USER MOD reduce.3.24.130724 H: found=0, std=0, add=1074, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1079 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 73 TYR OH : rot -176:sc= 0.744 USER MOD Set 1.2: A 168 CYS SG : rot 167:sc= 0.301 USER MOD Set 2.1: A 109 HIS :FLIP no HE2:sc= 0.146 F(o=-2.6,f=0.7) USER MOD Set 2.2: A 147 SER OG : rot 113:sc= 0.557 USER MOD Set 3.1: A 107 ASN : amide:sc= 0.313 K(o=-3.7,f=-4.5) USER MOD Set 3.2: A 154 SER OG : rot -159:sc= -4! USER MOD Set 4.1: A 20 SER OG : rot 54:sc= 0.854 USER MOD Set 4.2: A 31 LYS NZ :NH3+ -140:sc= 2.34 (180deg=0.151) USER MOD Set 5.1: A 15 ASN : amide:sc= -1.13 K(o=-0.00057,f=-3.5!) USER MOD Set 5.2: A 63 THR OG1 : rot -90:sc= 1.13 USER MOD Single : A 9 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0603) USER MOD Single : A 21 HIS :FLIP no HE2:sc= -4.03! C(o=-6.7!,f=-4!) USER MOD Single : A 25 HIS : no HD1:sc= -0.351 X(o=-0.35,f=0.034) USER MOD Single : A 28 HIS : no HD1:sc= -1.11 K(o=-1.1,f=-2!) USER MOD Single : A 29 TYR OH : rot 38:sc= 0.0819 USER MOD Single : A 53 SER OG : rot 175:sc= 0.623 USER MOD Single : A 54 ASN : amide:sc= -5.27! C(o=-5.3!,f=-5.6!) USER MOD Single : A 58 GLN : amide:sc= 0 X(o=0,f=-0.24) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 GLN :FLIP amide:sc= -0.049 F(o=-1.5,f=-0.049) USER MOD Single : A 70 SER OG : rot 170:sc= -0.681 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot -15:sc= -1.32 USER MOD Single : A 88 LYS NZ :NH3+ 144:sc= 1.04 (180deg=0.129) USER MOD Single : A 110 THR OG1 : rot 52:sc= 0.0291 USER MOD Single : A 113 LYS NZ :NH3+ 174:sc= 1.06 (180deg=0.884) USER MOD Single : A 123 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 180:sc= -0.756 USER MOD Single : A 127 HIS : no HD1:sc= -0.0979 K(o=-0.098,f=-3.2!) USER MOD Single : A 134 SER OG : rot 180:sc= -1.36 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 LYS NZ :NH3+ -168:sc= 1.25 (180deg=1.08) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 143 GLN :FLIP amide:sc= -0.154 F(o=-0.66,f=-0.15) USER MOD Single : A 148 THR OG1 : rot 180:sc= 0 USER MOD Single : A 150 THR OG1 : rot 180:sc= 0 USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 159 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0205) USER MOD Single : A 173 MET CE :methyl 138:sc= -2.55! (180deg=-4.64!) USER MOD Single : A 174 LYS NZ :NH3+ 170:sc= 0.634 (180deg=0.296) USER MOD Single : A 176 THR OG1 : rot 180:sc= -0.0218 USER MOD ----------------------------------------------------------------- ATOM 8 N LEU A 6 -9.737 13.307 4.398 1.00 0.72 N ATOM 9 CA LEU A 6 -9.392 11.941 4.049 1.00 0.55 C ATOM 10 C LEU A 6 -9.605 11.029 5.252 1.00 0.42 C ATOM 11 O LEU A 6 -9.931 9.851 5.110 1.00 0.36 O ATOM 12 CB LEU A 6 -7.934 11.896 3.582 1.00 0.53 C ATOM 13 CG LEU A 6 -7.455 10.565 3.009 1.00 0.44 C ATOM 14 CD1 LEU A 6 -8.372 10.103 1.889 1.00 0.52 C ATOM 15 CD2 LEU A 6 -6.023 10.698 2.510 1.00 0.47 C ATOM 0 HA LEU A 6 -10.033 11.591 3.240 1.00 0.55 H new ATOM 0 HB2 LEU A 6 -7.792 12.667 2.825 1.00 0.53 H new ATOM 0 HB3 LEU A 6 -7.295 12.157 4.426 1.00 0.53 H new ATOM 0 HG LEU A 6 -7.482 9.814 3.799 1.00 0.44 H new ATOM 0 HD11 LEU A 6 -8.013 9.153 1.494 1.00 0.52 H new ATOM 0 HD12 LEU A 6 -9.383 9.977 2.275 1.00 0.52 H new ATOM 0 HD13 LEU A 6 -8.378 10.848 1.093 1.00 0.52 H new ATOM 0 HD21 LEU A 6 -5.689 9.743 2.103 1.00 0.47 H new ATOM 0 HD22 LEU A 6 -5.978 11.460 1.732 1.00 0.47 H new ATOM 0 HD23 LEU A 6 -5.375 10.986 3.338 1.00 0.47 H new ATOM 27 N ALA A 7 -9.446 11.609 6.437 1.00 0.44 N ATOM 28 CA ALA A 7 -9.608 10.892 7.695 1.00 0.41 C ATOM 29 C ALA A 7 -11.032 10.387 7.875 1.00 0.39 C ATOM 30 O ALA A 7 -11.278 9.442 8.624 1.00 0.44 O ATOM 31 CB ALA A 7 -9.243 11.802 8.853 1.00 0.53 C ATOM 0 H ALA A 7 -9.200 12.592 6.551 1.00 0.44 H new ATOM 0 HA ALA A 7 -8.944 10.028 7.674 1.00 0.41 H new ATOM 0 HB1 ALA A 7 -9.365 11.263 9.792 1.00 0.53 H new ATOM 0 HB2 ALA A 7 -8.206 12.123 8.751 1.00 0.53 H new ATOM 0 HB3 ALA A 7 -9.895 12.676 8.849 1.00 0.53 H new ATOM 37 N ASP A 8 -11.963 11.028 7.190 1.00 0.41 N ATOM 38 CA ASP A 8 -13.374 10.723 7.350 1.00 0.48 C ATOM 39 C ASP A 8 -13.784 9.521 6.502 1.00 0.44 C ATOM 40 O ASP A 8 -14.610 8.713 6.921 1.00 0.60 O ATOM 41 CB ASP A 8 -14.213 11.947 6.972 1.00 0.61 C ATOM 42 CG ASP A 8 -15.682 11.777 7.301 1.00 1.30 C ATOM 43 OD1 ASP A 8 -16.065 11.975 8.470 1.00 1.44 O ATOM 44 OD2 ASP A 8 -16.459 11.429 6.389 1.00 2.18 O ATOM 0 H ASP A 8 -11.766 11.766 6.515 1.00 0.41 H new ATOM 0 HA ASP A 8 -13.552 10.469 8.395 1.00 0.48 H new ATOM 0 HB2 ASP A 8 -13.827 12.822 7.495 1.00 0.61 H new ATOM 0 HB3 ASP A 8 -14.105 12.140 5.905 1.00 0.61 H new ATOM 49 N LYS A 9 -13.187 9.387 5.324 1.00 0.33 N ATOM 50 CA LYS A 9 -13.632 8.375 4.368 1.00 0.34 C ATOM 51 C LYS A 9 -12.825 7.088 4.497 1.00 0.29 C ATOM 52 O LYS A 9 -13.253 6.041 4.023 1.00 0.36 O ATOM 53 CB LYS A 9 -13.534 8.899 2.932 1.00 0.44 C ATOM 54 CG LYS A 9 -13.621 10.415 2.827 1.00 0.65 C ATOM 55 CD LYS A 9 -15.011 10.930 3.164 1.00 0.86 C ATOM 56 CE LYS A 9 -15.004 12.432 3.402 1.00 1.24 C ATOM 57 NZ LYS A 9 -14.479 13.185 2.234 1.00 1.79 N ATOM 0 H LYS A 9 -12.403 9.958 5.008 1.00 0.33 H new ATOM 0 HA LYS A 9 -14.674 8.154 4.599 1.00 0.34 H new ATOM 0 HB2 LYS A 9 -12.591 8.567 2.497 1.00 0.44 H new ATOM 0 HB3 LYS A 9 -14.333 8.456 2.338 1.00 0.44 H new ATOM 0 HG2 LYS A 9 -12.893 10.867 3.501 1.00 0.65 H new ATOM 0 HG3 LYS A 9 -13.355 10.724 1.816 1.00 0.65 H new ATOM 0 HD2 LYS A 9 -15.696 10.692 2.350 1.00 0.86 H new ATOM 0 HD3 LYS A 9 -15.384 10.421 4.053 1.00 0.86 H new ATOM 0 HE2 LYS A 9 -16.017 12.768 3.622 1.00 1.24 H new ATOM 0 HE3 LYS A 9 -14.396 12.656 4.279 1.00 1.24 H new ATOM 0 HZ1 LYS A 9 -14.634 14.203 2.379 1.00 1.79 H new ATOM 0 HZ2 LYS A 9 -13.461 13.001 2.131 1.00 1.79 H new ATOM 0 HZ3 LYS A 9 -14.975 12.879 1.372 1.00 1.79 H new ATOM 71 N VAL A 10 -11.647 7.167 5.108 1.00 0.26 N ATOM 72 CA VAL A 10 -10.824 5.981 5.314 1.00 0.24 C ATOM 73 C VAL A 10 -11.586 4.899 6.071 1.00 0.23 C ATOM 74 O VAL A 10 -12.269 5.176 7.057 1.00 0.30 O ATOM 75 CB VAL A 10 -9.531 6.323 6.076 1.00 0.28 C ATOM 76 CG1 VAL A 10 -9.839 6.945 7.430 1.00 0.33 C ATOM 77 CG2 VAL A 10 -8.654 5.090 6.241 1.00 0.28 C ATOM 0 H VAL A 10 -11.244 8.033 5.466 1.00 0.26 H new ATOM 0 HA VAL A 10 -10.563 5.602 4.326 1.00 0.24 H new ATOM 0 HB VAL A 10 -8.983 7.056 5.484 1.00 0.28 H new ATOM 0 HG11 VAL A 10 -8.906 7.176 7.945 1.00 0.33 H new ATOM 0 HG12 VAL A 10 -10.411 7.862 7.288 1.00 0.33 H new ATOM 0 HG13 VAL A 10 -10.420 6.244 8.029 1.00 0.33 H new ATOM 0 HG21 VAL A 10 -7.747 5.359 6.782 1.00 0.28 H new ATOM 0 HG22 VAL A 10 -9.198 4.329 6.800 1.00 0.28 H new ATOM 0 HG23 VAL A 10 -8.388 4.699 5.259 1.00 0.28 H new ATOM 87 N ILE A 11 -11.482 3.670 5.595 1.00 0.24 N ATOM 88 CA ILE A 11 -12.113 2.554 6.276 1.00 0.29 C ATOM 89 C ILE A 11 -11.065 1.642 6.891 1.00 0.26 C ATOM 90 O ILE A 11 -11.351 0.909 7.838 1.00 0.28 O ATOM 91 CB ILE A 11 -13.021 1.726 5.340 1.00 0.38 C ATOM 92 CG1 ILE A 11 -12.254 1.275 4.095 1.00 0.53 C ATOM 93 CG2 ILE A 11 -14.254 2.528 4.951 1.00 0.92 C ATOM 94 CD1 ILE A 11 -13.040 0.332 3.210 1.00 0.62 C ATOM 0 H ILE A 11 -10.972 3.421 4.748 1.00 0.24 H new ATOM 0 HA ILE A 11 -12.739 2.983 7.058 1.00 0.29 H new ATOM 0 HB ILE A 11 -13.344 0.835 5.878 1.00 0.38 H new ATOM 0 HG12 ILE A 11 -11.970 2.153 3.515 1.00 0.53 H new ATOM 0 HG13 ILE A 11 -11.331 0.785 4.404 1.00 0.53 H new ATOM 0 HG21 ILE A 11 -14.883 1.931 4.291 1.00 0.92 H new ATOM 0 HG22 ILE A 11 -14.815 2.791 5.848 1.00 0.92 H new ATOM 0 HG23 ILE A 11 -13.948 3.438 4.435 1.00 0.92 H new ATOM 0 HD11 ILE A 11 -12.435 0.054 2.347 1.00 0.62 H new ATOM 0 HD12 ILE A 11 -13.301 -0.563 3.774 1.00 0.62 H new ATOM 0 HD13 ILE A 11 -13.951 0.826 2.871 1.00 0.62 H new ATOM 106 N TRP A 12 -9.848 1.698 6.361 1.00 0.23 N ATOM 107 CA TRP A 12 -8.810 0.772 6.778 1.00 