0.95 C ATOM 1980 O GLU A 134 -8.459 2.900 -6.920 1.00 1.24 O ATOM 1981 CB GLU A 134 -9.181 6.064 -7.403 1.00 1.17 C ATOM 1982 CG GLU A 134 -9.666 7.048 -8.472 1.00 1.34 C ATOM 1983 CD GLU A 134 -10.334 8.250 -7.828 1.00 1.70 C ATOM 1984 OE1 GLU A 134 -11.533 8.136 -7.506 1.00 2.56 O ATOM 1985 OE2 GLU A 134 -9.604 9.252 -7.653 1.00 2.32 O ATOM 0 H GLU A 134 -9.514 3.639 -8.833 1.00 0.99 H new ATOM 0 HA GLU A 134 -7.326 5.564 -8.304 1.00 1.05 H new ATOM 0 HB2 GLU A 134 -10.038 5.557 -6.959 1.00 1.17 H new ATOM 0 HB3 GLU A 134 -8.685 6.612 -6.602 1.00 1.17 H new ATOM 0 HG2 GLU A 134 -8.824 7.376 -9.081 1.00 1.34 H new ATOM 0 HG3 GLU A 134 -10.368 6.550 -9.141 1.00 1.34 H new ATOM 1992 N VAL A 135 -6.878 4.292 -6.094 1.00 0.96 N ATOM 1993 CA VAL A 135 -6.668 3.564 -4.851 1.00 0.98 C ATOM 1994 C VAL A 135 -6.655 4.586 -3.725 1.00 1.18 C ATOM 1995 O VAL A 135 -6.290 5.742 -3.954 1.00 1.80 O ATOM 1996 CB VAL A 135 -5.397 2.683 -4.880 1.00 0.97 C ATOM 1997 CG1 VAL A 135 -5.119 2.108 -6.275 1.00 1.23 C ATOM 1998 CG2 VAL A 135 -4.166 3.443 -4.391 1.00 1.15 C ATOM 0 H VAL A 135 -6.219 5.056 -6.246 1.00 0.96 H new ATOM 0 HA VAL A 135 -7.478 2.852 -4.695 1.00 0.98 H new ATOM 0 HB VAL A 135 -5.595 1.856 -4.199 1.00 0.97 H new ATOM 0 HG11 VAL A 135 -4.217 1.497 -6.244 1.00 1.23 H new ATOM 0 HG12 VAL A 135 -5.962 1.494 -6.590 1.00 1.23 H new ATOM 0 HG13 VAL A 135 -4.980 2.924 -6.984 1.00 1.23 H new ATOM 0 HG21 VAL A 135 -3.296 2.788 -4.427 1.00 1.15 H new ATOM 0 HG22 VAL A 135 -3.995 4.309 -5.030 1.00 1.15 H new ATOM 0 HG23 VAL A 135 -4.327 3.775 -3.365 1.00 1.15 H new ATOM 2008 N ALA A 136 -7.032 4.139 -2.528 1.00 0.85 N ATOM 2009 CA ALA A 136 -6.968 4.899 -1.291 1.00 0.96 C ATOM 2010 C ALA A 136 -6.347 3.986 -0.242 1.00 1.01 C ATOM 2011 O ALA A 136 -6.628 2.787 -0.232 1.00 1.07 O ATOM 2012 CB ALA A 136 -8.373 5.343 -0.880 1.00 1.09 C ATOM 0 H ALA A 136 -7.405 3.199 -2.393 1.00 0.85 H new ATOM 0 HA ALA A 136 -6.367 5.801 -1.406 1.00 0.96 H new ATOM 0 HB1 ALA A 136 -8.318 5.912 0.048 1.00 1.09 H new ATOM 0 HB2 ALA A 136 -8.801 5.968 -1.664 1.00 1.09 H new ATOM 0 HB3 ALA A 136 -9.003 4.466 -0.731 1.00 1.09 H new ATOM 2018 N GLY A 137 -5.475 4.519 0.614 1.00 1.02 N ATOM 2019 CA GLY A 137 -4.810 3.718 1.622 1.00 1.09 C ATOM 2020 C GLY A 137 -4.368 4.576 2.793 1.00 1.06 C ATOM 2021 O GLY A 137 -4.485 5.804 2.768 1.00 1.03 O ATOM 0 H GLY A 137 -5.217 5.506 0.623 1.00 1.02 H new ATOM 0 HA2 GLY A 137 -5.483 2.936 1.973 1.00 1.09 H new ATOM 0 HA3 GLY A 137 -3.945 3.220 1.184 1.00 1.09 H new ATOM 2025 N SER A 138 -3.820 3.928 3.815 1.00 1.11 N ATOM 2026 CA SER A 138 -3.112 4.586 4.893 1.00 1.07 C ATOM 2027 C SER A 138 -2.093 3.602 5.456 1.00 0.96 C ATOM 2028 O SER A 138 -2.231 2.390 5.274 1.00 1.18 O ATOM 2029 CB SER A 138 -4.096 5.043 5.979 1.00 1.14 C ATOM 2030 OG SER A 138 -4.960 6.056 5.498 1.00 1.79 O ATOM 0 H SER A 138 -3.859 2.914 3.914 1.00 1.11 H new ATOM 0 HA SER A 138 -2.600 5.475 4.525 1.00 1.07 H new ATOM 0 HB2 SER A 138 -4.685 4.192 6.320 1.00 1.14 H new ATOM 0 HB3 SER A 138 -3.542 5.414 6.842 1.00 1.14 H new ATOM 0 HG SER A 138 -4.834 6.162 4.532 1.00 1.79 H new ATOM 2036 N ALA A 139 -1.085 4.122 6.151 1.00 0.81 N ATOM 2037 CA ALA A 139 -0.208 3.340 6.988 1.00 0.70 C ATOM 2038 C ALA A 139 -0.074 4.021 8.336 1.00 0.70 C ATOM 2039 O ALA A 139 -0.017 5.248 8.414 1.00 0.94 O ATOM 2040 CB ALA A 139 1.146 3.112 6.314 1.00 0.81 C ATOM 0 H ALA A 139 -0.859 5.117 6.142 1.00 0.81 H new ATOM 0 HA ALA A 139 -0.638 2.350 7.143 1.00 0.70 H new ATOM 0 HB1 ALA A 139 1.784 2.520 6.970 1.00 0.81 H new ATOM 0 HB2 ALA A 139 0.999 2.580 5.374 1.00 0.81 H new ATOM 0 HB3 ALA A 139 1.621 4.073 6.117 1.00 0.81 H new ATOM 2046 N GLU A 140 -0.038 3.212 9.389 1.00 0.59 N ATOM 2047 CA GLU A 140 0.328 3.654 10.717 1.00 0.69 C ATOM 2048 C GLU A 140 1.625 2.951 11.085 1.00 0.82 C ATOM 2049 O GLU A 140 1.662 1.784 11.474 1.00 1.19 O ATOM 2050 CB GLU A 140 -0.780 3.421 11.731 1.00 0.87 C ATOM 2051 CG GLU A 140 -1.521 2.113 11.494 1.00 1.92 C ATOM 2052 CD GLU A 140 -2.259 1.680 12.748 1.00 2.36 C ATOM 2053 OE1 GLU A 140 -2.474 0.456 12.873 1.00 3.44 O ATOM 2054 OE2 GLU A 140 -2.545 2.583 13.574 1.00 2.66 O ATOM 0 H GLU A 140 -0.266 2.219 9.337 1.00 0.59 H new ATOM 0 HA GLU A 140 0.479 4.733 10.727 1.00 0.69 H new ATOM 0 HB2 GLU A 140 -0.355 3.417 12.735 1.00 0.87 H new ATOM 0 HB3 GLU A 140 -1.488 4.249 11.688 1.00 0.87 H new ATOM 0 HG2 GLU A 140 -2.228 2.233 10.673 1.00 1.92 H new ATOM 0 HG3 GLU A 140 -0.815 1.338 11.196 1.00 1.92 H new ATOM 2061 N VAL A 141 2.700 3.700 10.907 1.00 0.74 N ATOM 2062 CA VAL A 141 4.062 3.236 11.046 1.00 0.77 C ATOM 2063 C VAL A 141 4.670 3.983 12.225 1.00 