0.21 C ATOM 108 C TRP A 12 -7.463 1.207 6.190 1.00 0.21 C ATOM 109 O TRP A 12 -7.416 1.758 5.095 1.00 0.25 O ATOM 110 CB TRP A 12 -9.228 -0.618 6.288 1.00 0.23 C ATOM 111 CG TRP A 12 -8.400 -1.761 6.761 1.00 0.25 C ATOM 112 CD1 TRP A 12 -8.617 -2.545 7.857 1.00 0.31 C ATOM 113 CD2 TRP A 12 -7.248 -2.281 6.115 1.00 0.26 C ATOM 114 NE1 TRP A 12 -7.658 -3.527 7.923 1.00 0.33 N ATOM 115 CE2 TRP A 12 -6.803 -3.381 6.865 1.00 0.29 C ATOM 116 CE3 TRP A 12 -6.551 -1.913 4.971 1.00 0.30 C ATOM 117 CZ2 TRP A 12 -5.690 -4.122 6.495 1.00 0.33 C ATOM 118 CZ3 TRP A 12 -5.448 -2.641 4.606 1.00 0.36 C ATOM 119 CH2 TRP A 12 -5.023 -3.736 5.364 1.00 0.36 C ATOM 0 H TRP A 12 -9.561 2.369 5.649 1.00 0.23 H new ATOM 0 HA TRP A 12 -8.691 0.757 7.861 1.00 0.21 H new ATOM 0 HB2 TRP A 12 -10.259 -0.793 6.594 1.00 0.23 H new ATOM 0 HB3 TRP A 12 -9.216 -0.615 5.198 1.00 0.23 H new ATOM 0 HD1 TRP A 12 -9.421 -2.413 8.566 1.00 0.31 H new ATOM 0 HE1 TRP A 12 -7.594 -4.247 8.643 1.00 0.33 H new ATOM 0 HE3 TRP A 12 -6.872 -1.068 4.380 1.00 0.30 H new ATOM 0 HZ2 TRP A 12 -5.363 -4.971 7.077 1.00 0.33 H new ATOM 0 HZ3 TRP A 12 -4.899 -2.364 3.718 1.00 0.36 H new ATOM 0 HH2 TRP A 12 -4.150 -4.289 5.050 1.00 0.36 H new ATOM 130 N ALA A 13 -6.377 0.987 6.921 1.00 0.23 N ATOM 131 CA ALA A 13 -5.051 1.396 6.456 1.00 0.23 C ATOM 132 C ALA A 13 -3.956 0.685 7.237 1.00 0.25 C ATOM 133 O ALA A 13 -4.052 0.544 8.455 1.00 0.26 O ATOM 134 CB ALA A 13 -4.883 2.902 6.581 1.00 0.25 C ATOM 0 H ALA A 13 -6.384 0.531 7.833 1.00 0.23 H new ATOM 0 HA ALA A 13 -4.964 1.116 5.406 1.00 0.23 H new ATOM 0 HB1 ALA A 13 -3.891 3.188 6.231 1.00 0.25 H new ATOM 0 HB2 ALA A 13 -5.639 3.404 5.978 1.00 0.25 H new ATOM 0 HB3 ALA A 13 -4.998 3.196 7.624 1.00 0.25 H new ATOM 140 N VAL A 14 -2.916 0.244 6.535 1.00 0.27 N ATOM 141 CA VAL A 14 -1.810 -0.482 7.144 1.00 0.27 C ATOM 142 C VAL A 14 -0.482 -0.179 6.441 1.00 0.26 C ATOM 143 O VAL A 14 -0.351 -0.416 5.247 1.00 0.33 O ATOM 144 CB VAL A 14 -2.017 -2.005 7.084 1.00 0.33 C ATOM 145 CG1 VAL A 14 -0.818 -2.732 7.671 1.00 0.70 C ATOM 146 CG2 VAL A 14 -3.281 -2.400 7.807 1.00 0.79 C ATOM 0 H VAL A 14 -2.818 0.381 5.529 1.00 0.27 H new ATOM 0 HA VAL A 14 -1.779 -0.149 8.181 1.00 0.27 H new ATOM 0 HB VAL A 14 -2.116 -2.294 6.038 1.00 0.33 H new ATOM 0 HG11 VAL A 14 -0.984 -3.808 7.619 1.00 0.70 H new ATOM 0 HG12 VAL A 14 0.077 -2.475 7.104 1.00 0.70 H new ATOM 0 HG13 VAL A 14 -0.686 -2.435 8.711 1.00 0.70 H new ATOM 0 HG21 VAL A 14 -3.409 -3.481 7.753 1.00 0.79 H new ATOM 0 HG22 VAL A 14 -3.213 -2.095 8.851 1.00 0.79 H new ATOM 0 HG23 VAL A 14 -4.135 -1.910 7.340 1.00 0.79 H new ATOM 156 N ASN A 15 0.501 0.326 7.176 1.00 0.26 N ATOM 157 CA ASN A 15 1.864 0.395 6.654 1.00 0.28 C ATOM 158 C ASN A 15 2.698 -0.716 7.256 1.00 0.28 C ATOM 159 O ASN A 15 3.163 -0.604 8.390 1.00 0.34 O ATOM 160 CB ASN A 15 2.578 1.725 6.937 1.00 0.32 C ATOM 161 CG ASN A 15 3.970 1.715 6.326 1.00 0.50 C ATOM 162 OD1 ASN A 15 4.181 1.193 5.236 1.00 1.49 O ATOM 163 ND2 ASN A 15 4.938 2.241 7.055 1.00 0.83 N ATOM 0 H ASN A 15 0.385 0.689 8.122 1.00 0.26 H new ATOM 0 HA ASN A 15 1.769 0.297 5.573 1.00 0.28 H new ATOM 0 HB2 ASN A 15 1.999 2.552 6.526 1.00 0.32 H new ATOM 0 HB3 ASN A 15 2.646 1.888 8.013 1.00 0.32 H new ATOM 0 HD21 ASN A 15 5.900 2.222 6.716 1.00 0.83 H new ATOM 0 HD22 ASN A 15 4.724 2.667 7.957 1.00 0.83 H new ATOM 170 N ALA A 16 2.878 -1.789 6.510 1.00 0.33 N ATOM 171 CA ALA A 16 3.735 -2.867 6.952 1.00 0.39 C ATOM 172 C ALA A 16 5.167 -2.370 7.039 1.00 0.37 C ATOM 173 O ALA A 16 5.814 -2.143 6.002 1.00 0.38 O ATOM 174 CB ALA A 16 3.642 -4.060 6.015 1.00 0.48 C ATOM 0 H ALA A 16 2.443 -1.935 5.599 1.00 0.33 H new ATOM 0 HA ALA A 16 3.405 -3.195 7.938 1.00 0.39 H new ATOM 0 HB1 ALA A 16 4.297 -4.855 6.372 1.00 0.48 H new ATOM 0 HB2 ALA A 16 2.614 -4.422 5.987 1.00 0.48 H new ATOM 0 HB3 ALA A 16 3.948 -3.760 5.013 1.00 0.48 H new ATOM 180 N GLY A 17 5.629 -2.159 8.275 1.00 0.40 N ATOM 181 CA GLY A 17 6.986 -1.714 8.508 1.00 0.45 C ATOM 182 C GLY A 17 7.175 -1.042 9.854 1.00 0.49 C ATOM 183 O GLY A 17 8.125 -1.343 10.583 1.00 0.76 O ATOM 0 H GLY A 17 5.076 -2.292 9.122 1.00 0.40 H new ATOM 0 HA2 GLY A 17 7.658 -2.569 8.439 1.00 0.45 H new ATOM 0 HA3 GLY A 17 7.273 -1.019 7.719 1.00 0.45 H new ATOM 187 N GLY A 18 6.277 -0.132 10.182 1.00 0.57 N ATOM 188 CA GLY A 18 6.417 0.648 11.400 1.00 0.66 C ATOM 189 C GLY A 18 5.501 0.173 12.507 1.00 0.57 C ATOM 190 O GLY A 18 5.435 -1.018 12.790 1.00 0.74 O ATOM 0 H GLY A 18 5.449 0.085 9.628 1.00 0.57 H new ATOM 0 HA2 GLY A 18 7.451 0.597 11.742 1.00 0.66 H new ATOM 0 HA3 GLY A 18 6.205 1.695 11.183 1.00 0.66 H new ATOM 194 N GLU A 19 4.811 1.115 13.147 1.00 0.53 N ATOM 195 CA GLU A 19 3.811 0.793 14.162 1.00 0.50 C ATOM 196 C GLU A 19 2.805 1.921 14.321 1.00 0.45 C ATOM 197 O GLU A 19 3.193 3.041 14.642 1.00 0.64 O ATOM 198 CB GLU A 19 4.445 0.530 15.524 1.00 0.69 C ATOM 199 CG GLU A 19 4.823 -0.914 15.770 1.00 1.27 C ATOM 200 CD GLU A 19 5.295 -1.140 17.183 1.00 1.45 C ATOM 201 OE1 GLU A 19 4.451 -1.179 18.099 1.00 1.75 O ATOM 202 OE2 GLU A 19 6.518 -1.285 17.385 1.00 1.77 O ATOM 0 H GLU A 19 4.928 2.114 12.979 1.00 0.53 H new ATOM 0 HA GLU A 19 3.310 -0.111 13.816 1.00 0.50 H new ATOM 0 HB2 GLU A 19 5.338 1.148 15.621 1.00 0.69 H new ATOM 0 HB3 GLU A 19 3.751 0.849 16.302 1.00 0.69 H new ATOM 0 HG2 GLU A 19 3.964 -1.553 15.568 1.00 1.27 H new ATOM 0 HG3 GLU A 19 5.609 -1.207 15.074 1.00 1.27 H new ATOM 209 N SER A 20 1.528 1.598 14.079 1.00 0.42 N ATOM 210 CA SER A 20 0.385 2.489 14.345 1.00 0.42 C ATOM 211 C SER A 20 0.693 3.967 14.097 1.00 0.38 C ATOM 212 O SER A 20 1.100 4.681 15.012 1.00 0.44 O ATOM 213 CB SER A 20 -0.096 2.279 15.785 1.00 0.59 C ATOM 214 OG SER A 20 0.996 2.151 16.683 1.00 1.29 O ATOM 0 H SER A 20 1.253 0.697 13.687 1.00 0.42 H new ATOM 0 HA SER A 20 -0.401 2.223 13.638 1.00 0.42 H new ATOM 0 HB2 SER A 20 -0.721 3.119 16.087 1.00 0.59 H new ATOM 0 HB3 SER A 20 -0.717 1.385 15.836 1.00 0.59 H new ATOM 0 HG SER A 20 1.591 2.924 16.587 1.00 1.29 H new ATOM 220 N HIS A 21 0.466 4.448 12.881 1.00 0.34 N ATOM 221 CA HIS A 21 0.849 5.823 12.566 1.00 0.33 C ATOM 222 C HIS A 21 -0.280 6.579 11.894 1.00 0.32 C ATOM 223 O HIS A 21 -0.904 6.083 10.965 1.00 0.32 O ATOM 224 CB HIS A 21 2.109 5.874 11.687 1.00 0.35 C ATOM 225 CG HIS A 21 2.427 7.256 11.181 1.00 0.35 C ATOM 226 ND1 HIS A 21 2.218 7.822 9.970 1.00 0.41 N flip ATOM 227 CD2 HIS A 21 2.968 8.246 11.968 1.00 0.40 C flip ATOM 228 CE1 HIS A 21 2.622 9.127 10.048 1.00 0.42 C flip ATOM 229 NE2 HIS A 21 3.071 9.357 11.265 1.00 0.41 N flip ATOM 0 H HIS A 21 0.033 3.928 12.117 1.00 0.34 H new ATOM 0 HA HIS A 21 1.071 6.309 13.516 1.00 0.33 H new ATOM 0 HB2 HIS A 21 2.958 5.500 12.259 1.00 0.35 H new ATOM 0 HB3 HIS A 21 1.978 5.205 10.837 1.00 0.35 H new ATOM 0 HD1 HIS A 21 1.830 7.360 9.148 1.00 0.41 H new ATOM 0 HD2 HIS A 21 3.263 8.131 13.001 1.00 0.40 H new ATOM 0 HE1 HIS A 21 2.580 9.848 9.245 1.00 0.42 H new ATOM 238 N VAL A 22 -0.517 7.788 12.362 1.00 0.41 N ATOM 239 CA VAL A 22 -1.513 8.657 11.769 1.00 0.40 C ATOM 240 C VAL A 22 -0.855 9.596 10.763 1.00 0.40 C ATOM 241 O VAL A 22 0.004 10.402 11.121 1.00 0.48 O ATOM 242 CB VAL A 22 -2.241 9.490 12.840 1.00 0.49 C ATOM 243 CG1 VAL A 22 -3.333 10.346 12.217 1.00 0.84 C ATOM 244 CG2 VAL A 22 -2.816 8.591 13.920 1.00 1.01 C ATOM 0 H VAL A 22 -0.028 8.194 13.160 1.00 0.41 H new ATOM 0 HA VAL A 22 -2.245 8.026 11.264 1.00 0.40 H new ATOM 0 HB VAL A 22 -1.512 10.157 13.300 1.00 0.49 H new ATOM 0 HG11 VAL A 22 -3.831 10.924 12.996 1.00 0.84 H new ATOM 0 HG12 VAL A 22 -2.891 11.025 11.488 1.00 0.84 H new ATOM 0 HG13 VAL A 22 -4.060 9.703 11.721 1.00 0.84 H new ATOM 0 HG21 VAL A 22 -3.326 9.200 14.667 1.00 1.01 H new ATOM 0 HG22 VAL A 22 -3.525 7.894 13.474 1.00 1.01 H new ATOM 0 HG23 VAL A 22 -2.010 8.033 14.396 1.00 1.01 H new ATOM 254 N ASP A 23 -1.235 9.455 9.504 1.00 0.37 N ATOM 255 CA ASP A 23 -0.757 10.331 8.442 1.00 0.42 C ATOM 256 C ASP A 23 -1.390 11.707 8.586 1.00 0.36 C ATOM 257 O ASP A 23 -2.467 11.833 9.161 1.00 0.33 O ATOM 258 CB ASP A 23 -1.096 9.723 7.076 1.00 0.51 C ATOM 259 CG ASP A 23 -1.194 10.759 5.975 1.00 0.55 C ATOM 260 OD1 ASP A 23 -0.148 11.168 5.438 1.00 0.75 O ATOM 261 OD2 ASP A 23 -2.323 11.191 5.675 1.00 0.77 O ATOM 0 H ASP A 23 -1.882 8.733 9.188 1.00 0.37 H new ATOM 0 HA ASP A 23 0.325 10.436 8.518 1.00 0.42 H new ATOM 0 HB2 ASP A 23 -0.334 8.990 6.811 1.00 0.51 H new ATOM 0 HB3 ASP A 23 -2.042 9.187 7.148 1.00 0.51 H new ATOM 266 N VAL A 24 -0.716 12.721 8.039 1.00 0.38 N ATOM 267 CA VAL A 24 -1.096 14.127 8.208 1.00 0.37 C ATOM 268 C VAL A 24 -2.480 14.452 7.654 1.00 0.38 C ATOM 269 O VAL A 24 -3.021 15.524 7.928 1.00 0.49 O ATOM 270 CB VAL A 24 -0.067 15.065 7.540 1.00 0.42 C ATOM 271 CG1 VAL A 24 1.208 15.144 8.359 1.00 0.59 C ATOM 272 CG2 VAL A 24 0.255 14.592 6.133 1.00 0.62 C ATOM 0 H VAL A 24 0.115 12.590 7.462 1.00 0.38 H new ATOM 0 HA VAL A 24 -1.118 14.291 9.285 1.00 0.37 H new ATOM 0 HB VAL A 24 -0.510 16.060 7.487 1.00 0.42 H new ATOM 0 HG11 VAL A 24 1.916 15.811 7.867 1.00 0.59 H new ATOM 0 HG12 VAL A 24 0.979 15.528 9.353 1.00 0.59 H new ATOM 0 HG13 VAL A 24 1.646 14.150 8.446 1.00 0.59 H new ATOM 0 HG21 VAL A 24 0.982 15.266 5.680 1.00 0.62 H new ATOM 0 HG22 VAL A 24 0.670 13.585 6.174 1.00 0.62 H new ATOM 0 HG23 VAL A 24 -0.656 14.585 5.534 1.00 0.62 H new ATOM 282 N HIS A 25 -3.047 13.551 6.867 1.00 0.37 N ATOM 283 CA HIS A 25 -4.401 13.737 6.360 1.00 0.43 C ATOM 284 C HIS A 25 -5.389 13.047 7.293 1.00 0.40 C ATOM 285 O HIS A 25 -6.601 13.089 7.088 1.00 0.51 O ATOM 286 CB HIS A 25 -4.525 13.191 4.934 1.00 0.53 C ATOM 287 CG HIS A 25 -3.486 13.736 4.001 1.00 0.61 C ATOM 288 ND1 HIS A 25 -3.495 15.031 3.533 1.00 0.73 N ATOM 289 CD2 HIS A 25 -2.374 13.162 3.482 1.00 0.72 C ATOM 290 CE1 HIS A 25 -2.438 15.227 2.769 1.00 0.86 C ATOM 291 NE2 HIS A 25 -1.737 14.108 2.721 1.00 0.86 N ATOM 0 H HIS A 25 -2.595 12.688 6.566 1.00 0.37 H new ATOM 0 HA HIS A 25 -4.628 14.803 6.327 1.00 0.43 H new ATOM 0 HB2 HIS A 25 -4.447 12.104 4.960 1.00 0.53 H new ATOM 0 HB3 HIS A 25 -5.515 13.430 4.545 1.00 0.53 H new ATOM 0 HD2 HIS A 25 -2.048 12.144 3.639 1.00 0.72 H new ATOM 0 HE1 HIS A 25 -2.187 16.149 2.266 1.00 0.86 H new ATOM 0 HE2 HIS A 25 -0.868 13.971 2.205 1.00 0.86 H new ATOM 300 N GLY A 26 -4.838 12.429 8.329 1.00 0.32 N ATOM 301 CA GLY A 26 -5.630 11.773 9.345 1.00 0.33 C ATOM 302 C GLY A 26 -5.832 10.295 9.070 1.00 0.30 C ATOM 303 O GLY A 26 -6.857 9.722 9.442 1.00 0.33 O ATOM 0 H GLY A 26 -3.831 12.372 8.483 1.00 0.32 H new ATOM 0 HA2 GLY A 26 -5.144 11.895 10.313 1.00 0.33 H new ATOM 0 HA3 GLY A 26 -6.602 12.261 9.413 1.00 0.33 H new ATOM 307 N ILE A 27 -4.859 9.664 8.426 1.00 0.26 N ATOM 308 CA ILE A 27 -5.000 8.254 8.068 1.00 0.24 C ATOM 309 C ILE A 27 -4.172 7.366 9.005 1.00 0.26 C ATOM 310 O ILE A 27 -2.943 7.365 8.959 1.00 0.28 O ATOM 311 CB ILE A 27 -4.635 7.991 6.586 1.00 0.24 C ATOM 312 CG1 ILE A 27 -5.613 8.717 5.662 1.00 0.26 C ATOM 313 CG2 ILE A 27 -4.663 6.505 6.273 1.00 0.27 C ATOM 314 CD1 ILE A 27 -7.053 8.478 6.026 1.00 0.31 C ATOM 0 H ILE A 27 -3.978 10.094 8.144 1.00 0.26 H new ATOM 0 HA ILE A 27 -6.051 7.994 8.190 1.00 0.24 H new ATOM 0 HB ILE A 27 -3.626 8.368 6.421 1.00 0.24 H new ATOM 0 HG12 ILE A 27 -5.409 9.787 5.694 1.00 0.26 H new ATOM 0 HG13 ILE A 27 -5.445 8.391 4.636 1.00 0.26 H new ATOM 0 HG21 ILE A 27 -4.403 6.349 5.226 1.00 0.27 H new ATOM 0 HG22 ILE A 27 -3.944 5.986 6.907 1.00 0.27 H new ATOM 0 HG23 ILE A 27 -5.662 6.112 6.461 1.00 0.27 H new ATOM 0 HD11 ILE A 27 -7.698 9.020 5.334 1.00 0.31 H new ATOM 0 HD12 ILE A 27 -7.271 7.412 5.967 1.00 0.31 H new ATOM 0 HD13 ILE A 27 -7.235 8.829 7.042 1.00 0.31 H new ATOM 326 N HIS A 28 -4.860 6.618 9.863 1.00 0.31 N ATOM 327 CA HIS A 28 -4.207 5.830 10.909 1.00 0.33 C ATOM 328 C HIS A 28 -3.913 4.408 10.435 1.00 0.33 C ATOM 329 O HIS A 28 -4.827 3.621 10.195 1.00 0.39 O ATOM 330 CB HIS A 28 -5.101 5.798 12.155 1.00 0.40 C ATOM 331 CG HIS A 28 -4.472 5.217 13.392 1.00 0.49 C ATOM 332 ND1 HIS A 28 -4.403 5.910 14.578 1.00 0.60 N ATOM 333 CD2 HIS A 28 -3.904 4.012 13.633 1.00 0.80 C ATOM 334 CE1 HIS A 28 -3.816 5.164 15.491 1.00 0.66 C ATOM 335 NE2 HIS A 28 -3.502 4.002 14.947 1.00 0.78 N ATOM 0 H HIS A 28 -5.877 6.540 9.855 1.00 0.31 H new ATOM 0 HA HIS A 28 -3.254 6.301 11.151 1.00 0.33 H new ATOM 0 HB2 HIS A 28 -5.422 6.816 12.376 1.00 0.40 H new ATOM 0 HB3 HIS A 28 -5.998 5.225 11.922 1.00 0.40 H new ATOM 0 HD2 HIS A 28 -3.788 3.207 12.923 1.00 0.80 H new ATOM 0 HE1 HIS A 28 -3.624 5.454 16.513 1.00 0.66 H new ATOM 0 HE2 HIS A 28 -3.039 3.227 15.422 1.00 0.78 H new ATOM 344 N TYR A 29 -2.634 4.087 10.322 1.00 0.32 N ATOM 345 CA TYR A 29 -2.210 2.749 9.947 1.00 0.35 C ATOM 346 C TYR A 29 -2.298 1.796 11.138 1.00 0.40 C ATOM 347 O TYR A 29 -1.810 2.102 12.235 1.00 0.44 O ATOM 348 CB TYR A 29 -0.790 2.783 9.349 1.00 0.42 C ATOM 349 CG TYR A 29 0.211 1.815 9.962 1.00 0.65 C ATOM 350 CD1 TYR A 29 0.008 0.442 9.919 1.00 0.80 C ATOM 351 CD2 TYR A 29 1.366 2.279 10.569 1.00 0.98 C ATOM 352 CE1 TYR A 29 0.911 -0.434 10.468 1.00 1.17 C ATOM 353 CE2 TYR A 29 2.278 1.402 11.118 1.00 1.30 C ATOM 354 CZ TYR A 29 2.041 0.046 11.065 1.00 1.39 C ATOM 355 OH TYR A 29 2.926 -0.829 11.636 1.00 1.75 O ATOM 0 H TYR A 29 -1.868 4.740 10.486 1.00 0.32 H new ATOM 0 HA TYR A 29 -2.886 2.372 9.179 1.00 0.35 H new ATOM 0 HB2 TYR A 29 -0.861 2.575 8.281 1.00 0.42 H new ATOM 0 HB3 TYR A 29 -0.398 3.795 9.451 1.00 0.42 H new ATOM 0 HD1 TYR A 29 -0.881 0.055 9.443 1.00 0.80 H new ATOM 0 HD2 TYR A 29 1.555 3.341 10.613 1.00 0.98 H new ATOM 0 HE1 TYR A 29 0.728 -1.498 10.428 1.00 1.17 H new ATOM 0 HE2 TYR A 29 3.175 1.777 11.588 1.00 1.30 H new ATOM 0 HH TYR A 29 2.984 -1.640 11.088 1.00 1.75 H new ATOM 365 N ARG A 30 -2.923 0.649 10.872 1.00 0.50 N ATOM 366 CA ARG A 30 -3.109 -0.444 11.830 1.00 0.64 C ATOM 367 C ARG A 30 -1.788 -1.144 12.147 1.00 0.76 C ATOM 368 O ARG A 30 -1.320 -1.945 11.346 1.00 1.46 O ATOM 369 CB ARG A 30 -4.052 -1.486 11.224 1.00 0.83 C ATOM 370 CG ARG A 30 -5.541 -1.179 11.292 1.00 0.73 C ATOM 371 CD ARG A 30 -5.904 0.248 10.904 1.00 0.93 C ATOM 372 NE ARG A 30 -7.354 0.443 10.948 1.00 1.52 N ATOM 373 CZ ARG A 30 -7.998 1.517 10.493 1.00 2.17 C ATOM 374 NH1 ARG A 30 -7.332 2.546 9.989 1.00 2.48 N ATOM 375 NH2 ARG A 30 -9.322 1.563 10.569 1.00 2.94 N ATOM 0 H ARG A 30 -3.326 0.448 9.957 1.00 0.50 H new ATOM 0 HA ARG A 30 -3.517 -0.017 12.746 1.00 0.64 H new ATOM 0 HB2 ARG A 30 -3.780 -1.624 10.178 1.00 0.83 H new ATOM 0 HB3 ARG A 30 -3.877 -2.437 11.727 1.00 0.83 H new ATOM 0 HG2 ARG A 30 -6.073 -1.868 10.636 1.00 0.73 H new ATOM 0 HG3 ARG A 30 -5.893 -1.368 12.306 1.00 0.73 H new ATOM 0 HD2 ARG A 30 -5.417 0.949 11.581 1.00 0.93 H new ATOM 0 HD3 ARG A 30 -5.533 0.463 9.902 1.00 0.93 H new ATOM 0 HE ARG A 30 -7.916 -0.302 11.360 1.00 1.52 H new ATOM 0 HH11 ARG A 30 -6.313 2.522 9.946 1.00 2.48 H new ATOM 0 HH12 ARG A 30 -7.838 3.362 9.644 1.00 2.48 H new ATOM 0 HH21 ARG A 30 -9.837 0.781 10.973 1.00 2.94 H new ATOM 0 HH22 ARG A 30 -9.825 2.381 10.224 1.00 2.94 H new ATOM 389 N LYS A 31 -1.218 -0.836 13.309 1.00 0.59 N ATOM 390 CA LYS A 31 0.054 -1.413 13.783 1.00 0.67 C ATOM 391 C LYS A 31 0.220 -2.906 13.461 1.00 0.86 C ATOM 392 O LYS A 31 -0.276 -3.755 14.202 1.00 1.37 O ATOM 393 CB LYS A 31 0.156 -1.235 15.299 1.00 0.99 C ATOM 394 CG LYS A 31 1.479 -1.706 15.881 1.00 1.25 C ATOM 395 CD LYS A 31 1.340 -2.119 17.341 1.00 1.61 C ATOM 396 CE LYS A 31 1.024 -0.939 18.246 1.00 2.18 C ATOM 397 NZ LYS A 31 2.091 0.093 18.199 1.00 2.78 N ATOM 0 H LYS A 31 -1.627 -0.169 13.964 1.00 0.59 H new ATOM 0 HA LYS A 31 0.844 -0.880 13.254 1.00 0.67 H new ATOM 0 HB2 LYS A 31 0.016 -0.182 15.543 1.00 0.99 H new ATOM 0 HB3 LYS A 31 -0.657 -1.783 15.776 1.00 0.99 H new ATOM 0 HG2 LYS A 31 1.853 -2.548 15.299 1.00 1.25 H new ATOM 0 HG3 LYS A 31 2.217 -0.908 15.798 1.00 1.25 H new ATOM 0 HD2 LYS A 31 0.551 -2.865 17.432 1.00 1.61 H new ATOM 0 HD3 LYS A 31 2.265 -2.591 17.673 1.00 1.61 H new ATOM 0 HE2 LYS A 31 0.075 -0.495 17.946 1.00 2.18 H new ATOM 0 HE3 LYS A 31 0.902 -1.289 19.271 1.00 2.18 H new ATOM 0 HZ1 LYS A 31 2.254 0.468 19.155 1.00 2.78 H new ATOM 0 HZ2 LYS A 31 2.969 -0.332 17.839 1.00 2.78 H new ATOM 0 HZ3 LYS A 31 1.798 0.867 17.569 1.00 2.78 H new ATOM 411 N ASP A 32 0.920 -3.185 12.353 1.00 0.75 N ATOM 412 CA ASP A 32 1.220 -4.548 11.872 1.00 1.00 C ATOM 413 C ASP A 32 0.144 -5.572 12.244 1.00 0.93 C ATOM 414 O ASP A 32 0.313 -6.372 13.163 1.00 1.29 O ATOM 415 CB ASP A 32 2.579 -5.003 12.395 1.00 1.58 C ATOM 416 CG ASP A 32 3.716 -4.124 11.914 1.00 1.92 C ATOM 417 OD1 ASP A 32 3.530 -3.390 10.915 1.00 2.41 O ATOM 418 OD2 ASP A 32 4.805 -4.186 12.526 1.00 2.36 O ATOM 0 H ASP A 32 1.303 -2.457 11.751 1.00 0.75 H new ATOM 0 HA ASP A 32 1.238 -4.496 10.783 1.00 1.00 H new ATOM 0 HB2 ASP A 32 2.562 -5.004 13.485 1.00 1.58 H new ATOM 0 HB3 ASP A 32 2.760 -6.030 12.078 1.00 1.58 H new ATOM 423 N PRO A 33 -0.971 -5.583 11.514 1.00 0.72 N ATOM 424 CA PRO A 33 -2.149 -6.357 11.878 1.00 0.89 C ATOM 425 C PRO A 33 -2.261 -7.705 11.168 1.00 1.04 C ATOM 426 O PRO A 33 -3.249 -8.413 11.345 1.00 1.87 O ATOM 427 CB PRO A 33 -3.250 -5.434 11.387 1.00 0.99 C ATOM 428 CG PRO A 33 -2.702 -4.903 10.104 1.00 0.86 C ATOM 429 CD PRO A 33 -1.201 -4.823 10.279 1.00 0.69 C ATOM 0 HA PRO A 33 -2.160 -6.619 12.936 1.00 0.89 H new ATOM 0 HB2 PRO A 33 -4.187 -5.970 11.234 1.00 0.99 H new ATOM 0 HB3 PRO A 33 -3.453 -4.635 12.100 1.00 0.99 H new ATOM 0 HG2 PRO A 33 -2.961 -5.557 9.271 1.00 0.86 H new ATOM 0 HG3 PRO A 33 -3.119 -3.921 9.881 1.00 0.86 H new ATOM 0 HD2 PRO A 33 -0.672 -5.260 9.432 1.00 0.69 H new ATOM 0 HD3 PRO A 33 -0.860 -3.792 10.370 1.00 0.69 H new ATOM 682 N ILE A 50 12.182 8.905 2.203 1.00 0.66 N ATOM 683 CA ILE A 50 11.393 8.524 1.044 1.00 0.48 C ATOM 684 C ILE A 50 11.252 9.731 0.103 1.00 0.70 C ATOM 685 O ILE A 50 10.726 9.631 -1.008 1.00 1.59 O ATOM 686 CB ILE A 50 10.013 7.935 1.480 1.00 0.38 C ATOM 687 CG1 ILE A 50 9.875 6.516 0.941 1.00 0.42 C ATOM 688 CG2 ILE A 50 8.842 8.783 1.017 1.00 0.42 C ATOM 689 CD1 ILE A 50 10.912 5.572 1.497 1.00 0.51 C ATOM 0 HA ILE A 50 11.903 7.732 0.495 1.00 0.48 H new ATOM 0 HB ILE A 50 9.988 7.930 2.570 1.00 0.38 H new ATOM 0 HG12 ILE A 50 8.881 6.137 1.180 1.00 0.42 H new ATOM 0 HG13 ILE A 50 9.955 6.536 -0.146 1.00 0.42 H new ATOM 0 HG21 ILE A 50 7.909 8.327 1.348 1.00 0.42 H new ATOM 0 HG22 ILE A 50 8.927 9.783 1.441 1.00 0.42 H new ATOM 0 HG23 ILE A 50 8.848 8.849 -0.071 1.00 0.42 H new ATOM 0 HD11 ILE A 50 10.762 4.578 1.076 1.00 0.51 H new ATOM 0 HD12 ILE A 50 11.908 5.930 1.235 1.00 0.51 H new ATOM 0 HD13 ILE A 50 10.817 5.525 2.582 1.00 0.51 H new ATOM 701 N LEU A 51 11.770 10.862 0.581 1.00 0.60 N ATOM 702 CA LEU A 51 11.869 12.122 -0.169 1.00 0.60 C ATOM 703 C LEU A 51 10.508 12.763 -0.420 1.00 0.62 C ATOM 704 O LEU A 51 10.295 13.931 -0.101 1.00 0.90 O ATOM 705 CB LEU A 51 12.611 11.914 -1.496 1.00 0.66 C ATOM 706 CG LEU A 51 12.813 13.179 -2.336 1.00 0.92 C ATOM 707 CD1 LEU A 51 13.647 14.201 -1.577 1.00 1.51 C ATOM 708 CD2 LEU A 51 13.474 12.833 -3.660 1.00 1.91 C ATOM 0 H LEU A 51 12.144 10.933 1.527 1.00 0.60 H new ATOM 0 HA LEU A 51 12.441 12.810 0.454 1.00 0.60 H new ATOM 0 HB2 LEU A 51 13.587 11.479 -1.283 1.00 0.66 H new ATOM 0 HB3 LEU A 51 12.060 11.186 -2.092 1.00 0.66 H new ATOM 0 HG LEU A 51 11.836 13.618 -2.538 1.00 0.92 H new ATOM 0 HD11 LEU A 51 13.779 15.092 -2.191 1.00 1.51 H new ATOM 0 HD12 LEU A 51 13.138 14.470 -0.651 1.00 1.51 H new ATOM 0 HD13 LEU A 51 14.622 13.774 -1.344 1.00 1.51 H new ATOM 0 HD21 LEU A 51 13.611 13.741 -4.246 1.00 1.91 H new ATOM 0 HD22 LEU A 51 14.444 12.372 -3.473 1.00 1.91 H new ATOM 0 HD23 LEU A 51 12.842 12.137 -4.212 1.00 1.91 H new ATOM 720 N ARG A 52 9.591 11.996 -0.984 1.00 0.56 N ATOM 721 CA ARG A 52 8.290 12.515 -1.379 1.00 0.60 C ATOM 722 C ARG A 52 7.437 12.884 -0.169 1.00 0.59 C ATOM 723 O ARG A 52 6.519 13.698 -0.270 1.00 0.83 O ATOM 724 CB ARG A 52 7.548 11.481 -2.229 1.00 0.70 C ATOM 725 CG ARG A 52 8.261 11.123 -3.522 1.00 0.93 C ATOM 726 CD ARG A 52 8.333 12.306 -4.474 1.00 1.14 C ATOM 727 NE ARG A 52 7.008 12.758 -4.896 1.00 1.80 N ATOM 728 CZ ARG A 52 6.798 13.825 -5.669 1.00 2.47 C ATOM 729 NH1 ARG A 52 7.828 14.539 -6.106 1.00 2.72 N ATOM 730 NH2 ARG A 52 5.562 14.179 -5.997 1.00 3.17 N ATOM 0 H ARG A 52 9.724 11.004 -1.180 1.00 0.56 H new ATOM 0 HA ARG A 52 8.462 13.420 -1.962 1.00 0.60 H new ATOM 0 HB2 ARG A 52 7.407 10.575 -1.640 1.00 0.70 H new ATOM 0 HB3 ARG A 52 6.556 11.865 -2.467 1.00 0.70 H new ATOM 0 HG2 ARG A 52 9.269 10.776 -3.297 1.00 0.93 H new ATOM 0 HG3 ARG A 52 7.741 10.297 -4.007 1.00 0.93 H new ATOM 0 HD2 ARG A 52 8.858 13.129 -3.989 1.00 1.14 H new ATOM 0 HD3 ARG A 52 8.917 12.029 -5.352 1.00 1.14 H new ATOM 0 HE ARG A 52 6.197 12.226 -4.581 1.00 1.80 H new ATOM 0 HH11 ARG A 52 8.779 14.272 -5.851 1.00 2.72 H new ATOM 0 HH12 ARG A 52 7.669 15.355 -6.697 1.00 2.72 H new ATOM 0 HH21 ARG A 52 4.769 13.635 -5.658 1.00 3.17 H new ATOM 0 HH22 ARG A 52 5.405 14.995 -6.588 1.00 3.17 H new ATOM 744 N SER A 53 7.758 12.299 0.974 1.00 0.49 N ATOM 745 CA SER A 53 6.904 12.407 2.142 1.00 0.47 C ATOM 746 C SER A 53 7.548 13.194 3.281 1.00 0.46 C ATOM 747 O SER A 53 8.768 13.164 3.478 1.00 0.54 O ATOM 748 CB SER A 53 6.516 11.007 2.612 1.00 0.47 C ATOM 749 OG SER A 53 5.160 10.753 2.328 1.00 0.97 O ATOM 0 H SER A 53 8.603 11.746 1.116 1.00 0.49 H new ATOM 0 HA SER A 53 6.015 12.966 1.850 1.00 0.47 H new ATOM 0 HB2 SER A 53 7.143 10.264 2.119 1.00 0.47 H new ATOM 0 HB3 SER A 53 6.694 10.914 3.683 1.00 0.47 H new ATOM 0 HG SER A 53 4.945 9.825 2.560 1.00 0.97 H new ATOM 755 N ASN A 54 6.694 13.904 4.012 1.00 0.46 N ATOM 756 CA ASN A 54 7.081 14.646 5.209 1.00 0.48 C ATOM 757 C ASN A 54 7.445 13.658 6.322 1.00 0.44 C ATOM 758 O ASN A 54 6.836 12.600 6.417 1.00 0.42 O ATOM 759 CB ASN A 54 5.921 15.591 5.595 1.00 0.60 C ATOM 760 CG ASN A 54 5.720 15.780 7.090 1.00 0.92 C ATOM 761 OD1 ASN A 54 6.318 16.653 7.711 1.00 1.92 O ATOM 762 ND2 ASN A 54 4.846 14.974 7.665 1.00 0.75 N ATOM 0 H ASN A 54 5.702 13.982 3.788 1.00 0.46 H new ATOM 0 HA ASN A 54 7.964 15.260 5.031 1.00 0.48 H new ATOM 0 HB2 ASN A 54 6.099 16.566 5.141 1.00 0.60 H new ATOM 0 HB3 ASN A 54 4.997 15.203 5.165 1.00 0.60 H new ATOM 0 HD21 ASN A 54 4.647 15.065 8.661 1.00 0.75 H new ATOM 0 HD22 ASN A 54 4.370 14.261 7.113 1.00 0.75 H new ATOM 769 N PRO A 55 8.426 14.006 7.186 1.00 0.47 N ATOM 770 CA PRO A 55 9.089 13.065 8.110 1.00 0.49 C ATOM 771 C PRO A 55 8.187 11.999 8.755 1.00 0.45 C ATOM 772 O PRO A 55 8.564 10.826 8.802 1.00 0.46 O ATOM 773 CB PRO A 55 9.630 13.999 9.186 1.00 0.57 C ATOM 774 CG PRO A 55 9.975 15.250 8.459 1.00 0.70 C ATOM 775 CD PRO A 55 9.004 15.362 7.308 1.00 0.53 C ATOM 0 HA PRO A 55 9.822 12.464 7.572 1.00 0.49 H new ATOM 0 HB2 PRO A 55 8.886 14.183 9.961 1.00 0.57 H new ATOM 0 HB3 PRO A 55 10.504 13.573 9.678 1.00 0.57 H new ATOM 0 HG2 PRO A 55 9.897 16.115 9.118 1.00 0.70 H new ATOM 0 HG3 PRO A 55 11.003 15.217 8.097 1.00 0.70 H new ATOM 0 HD2 PRO A 55 8.234 16.107 7.508 1.00 0.53 H new ATOM 0 HD3 PRO A 55 9.508 15.664 6.390 1.00 0.53 H new ATOM 783 N GLU A 56 7.000 12.374 9.218 1.00 0.47 N ATOM 784 CA GLU A 56 6.164 11.434 9.959 1.00 0.49 C ATOM 785 C GLU A 56 5.453 10.471 9.014 1.00 0.40 C ATOM 786 O GLU A 56 5.504 9.249 9.188 1.00 0.39 O ATOM 787 CB GLU A 56 5.154 12.176 10.842 1.00 0.62 C ATOM 788 CG GLU A 56 4.325 13.208 10.107 1.00 0.78 C ATOM 789 CD GLU A 56 3.417 13.979 11.034 1.00 1.73 C ATOM 790 OE1 GLU A 56 