0.80 C ATOM 2064 O VAL A 141 4.466 5.186 12.332 1.00 1.09 O ATOM 2065 CB VAL A 141 4.786 3.405 9.699 1.00 0.87 C ATOM 2066 CG1 VAL A 141 3.995 2.718 8.576 1.00 2.19 C ATOM 2067 CG2 VAL A 141 4.947 4.863 9.268 1.00 1.91 C ATOM 0 H VAL A 141 2.641 4.686 10.652 1.00 0.74 H new ATOM 0 HA VAL A 141 4.145 2.173 11.273 1.00 0.77 H new ATOM 0 HB VAL A 141 5.770 2.962 9.853 1.00 0.87 H new ATOM 0 HG11 VAL A 141 4.520 2.847 7.630 1.00 2.19 H new ATOM 0 HG12 VAL A 141 3.899 1.655 8.796 1.00 2.19 H new ATOM 0 HG13 VAL A 141 3.003 3.164 8.504 1.00 2.19 H new ATOM 0 HG21 VAL A 141 5.466 4.904 8.310 1.00 1.91 H new ATOM 0 HG22 VAL A 141 3.964 5.324 9.168 1.00 1.91 H new ATOM 0 HG23 VAL A 141 5.526 5.402 10.018 1.00 1.91 H new ATOM 2077 N LYS A 142 5.328 3.290 13.162 1.00 0.79 N ATOM 2078 CA LYS A 142 5.723 3.903 14.422 1.00 0.93 C ATOM 2079 C LYS A 142 7.151 3.514 14.776 1.00 1.07 C ATOM 2080 O LYS A 142 7.450 2.346 15.015 1.00 1.29 O ATOM 2081 CB LYS A 142 4.701 3.574 15.522 1.00 1.01 C ATOM 2082 CG LYS A 142 4.786 2.146 16.068 1.00 1.16 C ATOM 2083 CD LYS A 142 3.557 1.849 16.937 1.00 1.46 C ATOM 2084 CE LYS A 142 3.670 0.459 17.581 1.00 3.01 C ATOM 2085 NZ LYS A 142 2.502 0.145 18.431 1.00 3.80 N ATOM 0 H LYS A 142 5.594 2.310 13.066 1.00 0.79 H new ATOM 0 HA LYS A 142 5.720 4.988 14.321 1.00 0.93 H new ATOM 0 HB2 LYS A 142 4.838 4.273 16.347 1.00 1.01 H new ATOM 0 HB3 LYS A 142 3.698 3.739 15.128 1.00 1.01 H new ATOM 0 HG2 LYS A 142 4.841 1.434 15.244 1.00 1.16 H new ATOM 0 HG3 LYS A 142 5.696 2.025 16.655 1.00 1.16 H new ATOM 0 HD2 LYS A 142 3.462 2.608 17.713 1.00 1.46 H new ATOM 0 HD3 LYS A 142 2.654 1.901 16.329 1.00 1.46 H new ATOM 0 HE2 LYS A 142 3.763 -0.296 16.800 1.00 3.01 H new ATOM 0 HE3 LYS A 142 4.579 0.410 18.181 1.00 3.01 H new ATOM 0 HZ1 LYS A 142 2.619 -0.801 18.846 1.00 3.80 H new ATOM 0 HZ2 LYS A 142 2.427 0.850 19.192 1.00 3.80 H new ATOM 0 HZ3 LYS A 142 1.637 0.165 17.854 1.00 3.80 H new ATOM 2099 N THR A 143 8.035 4.507 14.825 1.00 1.17 N ATOM 2100 CA THR A 143 9.353 4.365 15.424 1.00 1.40 C ATOM 2101 C THR A 143 9.673 5.727 16.036 1.00 1.33 C ATOM 2102 O THR A 143 8.855 6.645 15.937 1.00 1.21 O ATOM 2103 CB THR A 143 10.420 3.955 14.386 1.00 1.62 C ATOM 2104 OG1 THR A 143 10.616 4.988 13.447 1.00 2.00 O ATOM 2105 CG2 THR A 143 10.105 2.653 13.648 1.00 2.11 C ATOM 