2.404 13.406 11.480 1.00 2.71 O ATOM 791 OE2 GLU A 56 3.710 15.160 11.306 1.00 2.02 O ATOM 0 H GLU A 56 6.599 13.304 9.097 1.00 0.47 H new ATOM 0 HA GLU A 56 6.815 10.849 10.609 1.00 0.49 H new ATOM 0 HB2 GLU A 56 4.484 11.447 11.299 1.00 0.62 H new ATOM 0 HB3 GLU A 56 5.691 12.668 11.653 1.00 0.62 H new ATOM 0 HG2 GLU A 56 4.988 13.902 9.591 1.00 0.78 H new ATOM 0 HG3 GLU A 56 3.725 12.712 9.344 1.00 0.78 H new ATOM 798 N ASP A 57 4.808 11.009 7.996 1.00 0.40 N ATOM 799 CA ASP A 57 4.105 10.175 7.042 1.00 0.38 C ATOM 800 C ASP A 57 5.109 9.489 6.121 1.00 0.35 C ATOM 801 O ASP A 57 4.818 8.459 5.518 1.00 0.38 O ATOM 802 CB ASP A 57 3.068 10.986 6.264 1.00 0.47 C ATOM 803 CG ASP A 57 3.660 12.097 5.426 1.00 0.92 C ATOM 804 OD1 ASP A 57 3.991 13.161 5.983 1.00 1.36 O ATOM 805 OD2 ASP A 57 3.827 11.894 4.209 1.00 1.63 O ATOM 0 H ASP A 57 4.757 12.011 7.810 1.00 0.40 H new ATOM 0 HA ASP A 57 3.556 9.401 7.578 1.00 0.38 H new ATOM 0 HB2 ASP A 57 2.508 10.313 5.614 1.00 0.47 H new ATOM 0 HB3 ASP A 57 2.355 11.416 6.968 1.00 0.47 H new ATOM 810 N GLN A 58 6.309 10.049 6.059 1.00 0.34 N ATOM 811 CA GLN A 58 7.429 9.383 5.426 1.00 0.36 C ATOM 812 C GLN A 58 7.706 8.061 6.121 1.00 0.34 C ATOM 813 O GLN A 58 7.935 7.059 5.467 1.00 0.35 O ATOM 814 CB GLN A 58 8.672 10.267 5.462 1.00 0.42 C ATOM 815 CG GLN A 58 9.921 9.563 4.977 1.00 0.51 C ATOM 816 CD GLN A 58 11.134 10.459 5.004 1.00 0.89 C ATOM 817 OE1 GLN A 58 11.453 11.115 4.018 1.00 1.52 O ATOM 818 NE2 GLN A 58 11.816 10.486 6.136 1.00 1.58 N ATOM 0 H GLN A 58 6.528 10.968 6.443 1.00 0.34 H new ATOM 0 HA GLN A 58 7.175 9.191 4.384 1.00 0.36 H new ATOM 0 HB2 GLN A 58 8.499 11.150 4.847 1.00 0.42 H new ATOM 0 HB3 GLN A 58 8.832 10.615 6.482 1.00 0.42 H new ATOM 0 HG2 GLN A 58 10.106 8.687 5.599 1.00 0.51 H new ATOM 0 HG3 GLN A 58 9.761 9.204 3.960 1.00 0.51 H new ATOM 0 HE21 GLN A 58 11.510 9.922 6.929 1.00 1.58 H new ATOM 0 HE22 GLN A 58 12.648 11.071 6.216 1.00 1.58 H new ATOM 827 N VAL A 59 7.674 8.061 7.453 1.00 0.35 N ATOM 828 CA VAL A 59 7.776 6.818 8.212 1.00 0.37 C ATOM 829 C VAL A 59 6.714 5.839 7.733 1.00 0.32 C ATOM 830 O VAL A 59 6.991 4.661 7.505 1.00 0.37 O ATOM 831 CB VAL A 59 7.602 7.051 9.731 1.00 0.45 C ATOM 832 CG1 VAL A 59 7.600 5.732 10.489 1.00 1.08 C ATOM 833 CG2 VAL A 59 8.694 7.959 10.261 1.00 1.27 C ATOM 0 H VAL A 59 7.579 8.901 8.024 1.00 0.35 H new ATOM 0 HA VAL A 59 8.773 6.412 8.045 1.00 0.37 H new ATOM 0 HB VAL A 59 6.638 7.536 9.887 1.00 0.45 H new ATOM 0 HG11 VAL A 59 7.476 5.925 11.555 1.00 1.08 H new ATOM 0 HG12 VAL A 59 6.778 5.110 10.135 1.00 1.08 H new ATOM 0 HG13 VAL A 59 8.545 5.215 10.321 1.00 1.08 H new ATOM 0 HG21 VAL A 59 8.554 8.110 11.331 1.00 1.27 H new ATOM 0 HG22 VAL A 59 9.667 7.500 10.084 1.00 1.27 H new ATOM 0 HG23 VAL A 59 8.648 8.920 9.749 1.00 1.27 H new ATOM 843 N LEU A 60 5.509 6.362 7.544 1.00 0.30 N ATOM 844 CA LEU A 60 4.376 5.572 7.066 1.00 0.31 C ATOM 845 C LEU A 60 4.576 5.116 5.618 1.00 0.33 C ATOM 846 O LEU A 60 3.849 4.267 5.125 1.00 0.41 O ATOM 847 CB LEU A 60 3.098 6.406 7.155 1.00 0.34 C ATOM 848 CG LEU A 60 1.804 5.657 6.853 1.00 0.56 C ATOM 849 CD1 LEU A 60 1.488 4.694 7.977 1.00 1.12 C ATOM 850 CD2 LEU A 60 0.658 6.629 6.648 1.00 1.18 C ATOM 0 H LEU A 60 5.288 7.343 7.716 1.00 0.30 H new ATOM 0 HA LEU A 60 4.298 4.686 7.696 1.00 0.31 H new ATOM 0 HB2 LEU A 60 3.028 6.827 8.158 1.00 0.34 H new ATOM 0 HB3 LEU A 60 3.183 7.244 6.463 1.00 0.34 H new ATOM 0 HG LEU A 60 1.937 5.090 5.932 1.00 0.56 H new ATOM 0 HD11 LEU A 60 0.562 4.164 7.752 1.00 1.12 H new ATOM 0 HD12 LEU A 60 2.302 3.976 8.080 1.00 1.12 H new ATOM 0 HD13 LEU A 60 1.372 5.248 8.909 1.00 1.12 H new ATOM 0 HD21 LEU A 60 -0.256 6.074 6.434 1.00 1.18 H new ATOM 0 HD22 LEU A 60 0.519 7.223 7.551 1.00 1.18 H new ATOM 0 HD23 LEU A 60 0.886 7.289 5.811 1.00 1.18 H new ATOM 862 N TYR A 61 5.539 5.709 4.941 1.00 0.35 N ATOM 863 CA TYR A 61 5.811 5.388 3.538 1.00 0.40 C ATOM 864 C TYR A 61 7.222 4.823 3.346 1.00 0.45 C ATOM 865 O TYR A 61 7.673 4.636 2.219 1.00 0.56 O ATOM 866 CB TYR A 61 5.653 6.640 2.663 1.00 0.42 C ATOM 867 CG TYR A 61 4.232 7.160 2.512 1.00 0.47 C ATOM 868 CD1 TYR A 61 3.152 6.549 3.137 1.00 0.59 C ATOM 869 CD2 TYR A 61 3.978 8.272 1.728 1.00 0.82 C ATOM 870 CE1 TYR A 61 1.866 7.035 2.984 1.00 0.64 C ATOM 871 CE2 TYR A 61 2.700 8.766 1.571 1.00 0.99 C ATOM 872 CZ TYR A 61 1.647 8.146 2.199 1.00 0.78 C ATOM 873 OH TYR A 61 0.371 8.636 2.028 1.00 0.96 O ATOM 0 H TYR A 61 6.154 6.421 5.335 1.00 0.35 H new ATOM 0 HA TYR A 61 5.089 4.628 3.238 1.00 0.40 H new ATOM 0 HB2 TYR A 61 6.269 7.435 3.083 1.00 0.42 H new ATOM 0 HB3 TYR A 61 6.048 6.421 1.671 1.00 0.42 H new ATOM 0 HD1 TYR A 61 3.320 5.678 3.754 1.00 0.59 H new ATOM 0 HD2 TYR A 61 4.799 8.764 1.228 1.00 0.82 H new ATOM 0 HE1 TYR A 61 1.038 6.547 3.477 1.00 0.64 H new ATOM 0 HE2 TYR A 61 2.528 9.637 0.957 1.00 0.99 H new ATOM 0 HH TYR A 61 0.398 9.424 1.446 1.00 0.96 H new ATOM 883 N GLN A 62 7.914 4.559 4.447 1.00 0.43 N ATOM 884 CA GLN A 62 9.337 4.178 4.390 1.00 0.58 C ATOM 885 C GLN A 62 9.631 2.884 5.139 1.00 0.73 C ATOM 886 O GLN A 62 10.396 2.049 4.672 1.00 1.49 O ATOM 887 CB GLN A 62 10.204 5.305 4.972 1.00 0.63 C ATOM 888 CG GLN A 62 11.626 4.886 5.327 1.00 0.99 C ATOM 889 CD GLN A 62 12.414 5.999 5.990 1.00 1.18 C ATOM 890 OE1 GLN A 62 12.140 7.230 5.598 1.00 1.97 O flip ATOM 891 NE2 GLN A 62 13.265 5.757 6.842 1.00 1.13 N flip ATOM 0 H GLN A 62 7.525 4.599 5.389 1.00 0.43 H new ATOM 0 HA GLN A 62 9.577 4.013 3.340 1.00 0.58 H new ATOM 0 HB2 GLN A 62 10.248 6.122 4.252 1.00 0.63 H new ATOM 0 HB3 GLN A 62 9.719 5.695 5.867 1.00 0.63 H new ATOM 0 HG2 GLN A 62 11.591 4.024 5.993 1.00 0.99 H new ATOM 0 HG3 GLN A 62 12.144 4.569 4.422 1.00 0.99 H new ATOM 0 HE21 GLN A 62 13.449 4.793 7.119 1.00 1.13 H new ATOM 0 HE22 GLN A 62 13.788 6.520 7.272 1.00 1.13 H new ATOM 900 N THR A 63 9.049 2.747 6.310 1.00 0.44 N ATOM 901 CA THR A 63 9.341 1.607 7.182 1.00 0.48 C ATOM 902 C THR A 63 8.836 0.279 6.594 1.00 0.61 C ATOM 903 O THR A 63 7.686 0.184 6.173 1.00 1.27 O ATOM 904 CB THR A 63 8.745 1.833 8.586 1.00 0.50 C ATOM 905 OG1 THR A 63 7.385 2.269 8.488 1.00 0.89 O ATOM 906 CG2 THR A 63 9.551 2.867 9.351 1.00 0.89 C ATOM 0 H THR A 63 8.369 3.406 6.690 1.00 0.44 H new ATOM 0 HA THR A 63 10.426 1.534 7.262 1.00 0.48 H new ATOM 0 HB THR A 63 8.782 0.885 9.123 1.00 0.50 H new ATOM 0 HG1 THR A 63 7.358 3.247 8.439 1.00 0.89 H new ATOM 0 HG21 THR A 63 9.113 3.011 10.339 1.00 0.89 H new ATOM 0 HG22 THR A 63 10.579 2.521 9.457 1.00 0.89 H new ATOM 0 HG23 THR A 63 9.540 3.812 8.808 1.00 0.89 H new ATOM 914 N GLU A 64 9.707 -0.739 6.571 1.00 0.53 N ATOM 915 CA GLU A 64 9.368 -2.051 6.001 1.00 0.53 C ATOM 916 C GLU A 64 9.361 -3.145 7.071 1.00 0.58 C ATOM 917 O GLU A 64 9.983 -3.006 8.127 1.00 0.99 O ATOM 918 CB GLU A 64 10.372 -2.444 4.913 1.00 0.67 C ATOM 919 CG GLU A 64 11.796 -2.623 5.419 1.00 1.00 C ATOM 920 CD GLU A 64 12.693 -3.281 4.391 1.00 1.42 C ATOM 921 OE1 GLU A 64 13.226 -2.567 3.513 1.00 1.96 O ATOM 922 OE2 GLU A 64 12.856 -4.524 4.446 1.00 1.78 O ATOM 0 H GLU A 64 10.655 -0.679 6.942 1.00 0.53 H new ATOM 0 HA GLU A 64 8.369 -1.961 5.574 1.00 0.53 H new ATOM 0 HB2 GLU A 64 10.043 -3.374 4.448 1.00 0.67 H new ATOM 0 HB3 GLU A 64 10.367 -1.680 4.136 1.00 0.67 H new ATOM 0 HG2 GLU A 64 12.208 -1.651 5.688 1.00 1.00 H new ATOM 0 HG3 GLU A 64 11.784 -3.227 6.327 1.00 1.00 H new ATOM 929 N ARG A 65 8.628 -4.222 6.798 1.00 0.85 N ATOM 930 CA ARG A 65 8.630 -5.399 7.661 1.00 0.96 C ATOM 931 C ARG A 65 9.411 -6.555 7.030 1.00 1.17 C ATOM 932 O ARG A 65 10.256 -6.347 6.165 1.00 2.02 O ATOM 933 CB ARG A 65 7.205 -5.843 7.991 1.00 0.96 C ATOM 934 CG ARG A 65 6.602 -5.090 9.163 1.00 1.17 C ATOM 935 CD ARG A 65 5.316 -5.739 9.641 1.00 1.09 C ATOM 936 NE ARG A 65 5.521 -7.133 10.023 1.00 1.70 N ATOM 937 CZ ARG A 65 5.597 -7.569 