0 H THR A 143 7.853 5.437 14.447 1.00 1.17 H new ATOM 0 HA THR A 143 9.359 3.572 16.172 1.00 1.40 H new ATOM 0 HB THR A 143 11.331 3.778 14.958 1.00 1.62 H new ATOM 0 HG1 THR A 143 11.296 4.714 12.797 1.00 2.00 H new ATOM 0 HG21 THR A 143 10.902 2.435 12.937 1.00 2.11 H new ATOM 0 HG22 THR A 143 10.027 1.837 14.367 1.00 2.11 H new ATOM 0 HG23 THR A 143 9.161 2.757 13.113 1.00 2.11 H new ATOM 2113 N VAL A 144 10.895 5.893 16.553 1.00 1.45 N ATOM 2114 CA VAL A 144 11.476 7.199 16.849 1.00 1.39 C ATOM 2115 C VAL A 144 11.255 8.171 15.679 1.00 1.22 C ATOM 2116 O VAL A 144 11.120 9.373 15.898 1.00 1.22 O ATOM 2117 CB VAL A 144 12.973 7.034 17.176 1.00 1.57 C ATOM 2118 CG1 VAL A 144 13.646 8.383 17.465 1.00 2.05 C ATOM 2119 CG2 VAL A 144 13.171 6.126 18.399 1.00 2.16 C ATOM 0 H VAL A 144 11.512 5.113 16.779 1.00 1.45 H new ATOM 0 HA VAL A 144 10.979 7.627 17.720 1.00 1.39 H new ATOM 0 HB VAL A 144 13.433 6.584 16.296 1.00 1.57 H new ATOM 0 HG11 VAL A 144 14.700 8.223 17.691 1.00 2.05 H new ATOM 0 HG12 VAL A 144 13.556 9.029 16.592 1.00 2.05 H new ATOM 0 HG13 VAL A 144 13.160 8.857 18.318 1.00 2.05 H new ATOM 0 HG21 VAL A 144 14.236 6.026 18.609 1.00 2.16 H new ATOM 0 HG22 VAL A 144 12.671 6.564 19.262 1.00 2.16 H new ATOM 0 HG23 VAL A 144 12.747 5.143 18.195 1.00 2.16 H new ATOM 2129 N ASN A 145 11.191 7.657 14.444 1.00 1.23 N ATOM 2130 CA ASN A 145 10.840 8.445 13.274 1.00 1.20 C ATOM 2131 C ASN A 145 9.881 7.629 12.411 1.00 1.25 C ATOM 2132 O ASN A 145 10.129 7.401 11.229 1.00 1.47 O ATOM 2133 CB ASN A 145 12.113 8.889 12.533 1.00 1.48 C ATOM 2134 CG ASN A 145 13.105 7.749 12.307 1.00 2.17 C ATOM 2135 OD1 ASN A 145 14.190 7.743 12.879 1.00 3.29 O ATOM 2136 ND2 ASN A 145 12.747 6.764 11.494 1.00 2.78 N ATOM 0 H ASN A 145 11.384 6.677 14.236 1.00 1.23 H new ATOM 0 HA ASN A 145 10.326 9.364 13.556 1.00 1.20 H new ATOM 0 HB2 ASN A 145 11.835 9.317 11.570 1.00 1.48 H new ATOM 0 HB3 ASN A 145 12.601 9.679 13.103 1.00 1.48 H new ATOM 0 HD21 ASN A 145 13.379 5.980 11.334 1.00 2.78 H new ATOM 0 HD22 ASN A 145 11.839 6.791 11.029 1.00 2.78 H new ATOM 2143 N GLY A 146 8.757 7.212 13.001 1.00 1.15 N ATOM 2144 CA GLY A 146 7.680 6.555 12.286 1.00 1.22 C ATOM 2145 C GLY A 146 6.403 7.339 12.506 1.00 1.04 C ATOM 2146 O GLY A 146 6.026 7.621 13.641 1.00 1.03 O ATOM 0 H GLY A 146 8.576 7.326 