11.284 1.00 2.50 C ATOM 938 NH1 ARG A 65 5.463 -6.727 12.304 1.00 2.93 N ATOM 939 NH2 ARG A 65 5.813 -8.854 11.521 1.00 3.35 N ATOM 0 H ARG A 65 8.022 -4.303 5.981 1.00 0.85 H new ATOM 0 HA ARG A 65 9.129 -5.118 8.588 1.00 0.96 H new ATOM 0 HB2 ARG A 65 6.575 -5.702 7.113 1.00 0.96 H new ATOM 0 HB3 ARG A 65 7.206 -6.910 8.214 1.00 0.96 H new ATOM 0 HG2 ARG A 65 7.320 -5.056 9.983 1.00 1.17 H new ATOM 0 HG3 ARG A 65 6.403 -4.059 8.870 1.00 1.17 H new ATOM 0 HD2 ARG A 65 4.923 -5.183 10.492 1.00 1.09 H new ATOM 0 HD3 ARG A 65 4.566 -5.685 8.851 1.00 1.09 H new ATOM 0 HE ARG A 65 5.613 -7.822 9.276 1.00 1.70 H new ATOM 0 HH11 ARG A 65 5.300 -5.735 12.129 1.00 2.93 H new ATOM 0 HH12 ARG A 65 5.523 -7.073 13.262 1.00 2.93 H new ATOM 0 HH21 ARG A 65 5.920 -9.505 10.743 1.00 3.35 H new ATOM 0 HH22 ARG A 65 5.872 -9.193 12.481 1.00 3.35 H new ATOM 1015 N SER A 70 3.983 -14.936 0.310 1.00 0.78 N ATOM 1016 CA SER A 70 2.709 -14.273 0.094 1.00 0.76 C ATOM 1017 C SER A 70 2.026 -13.988 1.429 1.00 0.82 C ATOM 1018 O SER A 70 1.551 -14.905 2.101 1.00 1.01 O ATOM 1019 CB SER A 70 1.807 -15.149 -0.779 1.00 0.96 C ATOM 1020 OG SER A 70 0.602 -14.481 -1.115 1.00 1.41 O ATOM 0 HA SER A 70 2.888 -13.326 -0.415 1.00 0.76 H new ATOM 0 HB2 SER A 70 2.338 -15.425 -1.690 1.00 0.96 H new ATOM 0 HB3 SER A 70 1.576 -16.075 -0.252 1.00 0.96 H new ATOM 0 HG SER A 70 0.123 -14.995 -1.798 1.00 1.41 H new ATOM 1026 N PHE A 71 1.996 -12.724 1.825 1.00 0.78 N ATOM 1027 CA PHE A 71 1.239 -12.333 3.006 1.00 0.94 C ATOM 1028 C PHE A 71 0.256 -11.238 2.627 1.00 0.58 C ATOM 1029 O PHE A 71 0.566 -10.374 1.805 1.00 0.79 O ATOM 1030 CB PHE A 71 2.129 -11.954 4.219 1.00 1.57 C ATOM 1031 CG PHE A 71 3.344 -11.092 3.955 1.00 1.10 C ATOM 1032 CD1 PHE A 71 3.229 -9.713 3.920 1.00 1.10 C ATOM 1033 CD2 PHE A 71 4.583 -11.657 3.698 1.00 1.38 C ATOM 1034 CE1 PHE A 71 4.325 -8.911 3.647 1.00 1.29 C ATOM 1035 CE2 PHE A 71 5.682 -10.859 3.420 1.00 1.18 C ATOM 1036 CZ PHE A 71 5.613 -9.522 3.540 1.00 1.02 C ATOM 0 H PHE A 71 2.480 -11.960 1.353 1.00 0.78 H new ATOM 0 HA PHE A 71 0.681 -13.203 3.354 1.00 0.94 H new ATOM 0 HB2 PHE A 71 1.503 -11.438 4.947 1.00 1.57 H new ATOM 0 HB3 PHE A 71 2.468 -12.878 4.688 1.00 1.57 H new ATOM 0 HD1 PHE A 71 2.269 -9.255 4.109 1.00 1.10 H new ATOM 0 HD2 PHE A 71 4.694 -12.731 3.714 1.00 1.38 H new ATOM 0 HE1 PHE A 71 4.209 -7.845 3.518 1.00 1.29 H new ATOM 0 HE2 PHE A 71 6.607 -11.318 3.103 1.00 1.18 H new ATOM 0 HZ PHE A 71 6.511 -8.922 3.555 1.00 1.02 H new ATOM 1046 N GLY A 72 -0.948 -11.312 3.183 1.00 0.46 N ATOM 1047 CA GLY A 72 -2.029 -10.495 2.683 1.00 0.78 C ATOM 1048 C GLY A 72 -2.880 -9.848 3.750 1.00 0.58 C ATOM 1049 O GLY A 72 -2.894 -10.277 4.907 1.00 0.74 O ATOM 0 H GLY A 72 -1.190 -11.920 3.965 1.00 0.46 H new ATOM 0 HA2 GLY A 72 -1.611 -9.714 2.048 1.00 0.78 H new ATOM 0 HA3 GLY A 72 -2.669 -11.111 2.051 1.00 0.78 H new ATOM 1053 N TYR A 73 -3.612 -8.824 3.334 1.00 0.39 N ATOM 1054 CA TYR A 73 -4.449 -8.046 4.232 1.00 0.36 C ATOM 1055 C TYR A 73 -5.913 -8.456 4.140 1.00 0.34 C ATOM 1056 O TYR A 73 -6.381 -8.913 3.096 1.00 0.43 O ATOM 1057 CB TYR A 73 -4.353 -6.561 3.901 1.00 0.51 C ATOM 1058 CG TYR A 73 -2.974 -5.968 4.046 1.00 0.58 C ATOM 1059 CD1 TYR A 73 -2.352 -5.931 5.282 1.00 0.72 C ATOM 1060 CD2 TYR A 73 -2.290 -5.463 2.950 1.00 0.78 C ATOM 1061 CE1 TYR A 73 -1.085 -5.408 5.425 1.00 0.89 C ATOM 1062 CE2 TYR A 73 -1.022 -4.934 3.086 1.00 0.97 C ATOM 1063 CZ TYR A 73 -0.450 -4.845 4.304 1.00 0.99 C ATOM 1064 OH TYR A 73 0.837 -4.387 4.470 1.00 1.21 O ATOM 0 H TYR A 73 -3.641 -8.510 2.364 1.00 0.39 H new ATOM 0 HA TYR A 73 -4.086 -8.237 5.242 1.00 0.36 H new ATOM 0 HB2 TYR A 73 -4.693 -6.409 2.876 1.00 0.51 H new ATOM 0 HB3 TYR A 73 -5.038 -6.014 4.548 1.00 0.51 H new ATOM 0 HD1 TYR A 73 -2.868 -6.318 6.148 1.00 0.72 H new ATOM 0 HD2 TYR A 73 -2.756 -5.484 1.976 1.00 0.78 H new ATOM 0 HE1 TYR A 73 -0.588 -5.430 6.383 1.00 0.89 H new ATOM 0 HE2 TYR A 73 -0.486 -4.590 2.214 1.00 0.97 H new ATOM 0 HH TYR A 73 1.145 -3.969 3.639 1.00 1.21 H new ATOM 1074 N ASP A 74 -6.624 -8.247 5.237 1.00 0.35 N ATOM 1075 CA ASP A 74 -8.058 -8.494 5.314 1.00 0.39 C ATOM 1076 C ASP A 74 -8.770 -7.165 5.569 1.00 0.34 C ATOM 1077 O ASP A 74 -8.707 -6.629 6.675 1.00 0.44 O ATOM 1078 CB ASP A 74 -8.332 -9.486 6.457 1.00 0.57 C ATOM 1079 CG ASP A 74 -9.768 -9.956 6.575 1.00 1.58 C ATOM 1080 OD1 ASP A 74 -10.662 -9.094 6.733 1.00 2.47 O ATOM 1081 OD2 ASP A 74 -10.020 -11.171 6.479 1.00 1.92 O ATOM 0 H ASP A 74 -6.220 -7.898 6.106 1.00 0.35 H new ATOM 0 HA ASP A 74 -8.428 -8.922 4.382 1.00 0.39 H new ATOM 0 HB2 ASP A 74 -7.692 -10.358 6.321 1.00 0.57 H new ATOM 0 HB3 ASP A 74 -8.041 -9.020 7.398 1.00 0.57 H new ATOM 1086 N ILE A 75 -9.385 -6.609 4.527 1.00 0.28 N ATOM 1087 CA ILE A 75 -10.132 -5.355 4.639 1.00 0.27 C ATOM 1088 C ILE A 75 -11.631 -5.636 4.645 1.00 0.27 C ATOM 1089 O ILE A 75 -12.259 -5.661 3.588 1.00 0.26 O ATOM 1090 CB ILE A 75 -9.861 -4.385 3.458 1.00 0.25 C ATOM 1091 CG1 ILE A 75 -8.385 -4.055 3.274 1.00 0.28 C ATOM 1092 CG2 ILE A 75 -10.623 -3.089 3.653 1.00 0.29 C ATOM 1093 CD1 ILE A 75 -7.604 -5.059 2.476 1.00 0.38 C ATOM 0 H ILE A 75 -9.381 -7.009 3.589 1.00 0.28 H new ATOM 0 HA ILE A 75 -9.800 -4.891 5.568 1.00 0.27 H new ATOM 0 HB ILE A 75 -10.201 -4.905 2.562 1.00 0.25 H new ATOM 0 HG12 ILE A 75 -8.304 -3.084 2.786 1.00 0.28 H new ATOM 0 HG13 ILE A 75 -7.925 -3.958 4.257 1.00 0.28 H new ATOM 0 HG21 ILE A 75 -10.422 -2.420 2.817 1.00 0.29 H new ATOM 0 HG22 ILE A 75 -11.691 -3.299 3.702 1.00 0.29 H new ATOM 0 HG23 ILE A 75 -10.304 -2.615 4.581 1.00 0.29 H new ATOM 0 HD11 ILE A 75 -6.566 -4.736 2.401 1.00 0.38 H new ATOM 0 HD12 ILE A 75 -7.647 -6.029 2.970 1.00 0.38 H new ATOM 0 HD13 ILE A 75 -8.032 -5.142 1.477 1.00 0.38 H new ATOM 1105 N PRO A 76 -12.232 -5.847 5.817 1.00 0.32 N ATOM 1106 CA PRO A 76 -13.659 -6.157 5.917 1.00 0.35 C ATOM 1107 C PRO A 76 -14.543 -5.080 5.288 1.00 0.34 C ATOM 1108 O PRO A 76 -14.555 -3.930 5.732 1.00 0.41 O ATOM 1109 CB PRO A 76 -13.913 -6.226 7.417 1.00 0.45 C ATOM 1110 CG PRO A 76 -12.581 -6.494 8.025 1.00 0.59 C ATOM 1111 CD PRO A 76 -11.579 -5.819 7.132 1.00 0.41 C ATOM 0 HA PRO A 76 -13.902 -7.076 5.384 1.00 0.35 H new ATOM 0 HB2 PRO A 76 -14.335 -5.292 7.789 1.00 0.45 H new ATOM 0 HB3 PRO A 76 -14.623 -7.016 7.660 1.00 0.45 H new ATOM 0 HG2 PRO A 76 -12.528 -6.100 9.040 1.00 0.59 H new ATOM 0 HG3 PRO A 76 -12.389 -7.565 8.089 1.00 0.59 H new ATOM 0 HD2 PRO A 76 -11.372 -4.800 7.457 1.00 0.41 H new ATOM 0 HD3 PRO A 76 -10.627 -6.350 7.121 1.00 0.41 H new ATOM 1119 N ILE A 77 -15.283 -5.466 4.257 1.00 0.31 N ATOM 1120 CA ILE A 77 -16.164 -4.549 3.552 1.00 0.30 C ATOM 1121 C ILE A 77 -17.612 -4.999 3.690 1.00 0.36 C ATOM 1122 O ILE A 77 -17.914 -6.184 3.577 1.00 0.40 O ATOM 1123 CB ILE A 77 -15.789 -4.454 2.058 1.00 0.26 C ATOM 1124 CG1 ILE A 77 -14.410 -3.808 1.901 1.00 0.28 C ATOM 1125 CG2 ILE A 77 -16.836 -3.661 1.285 1.00 0.30 C ATOM 1126 CD1 ILE A 77 -13.938 -3.698 0.467 1.00 0.49 C ATOM 0 H ILE A 77 -15.289 -6.417 3.889 1.00 0.31 H new ATOM 0 HA ILE A 77 -16.047 -3.562 4.000 1.00 0.30 H new ATOM 0 HB ILE A 77 -15.756 -5.463 1.647 1.00 0.26 H new ATOM 0 HG12 ILE A 77 -14.436 -2.811 2.341 1.00 0.28 H new ATOM 0 HG13 ILE A 77 -13.682 -4.388 2.468 1.00 0.28 H new ATOM 0 HG21 ILE A 77 -16.550 -3.608 0.235 1.00 0.30 H new ATOM 0 HG22 ILE A 77 -17.804 -4.154 1.373 1.00 0.30 H new ATOM 0 HG23 ILE A 77 -16.904 -2.653 1.694 1.00 0.30 H new ATOM 0 HD11 ILE A 77 -12.954 -3.230 0.443 1.00 0.49 H new ATOM 0 HD12 ILE A 77 -13.877 -4.693 0.027 1.00 0.49 H new ATOM 0 HD13 ILE A 77 -14.642 -3.092 -0.102 1.00 0.49 H new ATOM 1138 N LYS A 78 -18.500 -4.053 3.952 1.00 0.44 N ATOM 1139 CA LYS A 78 -19.907 -4.370 4.125 1.00 0.54 C ATOM 1140 C LYS A 78 -20.782 -3.454 3.275 1.00 0.55 C ATOM 1141 O LYS A 78 -22.006 -3.442 3.423 