13.998 1.00 1.15 H new ATOM 0 HA2 GLY A 146 7.911 6.500 11.222 1.00 1.22 H new ATOM 0 HA3 GLY A 146 7.561 5.531 12.640 1.00 1.22 H new ATOM 2150 N ILE A 147 5.774 7.718 11.397 1.00 1.02 N ATOM 2151 CA ILE A 147 4.606 8.566 11.357 1.00 1.02 C ATOM 2152 C ILE A 147 3.341 7.704 11.396 1.00 1.09 C ATOM 2153 O ILE A 147 2.884 7.176 10.386 1.00 1.39 O ATOM 2154 CB ILE A 147 4.653 9.464 10.098 1.00 1.09 C ATOM 2155 CG1 ILE A 147 5.122 8.683 8.866 1.00 1.57 C ATOM 2156 CG2 ILE A 147 5.480 10.731 10.342 1.00 1.47 C ATOM 2157 CD1 ILE A 147 6.622 8.715 8.571 1.00 1.45 C ATOM 0 H ILE A 147 6.083 7.427 10.470 1.00 1.02 H new ATOM 0 HA ILE A 147 4.591 9.219 12.229 1.00 1.02 H new ATOM 0 HB ILE A 147 3.635 9.793 9.887 1.00 1.09 H new ATOM 0 HG12 ILE A 147 4.819 7.643 8.985 1.00 1.57 H new ATOM 0 HG13 ILE A 147 4.594 9.070 7.995 1.00 1.57 H new ATOM 0 HG21 ILE A 147 5.491 11.338 9.437 1.00 1.47 H new ATOM 0 HG22 ILE A 147 5.037 11.303 11.157 1.00 1.47 H new ATOM 0 HG23 ILE A 147 6.501 10.454 10.606 1.00 1.47 H new ATOM 0 HD11 ILE A 147 6.830 8.127 7.677 1.00 1.45 H new ATOM 0 HD12 ILE A 147 6.939 9.745 8.410 1.00 1.45 H new ATOM 0 HD13 ILE A 147 7.168 8.295 9.416 1.00 1.45 H new ATOM 2169 N ARG A 148 2.719 7.609 12.569 1.00 1.08 N ATOM 2170 CA ARG A 148 1.523 6.798 12.782 1.00 1.14 C ATOM 2171 C ARG A 148 0.301 7.275 11.979 1.00 1.31 C ATOM 2172 O ARG A 148 -0.757 6.658 12.068 1.00 2.41 O ATOM 2173 CB ARG A 148 1.202 6.703 14.284 1.00 1.40 C ATOM 2174 CG ARG A 148 1.076 5.252 14.780 1.00 1.88 C ATOM 2175 CD ARG A 148 -0.175 4.997 15.630 1.00 2.18 C ATOM 2176 NE ARG A 148 -1.373 4.696 14.816 1.00 2.25 N ATOM 2177 CZ ARG A 148 -2.323 5.551 14.408 1.00 2.16 C ATOM 2178 NH1 ARG A 148 -2.301 6.830 14.790 1.00 2.09 N ATOM 2179 NH2 ARG A 148 -3.298 5.089 13.626 1.00 2.98 N ATOM 0 H ARG A 148 3.035 8.098 13.407 1.00 1.08 H new ATOM 0 HA ARG A 148 1.751 5.803 12.400 1.00 1.14 H new ATOM 0 HB2 ARG A 148 1.985 7.208 14.850 1.00 1.40 H new ATOM 0 HB3 ARG A 148 0.271 7.232 14.485 1.00 1.40 H new ATOM 0 HG2 ARG A 148 1.062 4.583 13.919 1.00 1.88 H new ATOM 0 HG3 ARG A 148 1.960 5.000 15.366 1.00 1.88 H new ATOM 0 HD2 ARG A 148 0.016 4.165 16.308 1.00 2.18 H new ATOM 0 HD3 ARG A 148 -0.373 5.873 16.248 1.00 2.18 H new ATOM 0 HE ARG A 148 -1.491 3.724 14.531 1.00 2.25 H new ATOM 0 HH11 ARG A 148 -1.556 7.168 15.399 1.00 2.09 H new ATOM 0 HH12 ARG A 148 -3.029 7.470 14.473 1.00 2.09 H new ATOM 0 HH21 ARG A 148 -3.310 4.107 13.352 1.00 2.98 H new ATOM 0 HH22 ARG A 148 -4.033 5.718 13.302 1.00 2.98 H new ATOM 2193 N HIS A 149 0.427 8.365 11.217 1.00 0.74 N ATOM 2194 CA HIS A 149 -0.508 8.760 10.183 1.00 0.78 C ATOM 2195 C HIS A 149 0.279 9.004 8.898 1.00 0.93 C ATOM 2196 O HIS A 149 0.806 10.100 8.698 1.00 1.27 O ATOM 2197 CB HIS A 149 -1.287 10.009 10.614 1.00 0.88 C ATOM 2198 CG HIS A 149 -2.369 9.680 11.611 1.00 0.89 C ATOM 2199 ND1 HIS A 149 -3.670 9.351 11.302 1.00 2.25 N ATOM 2200 CD2 HIS A 149 -2.190 9.441 12.946 1.00 1.00 C ATOM 2201 CE1 HIS A 149 -4.263 8.934 12.434 1.00 2.27 C ATOM 2202 NE2 HIS A 149 -3.397 8.949 13.462 1.00 1.08 N ATOM 0 H HIS A 149 1.210 9.011 11.313 1.00 0.74 H new ATOM 0 HA HIS A 149 -1.241 7.972 10.011 1.00 0.78 H new ATOM 0 HB2 HIS A 149 -0.599 10.733 11.050 1.00 0.88 H new ATOM 0 HB3 HIS A 149 -1.732 10.480 9.737 1.00 0.88 H new ATOM 0 HD1 HIS A 149 -4.105 9.413 10.381 1.00 2.25 H new ATOM 0 HD2 HIS A 149 -1.280 9.603 13.504 1.00 1.00 H new ATOM 0 HE1 HIS A 149 -5.296 8.628 12.508 1.00 2.27 H new ATOM 2210 N ILE A 150 0.326 7.988 8.035 1.00 0.77 N ATOM 2211 CA ILE A 150 0.509 8.151 6.605 1.00 0.64 C ATOM 2212 C ILE A 150 -0.863 7.948 5.975 1.00 0.76 C ATOM 2213 O ILE A 150 -1.484 6.912 6.215 1.00 1.02 O ATOM 2214 CB ILE A 150 1.533 7.144 6.048 1.00 0.63 C ATOM 2215 CG1 ILE A 150 2.928 7.454 6.607 1.00 0.96 C ATOM 2216 CG2 ILE A 150 1.560 7.173 4.513 1.00 1.03 C ATOM 2217 CD1 ILE A 150 4.004 6.448 6.185 1.00 1.17 C ATOM 0 H ILE A 150 0.236 7.014 8.323 1.00 0.77 H new ATOM 0 HA ILE A 150 0.907 9.139 6.374 1.00 0.64 H new ATOM 0 HB ILE A 150 1.233 6.144 6.361 1.00 0.63 H new ATOM 0 HG12 ILE A 150 3.227 8.450 6.279 1.00 0.96 H new ATOM 0 HG13 ILE A 150 2.875 7.479 7.695 1.00 0.96 H new ATOM 0 HG21 ILE A 150 2.292 6.452 4.148 1.00 1.03 H new ATOM 0 HG22 ILE A 150 0.574 6.916 4.127 1.00 1.03 H new ATOM 0 HG23 ILE A 150 1.834 8.172 4.173 1.00 1.03 H new ATOM 0 HD11 ILE A 150 4.961 6.735 6.620 1.00 1.17 H new ATOM 0 HD12 ILE A 150 3.730 5.453 6.536 1.00 1.17 H new ATOM 0 HD13 ILE A 150 4.087 6.439 5.098 1.00 1.17 H new ATOM 2229 N GLY A 151 -1.321 8.899 5.161 1.00 0.70 N ATOM 2230 CA GLY A 151 -2.461 8.707 4.275 1.00 0.87 C ATOM 2231 C GLY A 151 -1.915 8.514 