1.00 0.71 O ATOM 1142 CB LYS A 78 -20.294 -4.242 5.603 1.00 0.71 C ATOM 1143 CG LYS A 78 -19.512 -5.174 6.520 1.00 1.23 C ATOM 1144 CD LYS A 78 -19.849 -4.946 7.987 1.00 1.82 C ATOM 1145 CE LYS A 78 -19.457 -3.550 8.447 1.00 2.66 C ATOM 1146 NZ LYS A 78 -19.803 -3.321 9.875 1.00 3.32 N ATOM 0 H LYS A 78 -18.272 -3.064 4.049 1.00 0.44 H new ATOM 0 HA LYS A 78 -20.069 -5.397 3.798 1.00 0.54 H new ATOM 0 HB2 LYS A 78 -20.135 -3.212 5.924 1.00 0.71 H new ATOM 0 HB3 LYS A 78 -21.359 -4.449 5.711 1.00 0.71 H new ATOM 0 HG2 LYS A 78 -19.728 -6.209 6.255 1.00 1.23 H new ATOM 0 HG3 LYS A 78 -18.444 -5.022 6.366 1.00 1.23 H new ATOM 0 HD2 LYS A 78 -20.918 -5.093 8.141 1.00 1.82 H new ATOM 0 HD3 LYS A 78 -19.334 -5.688 8.598 1.00 1.82 H new ATOM 0 HE2 LYS A 78 -18.386 -3.408 8.306 1.00 2.66 H new ATOM 0 HE3 LYS A 78 -19.961 -2.808 7.827 1.00 2.66 H new ATOM 0 HZ1 LYS A 78 -19.520 -2.359 10.151 1.00 3.32 H new ATOM 0 HZ2 LYS A 78 -20.829 -3.431 10.006 1.00 3.32 H new ATOM 0 HZ3 LYS A 78 -19.302 -4.013 10.469 1.00 3.32 H new ATOM 1160 N GLU A 79 -20.163 -2.686 2.382 1.00 0.46 N ATOM 1161 CA GLU A 79 -20.898 -1.732 1.577 1.00 0.47 C ATOM 1162 C GLU A 79 -20.377 -1.743 0.142 1.00 0.36 C ATOM 1163 O GLU A 79 -19.502 -2.537 -0.199 1.00 0.39 O ATOM 1164 CB GLU A 79 -20.737 -0.353 2.205 1.00 0.60 C ATOM 1165 CG GLU A 79 -21.813 0.647 1.819 1.00 1.02 C ATOM 1166 CD GLU A 79 -21.674 1.951 2.569 1.00 1.41 C ATOM 1167 OE1 GLU A 79 -21.707 1.935 3.819 1.00 2.16 O ATOM 1168 OE2 GLU A 79 -21.518 2.999 1.920 1.00 1.87 O ATOM 0 H GLU A 79 -19.159 -2.710 2.203 1.00 0.46 H new ATOM 0 HA GLU A 79 -21.955 -1.997 1.546 1.00 0.47 H new ATOM 0 HB2 GLU A 79 -20.732 -0.461 3.290 1.00 0.60 H new ATOM 0 HB3 GLU A 79 -19.765 0.050 1.920 1.00 0.60 H new ATOM 0 HG2 GLU A 79 -21.761 0.839 0.747 1.00 1.02 H new ATOM 0 HG3 GLU A 79 -22.795 0.217 2.019 1.00 1.02 H new ATOM 1175 N GLU A 80 -20.924 -0.866 -0.687 1.00 0.38 N ATOM 1176 CA GLU A 80 -20.527 -0.770 -2.080 1.00 0.34 C ATOM 1177 C GLU A 80 -20.230 0.695 -2.430 1.00 0.35 C ATOM 1178 O GLU A 80 -20.707 1.609 -1.754 1.00 0.52 O ATOM 1179 CB GLU A 80 -21.625 -1.376 -2.979 1.00 0.42 C ATOM 1180 CG GLU A 80 -22.281 -0.395 -3.925 1.00 0.71 C ATOM 1181 CD GLU A 80 -23.768 -0.642 -4.086 1.00 0.84 C ATOM 1182 OE1 GLU A 80 -24.144 -1.545 -4.860 1.00 0.90 O ATOM 1183 OE2 GLU A 80 -24.573 0.066 -3.445 1.00 1.20 O ATOM 0 H GLU A 80 -21.651 -0.205 -0.413 1.00 0.38 H new ATOM 0 HA GLU A 80 -19.615 -1.341 -2.252 1.00 0.34 H new ATOM 0 HB2 GLU A 80 -21.190 -2.187 -3.563 1.00 0.42 H new ATOM 0 HB3 GLU A 80 -22.393 -1.816 -2.344 1.00 0.42 H new ATOM 0 HG2 GLU A 80 -22.123 0.619 -3.557 1.00 0.71 H new ATOM 0 HG3 GLU A 80 -21.799 -0.459 -4.900 1.00 0.71 H new ATOM 1190 N GLY A 81 -19.439 0.906 -3.473 1.00 0.30 N ATOM 1191 CA GLY A 81 -18.997 2.243 -3.837 1.00 0.28 C ATOM 1192 C GLY A 81 -17.617 2.191 -4.455 1.00 0.24 C ATOM 1193 O GLY A 81 -17.169 1.111 -4.851 1.00 0.28 O ATOM 0 H GLY A 81 -19.090 0.166 -4.082 1.00 0.30 H new ATOM 0 HA2 GLY A 81 -19.701 2.687 -4.541 1.00 0.28 H new ATOM 0 HA3 GLY A 81 -18.983 2.882 -2.954 1.00 0.28 H new ATOM 1197 N GLU A 82 -16.915 3.322 -4.529 1.00 0.22 N ATOM 1198 CA GLU A 82 -15.569 3.298 -5.092 1.00 0.23 C ATOM 1199 C GLU A 82 -14.537 3.280 -3.981 1.00 0.22 C ATOM 1200 O GLU A 82 -14.239 4.302 -3.393 1.00 0.26 O ATOM 1201 CB GLU A 82 -15.300 4.502 -6.003 1.00 0.29 C ATOM 1202 CG GLU A 82 -16.210 4.599 -7.214 1.00 0.42 C ATOM 1203 CD GLU A 82 -15.601 5.440 -8.316 1.00 1.11 C ATOM 1204 OE1 GLU A 82 -15.234 6.605 -8.048 1.00 1.96 O ATOM 1205 OE2 GLU A 82 -15.481 4.943 -9.457 1.00 1.30 O ATOM 0 H GLU A 82 -17.243 4.236 -4.217 1.00 0.22 H new ATOM 0 HA GLU A 82 -15.493 2.392 -5.694 1.00 0.23 H new ATOM 0 HB2 GLU A 82 -15.402 5.414 -5.415 1.00 0.29 H new ATOM 0 HB3 GLU A 82 -14.266 4.457 -6.345 1.00 0.29 H new ATOM 0 HG2 GLU A 82 -16.416 3.598 -7.594 1.00 0.42 H new ATOM 0 HG3 GLU A 82 -17.166 5.030 -6.916 1.00 0.42 H new ATOM 1212 N TYR A 83 -13.954 2.135 -3.706 1.00 0.21 N ATOM 1213 CA TYR A 83 -12.948 2.088 -2.668 1.00 0.22 C ATOM 1214 C TYR A 83 -11.601 2.240 -3.312 1.00 0.22 C ATOM 1215 O TYR A 83 -11.237 1.479 -4.198 1.00 0.22 O ATOM 1216 CB TYR A 83 -12.999 0.774 -1.891 1.00 0.25 C ATOM 1217 CG TYR A 83 -14.257 0.585 -1.088 1.00 0.27 C ATOM 1218 CD1 TYR A 83 -14.478 1.314 0.066 1.00 0.67 C ATOM 1219 CD2 TYR A 83 -15.229 -0.313 -1.492 1.00 0.59 C ATOM 1220 CE1 TYR A 83 -15.630 1.154 0.798 1.00 0.71 C ATOM 1221 CE2 TYR A 83 -16.388 -0.479 -0.768 1.00 0.60 C ATOM 1222 CZ TYR A 83 -16.567 0.217 0.400 1.00 0.39 C ATOM 1223 OH TYR A 83 -17.744 0.099 1.105 1.00 0.44 O ATOM 0 H TYR A 83 -14.150 1.248 -4.170 1.00 0.21 H new ATOM 0 HA TYR A 83 -13.135 2.895 -1.959 1.00 0.22 H new ATOM 0 HB2 TYR A 83 -12.900 -0.055 -2.592 1.00 0.25 H new ATOM 0 HB3 TYR A 83 -12.142 0.728 -1.220 1.00 0.25 H new ATOM 0 HD1 TYR A 83 -13.732 2.021 0.398 1.00 0.67 H new ATOM 0 HD2 TYR A 83 -15.076 -0.893 -2.390 1.00 0.59 H new ATOM 0 HE1 TYR A 83 -15.803 1.756 1.678 1.00 0.71 H new ATOM 0 HE2 TYR A 83 -17.154 -1.155 -1.119 1.00 0.60 H new ATOM 0 HH TYR A 83 -17.657 0.558 1.967 1.00 0.44 H new ATOM 1233 N VAL A 84 -10.857 3.217 -2.863 1.00 0.22 N ATOM 1234 CA VAL A 84 -9.599 3.526 -3.489 1.00 0.22 C ATOM 1235 C VAL A 84 -8.464 3.033 -2.630 1.00 0.23 C ATOM 1236 O VAL A 84 -8.167 3.588 -1.569 1.00 0.24 O ATOM 1237 CB VAL A 84 -9.470 5.034 -3.797 1.00 0.22 C ATOM 1238 CG1 VAL A 84 -8.058 5.390 -4.241 1.00 0.26 C ATOM 1239 CG2 VAL A 84 -10.467 5.406 -4.868 1.00 0.25 C ATOM 0 H VAL A 84 -11.099 3.810 -2.069 1.00 0.22 H new ATOM 0 HA VAL A 84 -9.555 3.009 -4.448 1.00 0.22 H new ATOM 0 HB VAL A 84 -9.678 5.597 -2.887 1.00 0.22 H new ATOM 0 HG11 VAL A 84 -8.001 6.458 -4.450 1.00 0.26 H new ATOM 0 HG12 VAL A 84 -7.353 5.137 -3.449 1.00 0.26 H new ATOM 0 HG13 VAL A 84 -7.808 4.830 -5.142 1.00 0.26 H new ATOM 0 HG21 VAL A 84 -10.382 6.470 -5.091 1.00 0.25 H new ATOM 0 HG22 VAL A 84 -10.264 4.829 -5.770 1.00 0.25 H new ATOM 0 HG23 VAL A 84 -11.476 5.188 -4.517 1.00 0.25 H new ATOM 1249 N LEU A 85 -7.866 1.952 -3.088 1.00 0.25 N ATOM 1250 CA LEU A 85 -6.746 1.362 -2.409 1.00 0.30 C ATOM 1251 C LEU A 85 -5.474 1.994 -2.938 1.00 0.29 C ATOM 1252 O LEU A 85 -4.999 1.645 -4.011 1.00 0.31 O ATOM 1253 CB LEU A 85 -6.723 -0.145 -2.671 1.00 0.40 C ATOM 1254 CG LEU A 85 -5.784 -0.953 -1.782 1.00 0.92 C ATOM 1255 CD1 LEU A 85 -6.485 -1.332 -0.490 1.00 1.56 C ATOM 1256 CD2 LEU A 85 -5.285 -2.188 -2.510 1.00 1.13 C ATOM 0 H LEU A 85 -8.146 1.464 -3.939 1.00 0.25 H new ATOM 0 HA LEU A 85 -6.827 1.532 -1.335 1.00 0.30 H new ATOM 0 HB2 LEU A 85 -7.734 -0.533 -2.548 1.00 0.40 H new ATOM 0 HB3 LEU A 85 -6.442 -0.311 -3.711 1.00 0.40 H new ATOM 0 HG LEU A 85 -4.919 -0.337 -1.538 1.00 0.92 H new ATOM 0 HD11 LEU A 85 -5.805 -1.909 0.137 1.00 1.56 H new ATOM 0 HD12 LEU A 85 -6.787 -0.428 0.039 1.00 1.56 H new ATOM 0 HD13 LEU A 85 -7.366 -1.932 -0.717 1.00 1.56 H new ATOM 0 HD21 LEU A 85 -4.617 -2.750 -1.857 1.00 1.13 H new ATOM 0 HD22 LEU A 85 -6.133 -2.814 -2.787 1.00 1.13 H new ATOM 0 HD23 LEU A 85 -4.747 -1.888 -3.409 1.00 1.13 H new ATOM 1268 N VAL A 86 -4.924 2.915 -2.187 1.00 0.31 N ATOM 1269 CA VAL A 86 -3.686 3.548 -2.571 1.00 0.34 C ATOM 1270 C VAL A 86 -2.605 3.154 -1.579 1.00 0.32 C ATOM 1271 O VAL A 86 -2.589 3.593 -0.430 1.00 0.32 O ATOM 1272 CB VAL A 86 -3.820 5.089 -2.684 1.00 0.41 C ATOM 1273 CG1 VAL A 86 -4.490 5.684 -1.457 1.00 1.05 C ATOM 1274 CG2 VAL A 86 -2.459 5.731 -2.919 1.00 1.14 C ATOM 0 H VAL A 86 -5.315 3.244 -1.304 1.00 0.31 H new ATOM 0 HA VAL A 86 -3.412 3.200 -3.567 1.00 0.34 H new ATOM 0 HB VAL A 86 -4.457 5.302 -3.542 1.00 0.41 H new ATOM 0 HG11 VAL A 86 -4.566 6.765 -1.572 1.00 1.05 H new ATOM 0 HG12 VAL A 86 -5.488 5.260 -1.345 1.00 1.05 H new ATOM 0 HG13 VAL A 86 -3.897 5.455 -0.572 1.00 1.05 H new ATOM 0 HG21 VAL A 86 -2.575 6.812 -2.995 1.00 