2.865 1.00 0.61 C ATOM 2232 O GLY A 151 -0.825 9.009 2.577 1.00 0.93 O ATOM 0 H GLY A 151 -0.906 9.829 5.100 1.00 0.70 H new ATOM 0 HA2 GLY A 151 -3.044 7.839 4.583 1.00 0.87 H new ATOM 0 HA3 GLY A 151 -3.127 9.569 4.314 1.00 0.87 H new ATOM 2236 N LEU A 152 -2.618 7.798 1.980 1.00 0.65 N ATOM 2237 CA LEU A 152 -2.172 7.681 0.598 1.00 1.19 C ATOM 2238 C LEU A 152 -3.329 7.525 -0.372 1.00 0.77 C ATOM 2239 O LEU A 152 -4.414 7.083 0.006 1.00 0.70 O ATOM 2240 CB LEU A 152 -1.134 6.557 0.447 1.00 2.03 C ATOM 2241 CG LEU A 152 -1.674 5.122 0.436 1.00 1.09 C ATOM 2242 CD1 LEU A 152 -2.124 4.668 -0.962 1.00 0.80 C ATOM 2243 CD2 LEU A 152 -0.582 4.178 0.948 1.00 0.84 C ATOM 0 H LEU A 152 -3.482 7.301 2.196 1.00 0.65 H new ATOM 0 HA LEU A 152 -1.683 8.619 0.335 1.00 1.19 H new ATOM 0 HB2 LEU A 152 -0.586 6.722 -0.480 1.00 2.03 H new ATOM 0 HB3 LEU A 152 -0.416 6.645 1.262 1.00 2.03 H new ATOM 0 HG LEU A 152 -2.552 5.094 1.082 1.00 1.09 H new ATOM 0 HD11 LEU A 152 -2.497 3.645 -0.910 1.00 0.80 H new ATOM 0 HD12 LEU A 152 -2.916 5.325 -1.320 1.00 0.80 H new ATOM 0 HD13 LEU A 152 -1.278 4.711 -1.648 1.00 0.80 H new ATOM 0 HD21 LEU A 152 -0.955 3.154 0.944 1.00 0.84 H new ATOM 0 HD22 LEU A 152 0.292 4.248 0.301 1.00 0.84 H new ATOM 0 HD23 LEU A 152 -0.305 4.460 1.964 1.00 0.84 H new ATOM 2255 N ALA A 153 -3.064 7.852 -1.638 1.00 0.80 N ATOM 2256 CA ALA A 153 -3.974 7.597 -2.740 1.00 0.91 C ATOM 2257 C ALA A 153 -3.162 7.390 -4.015 1.00 0.76 C ATOM 2258 O ALA A 153 -1.973 7.715 -4.048 1.00 0.77 O ATOM 2259 CB ALA A 153 -4.962 8.758 -2.884 1.00 1.53 C ATOM 0 H ALA A 153 -2.197 8.308 -1.924 1.00 0.80 H new ATOM 0 HA ALA A 153 -4.555 6.695 -2.547 1.00 0.91 H new ATOM 0 HB1 ALA A 153 -5.641 8.558 -3.713 1.00 1.53 H new ATOM 0 HB2 ALA A 153 -5.536 8.864 -1.963 1.00 1.53 H new ATOM 0 HB3 ALA A 153 -4.414 9.680 -3.078 1.00 1.53 H new ATOM 2265 N ALA A 154 -3.799 6.849 -5.057 1.00 0.85 N ATOM 2266 CA ALA A 154 -3.177 6.676 -6.363 1.00 0.79 C ATOM 2267 C ALA A 154 -4.205 6.735 -7.475 1.00 0.92 C ATOM 2268 O ALA A 154 -5.411 6.650 -7.235 1.00 1.11 O ATOM 2269 CB ALA A 154 -2.431 5.338 -6.481 1.00 1.12 C ATOM 0 H ALA A 154 -4.763 6.519 -5.014 1.00 0.85 H new ATOM 0 HA ALA A 154 -2.465 7.495 -6.462 1.00 0.79 H new ATOM 0 HB1 ALA A 154 -1.985 5.256 -7.472 1.00 1.12 H new ATOM 0 HB2 ALA A 154 -1.647 5.291 -5.725 1.00 1.12 H new ATOM 0 HB3 ALA A 154 -3.131 4.516 -6.329 1.00 1.12 H new ATOM 2275 N LYS A 155 -3.674 6.852 -8.688 1.00 0.99 N ATOM 2276 CA LYS A 155 -4.319 6.610 -9.960 1.00 1.34 C ATOM 2277 C LYS A 155 -3.200 6.310 -10.965 1.00 1.36 C ATOM 2278 O LYS A 155 -2.028 6.292 -10.576 1.00 1.74 O ATOM 2279 CB LYS A 155 -5.262 7.760 -10.345 1.00 1.84 C ATOM 2280 CG LYS A 155 -4.699 9.149 -10.012 1.00 1.56 C ATOM 2281 CD LYS A 155 -5.681 10.273 -10.367 1.00 1.74 C ATOM 2282 CE LYS A 155 -7.103 10.077 -9.810 1.00 2.64 C ATOM 2283 NZ LYS A 155 -7.125 9.725 -8.374 1.00 3.57 N ATOM 0 H LYS A 155 -2.704 7.142 -8.809 1.00 0.99 H new ATOM 0 HA LYS A 155 -4.989 5.751 -9.928 1.00 1.34 H new ATOM 0 HB2 LYS A 155 -5.470 7.707 -11.414 1.00 1.84 H new ATOM 0 HB3 LYS A 155 -6.213 7.628 -9.829 1.00 1.84 H new ATOM 0 HG2 LYS A 155 -4.462 9.198 -8.949 1.00 1.56 H new ATOM 0 HG3 LYS A 155 -3.765 9.300 -10.554 1.00 1.56 H new ATOM 0 HD2 LYS A 155 -5.284 11.217 -9.992 1.00 1.74 H new ATOM 0 HD3 LYS A 155 -5.738 10.359 -11.452 1.00 1.74 H new ATOM 0 HE2 LYS A 155 -7.674 10.993 -9.961 1.00 2.64 H new ATOM 0 HE3 LYS A 155 -7.603 9.292 -10.377 1.00 2.64 H new ATOM 0 HZ1 LYS A 155 -8.078 9.887 -7.992 1.00 3.57 H new ATOM 0 HZ2 LYS A 155 -6.871 8.723 -8.258 1.00 3.57 H new ATOM 0 HZ3 LYS A 155 -6.441 10.317 -7.861 1.00 3.57 H new ATOM 2297 N GLN A 156 -3.587 5.988 -12.196 1.00 1.51 N ATOM 2298 CA GLN A 156 -2.762 5.513 -13.280 1.00 1.79 C ATOM 2299 C GLN A 156 -1.662 6.519 -13.609 1.00 3.02 C ATOM 2300 O GLN A 156 -0.514 6.056 -13.790 1.00 4.32 O ATOM 2301 CB GLN A 156 -3.684 5.227 -14.471 1.00 2.45 C ATOM 2302 CG GLN A 156 -4.696 4.105 -14.166 1.00 2.79 C ATOM 2303 CD GLN A 156 -5.832 4.471 -13.229 1.00 3.29 C ATOM 2304 OE1 GLN A 156 -6.791 5.117 -13.634 1.00 4.79 O ATOM 2305 NE2 GLN A 156 -5.688 4.114 -11.954 1.00 2.92 N ATOM 0 H GLN A 156 -4.566 6.062 -12.474 1.00 1.51 H new ATOM 0 HA GLN A 156 -2.244 4.595 -13.004 1.00 1.79 H new ATOM 0 HB2 GLN A 156 -4.222 6.136 -14.739 1.00 2.45 H new ATOM 0 HB3 GLN A 156 -3.082 4.946 -15.335 1.00 2.45 H new ATOM 0 HG2 GLN A 156 -5.124 3.763 -15.108 1.00 2.79 H new ATOM 0 HG3 GLN A 156 -4.155 3.262 -13.737 1.00 2.79 H new ATOM 0 HE21 GLN A 156 -4.871 3.576 -11.664 1.00 2.92 H new ATOM 0 HE22 GLN A 156 -6.394 4.379 -11.267 1.00 2.92 H new TER 2314 GLN A 156