1.14 H new ATOM 0 HG22 VAL A 86 -1.797 5.495 -2.086 1.00 1.14 H new ATOM 0 HG23 VAL A 86 -2.030 5.346 -3.844 1.00 1.14 H new ATOM 1284 N LEU A 87 -1.743 2.265 -2.010 1.00 0.33 N ATOM 1285 CA LEU A 87 -0.679 1.781 -1.158 1.00 0.32 C ATOM 1286 C LEU A 87 0.638 2.410 -1.567 1.00 0.28 C ATOM 1287 O LEU A 87 0.949 2.507 -2.758 1.00 0.29 O ATOM 1288 CB LEU A 87 -0.606 0.244 -1.206 1.00 0.42 C ATOM 1289 CG LEU A 87 -1.193 -0.419 -2.460 1.00 0.57 C ATOM 1290 CD1 LEU A 87 -0.360 -0.112 -3.688 1.00 1.37 C ATOM 1291 CD2 LEU A 87 -1.306 -1.923 -2.267 1.00 1.44 C ATOM 0 H LEU A 87 -1.756 1.860 -2.946 1.00 0.33 H new ATOM 0 HA LEU A 87 -0.888 2.069 -0.128 1.00 0.32 H new ATOM 0 HB2 LEU A 87 0.439 -0.053 -1.118 1.00 0.42 H new ATOM 0 HB3 LEU A 87 -1.125 -0.152 -0.333 1.00 0.42 H new ATOM 0 HG LEU A 87 -2.190 -0.007 -2.615 1.00 0.57 H new ATOM 0 HD11 LEU A 87 -0.803 -0.596 -4.558 1.00 1.37 H new ATOM 0 HD12 LEU A 87 -0.331 0.966 -3.848 1.00 1.37 H new ATOM 0 HD13 LEU A 87 0.654 -0.484 -3.542 1.00 1.37 H new ATOM 0 HD21 LEU A 87 -1.724 -2.375 -3.167 1.00 1.44 H new ATOM 0 HD22 LEU A 87 -0.317 -2.341 -2.077 1.00 1.44 H new ATOM 0 HD23 LEU A 87 -1.958 -2.133 -1.419 1.00 1.44 H new ATOM 1303 N LYS A 88 1.401 2.872 -0.594 1.00 0.28 N ATOM 1304 CA LYS A 88 2.704 3.430 -0.899 1.00 0.28 C ATOM 1305 C LYS A 88 3.768 2.362 -0.707 1.00 0.28 C ATOM 1306 O LYS A 88 3.927 1.813 0.376 1.00 0.39 O ATOM 1307 CB LYS A 88 3.009 4.656 -0.033 1.00 0.35 C ATOM 1308 CG LYS A 88 4.182 5.485 -0.536 1.00 0.67 C ATOM 1309 CD LYS A 88 3.802 6.366 -1.721 1.00 1.91 C ATOM 1310 CE LYS A 88 2.685 7.333 -1.370 1.00 2.70 C ATOM 1311 NZ LYS A 88 2.533 8.415 -2.382 1.00 3.73 N ATOM 0 H LYS A 88 1.148 2.873 0.394 1.00 0.28 H new ATOM 0 HA LYS A 88 2.703 3.761 -1.938 1.00 0.28 H new ATOM 0 HB2 LYS A 88 2.122 5.288 0.012 1.00 0.35 H new ATOM 0 HB3 LYS A 88 3.218 4.328 0.985 1.00 0.35 H new ATOM 0 HG2 LYS A 88 4.556 6.111 0.274 1.00 0.67 H new ATOM 0 HG3 LYS A 88 4.996 4.820 -0.826 1.00 0.67 H new ATOM 0 HD2 LYS A 88 4.676 6.926 -2.053 1.00 1.91 H new ATOM 0 HD3 LYS A 88 3.490 5.738 -2.556 1.00 1.91 H new ATOM 0 HE2 LYS A 88 1.747 6.785 -1.284 1.00 2.70 H new ATOM 0 HE3 LYS A 88 2.885 7.777 -0.395 1.00 2.70 H new ATOM 0 HZ1 LYS A 88 1.526 8.650 -2.490 1.00 3.73 H new ATOM 0 HZ2 LYS A 88 3.054 9.259 -2.069 1.00 3.73 H new ATOM 0 HZ3 LYS A 88 2.913 8.093 -3.295 1.00 3.73 H new ATOM 1325 N PHE A 89 4.477 2.067 -1.768 1.00 0.27 N ATOM 1326 CA PHE A 89 5.487 1.036 -1.754 1.00 0.28 C ATOM 1327 C PHE A 89 6.873 1.654 -1.763 1.00 0.28 C ATOM 1328 O PHE A 89 7.113 2.659 -2.433 1.00 0.29 O ATOM 1329 CB PHE A 89 5.335 0.130 -2.975 1.00 0.32 C ATOM 1330 CG PHE A 89 4.218 -0.866 -2.870 1.00 0.32 C ATOM 1331 CD1 PHE A 89 4.079 -1.629 -1.729 1.00 0.37 C ATOM 1332 CD2 PHE A 89 3.330 -1.064 -3.916 1.00 0.37 C ATOM 1333 CE1 PHE A 89 3.082 -2.568 -1.625 1.00 0.44 C ATOM 1334 CE2 PHE A 89 2.336 -2.012 -3.823 1.00 0.42 C ATOM 1335 CZ PHE A 89 2.210 -2.766 -2.679 1.00 0.45 C ATOM 0 H PHE A 89 4.371 2.535 -2.668 1.00 0.27 H new ATOM 0 HA PHE A 89 5.360 0.447 -0.846 1.00 0.28 H new ATOM 0 HB2 PHE A 89 5.171 0.751 -3.855 1.00 0.32 H new ATOM 0 HB3 PHE A 89 6.271 -0.406 -3.134 1.00 0.32 H new ATOM 0 HD1 PHE A 89 4.764 -1.486 -0.906 1.00 0.37 H new ATOM 0 HD2 PHE A 89 3.419 -0.469 -4.813 1.00 0.37 H new ATOM 0 HE1 PHE A 89 2.980 -3.151 -0.721 1.00 0.44 H new ATOM 0 HE2 PHE A 89 1.655 -2.164 -4.648 1.00 0.42 H new ATOM 0 HZ PHE A 89 1.432 -3.511 -2.605 1.00 0.45 H new ATOM 1345 N ALA A 90 7.774 1.046 -1.022 1.00 0.32 N ATOM 1346 CA ALA A 90 9.163 1.475 -0.998 1.00 0.36 C ATOM 1347 C ALA A 90 10.077 0.257 -1.060 1.00 0.42 C ATOM 1348 O ALA A 90 9.715 -0.820 -0.575 1.00 0.51 O ATOM 1349 CB ALA A 90 9.448 2.307 0.242 1.00 0.44 C ATOM 0 H ALA A 90 7.571 0.246 -0.422 1.00 0.32 H new ATOM 0 HA ALA A 90 9.356 2.102 -1.868 1.00 0.36 H new ATOM 0 HB1 ALA A 90 10.493 2.617 0.240 1.00 0.44 H new ATOM 0 HB2 ALA A 90 8.807 3.189 0.244 1.00 0.44 H new ATOM 0 HB3 ALA A 90 9.248 1.712 1.133 1.00 0.44 H new ATOM 1521 N VAL A 101 9.944 -8.577 -9.527 1.00 0.62 N ATOM 1522 CA VAL A 101 8.590 -8.241 -9.938 1.00 0.51 C ATOM 1523 C VAL A 101 7.579 -8.903 -9.016 1.00 0.49 C ATOM 1524 O VAL A 101 7.421 -10.124 -8.986 1.00 0.64 O ATOM 1525 CB VAL A 101 8.318 -8.636 -11.412 1.00 0.60 C ATOM 1526 CG1 VAL A 101 9.092 -7.727 -12.354 1.00 1.22 C ATOM 1527 CG2 VAL A 101 8.686 -10.089 -11.671 1.00 1.20 C ATOM 0 HA VAL A 101 8.484 -7.159 -9.865 1.00 0.51 H new ATOM 0 HB VAL A 101 7.250 -8.518 -11.598 1.00 0.60 H new ATOM 0 HG11 VAL A 101 8.891 -8.016 -13.386 1.00 1.22 H new ATOM 0 HG12 VAL A 101 8.781 -6.694 -12.200 1.00 1.22 H new ATOM 0 HG13 VAL A 101 10.159 -7.819 -12.153 1.00 1.22 H new ATOM 0 HG21 VAL A 101 8.484 -10.335 -12.713 1.00 1.20 H new ATOM 0 HG22 VAL A 101 9.745 -10.239 -11.462 1.00 1.20 H new ATOM 0 HG23 VAL A 101 8.093 -10.735 -11.024 1.00 1.20 H new ATOM 1537 N PHE A 102 6.932 -8.065 -8.236 1.00 0.43 N ATOM 1538 CA PHE A 102 6.035 -8.504 -7.186 1.00 0.43 C ATOM 1539 C PHE A 102 4.623 -8.709 -7.704 1.00 0.35 C ATOM 1540 O PHE A 102 4.265 -8.222 -8.777 1.00 0.34 O ATOM 1541 CB PHE A 102 5.997 -7.451 -6.084 1.00 0.47 C ATOM 1542 CG PHE A 102 7.352 -7.051 -5.565 1.00 0.63 C ATOM 1543 CD1 PHE A 102 8.403 -7.952 -5.548 1.00 0.80 C ATOM 1544 CD2 PHE A 102 7.576 -5.759 -5.116 1.00 0.76 C ATOM 1545 CE1 PHE A 102 9.649 -7.572 -5.091 1.00 0.97 C ATOM 1546 CE2 PHE A 102 8.821 -5.375 -4.660 1.00 0.91 C ATOM 1547 CZ PHE A 102 9.857 -6.284 -4.647 1.00 0.99 C ATOM 0 H PHE A 102 7.013 -7.051 -8.312 1.00 0.43 H new ATOM 0 HA PHE A 102 6.407 -9.455 -6.806 1.00 0.43 H new ATOM 0 HB2 PHE A 102 5.489 -6.564 -6.462 1.00 0.47 H new ATOM 0 HB3 PHE A 102 5.400 -7.831 -5.255 1.00 0.47 H new ATOM 0 HD1 PHE A 102 8.247 -8.962 -5.896 1.00 0.80 H new ATOM 0 HD2 PHE A 102 6.767 -5.044 -5.123 1.00 0.76 H new ATOM 0 HE1 PHE A 102 10.461 -8.284 -5.081 1.00 0.97 H new ATOM 0 HE2 PHE A 102 8.983 -4.365 -4.314 1.00 0.91 H new ATOM 0 HZ PHE A 102 10.832 -5.987 -4.289 1.00 0.99 H new ATOM 1557 N ASP A 103 3.821 -9.409 -6.920 1.00 0.35 N ATOM 1558 CA ASP A 103 2.403 -9.534 -7.205 1.00 0.34 C ATOM 1559 C ASP A 103 1.641 -8.648 -6.250 1.00 0.33 C ATOM 1560 O ASP A 103 1.948 -8.603 -5.061 1.00 0.40 O ATOM 1561 CB ASP A 103 1.871 -10.949 -6.996 1.00 0.45 C ATOM 1562 CG ASP A 103 2.565 -12.034 -7.786 1.00 0.86 C ATOM 1563 OD1 ASP A 103 3.806 -12.013 -7.905 1.00 1.46 O ATOM 1564 OD2 ASP A 103 1.858 -12.945 -8.262 1.00 1.53 O ATOM 0 H ASP A 103 4.129 -9.900 -6.080 1.00 0.35 H new ATOM 0 HA ASP A 103 2.270 -9.259 -8.251 1.00 0.34 H new ATOM 0 HB2 ASP A 103 1.946 -11.193 -5.936 1.00 0.45 H new ATOM 0 HB3 ASP A 103 0.811 -10.960 -7.252 1.00 0.45 H new ATOM 1569 N VAL A 104 0.652 -7.965 -6.769 1.00 0.30 N ATOM 1570 CA VAL A 104 -0.205 -7.121 -5.969 1.00 0.31 C ATOM 1571 C VAL A 104 -1.666 -7.412 -6.306 1.00 0.28 C ATOM 1572 O VAL A 104 -2.115 -7.165 -7.431 1.00 0.30 O ATOM 1573 CB VAL A 104 0.137 -5.632 -6.193 1.00 0.36 C ATOM 1574 CG1 VAL A 104 -1.066 -4.756 -5.938 1.00 0.45 C ATOM 1575 CG2 VAL A 104 1.293 -5.219 -5.300 1.00 0.63 C ATOM 0 H VAL A 104 0.416 -7.977 -7.761 1.00 0.30 H new ATOM 0 HA VAL A 104 -0.042 -7.339 -4.913 1.00 0.31 H new ATOM 0 HB VAL A 104 0.433 -5.503 -7.234 1.00 0.36 H new ATOM 0 HG11 VAL A 104 -0.798 -3.712 -6.103 1.00 0.45 H new ATOM 0 HG12 VAL A 104 -1.870 -5.036 -6.618 1.00 0.45 H new ATOM 0 HG13 VAL A 104 -1.400 -4.887 -4.909 1.00 0.45 H new ATOM 0 HG21 VAL A 104 1.524 -4.167 -5.468 1.00 0.63 H new ATOM 0 HG22 VAL A 104 1.018 -5.368 -4.256 1.00 0.63 H new ATOM 0 HG23 VAL A 104 2.168 -5.825 -5.534 1.00 0.63 H new ATOM 1585 N ARG A 105 -2.391 -7.971 -5.343 1.00 0.28 N ATOM 1586 CA ARG A 105 -3.751 -8.430 -5.589 1.00 0.26 C ATOM 1587 C ARG A 105 -4.742 -7.762 -4.650 1.00 0.28 C ATOM 1588 O ARG A 105 -4.552 -7.741 -3.440 1.00 0.39 O ATOM 1589 CB ARG A 105 -3.823 -9.943 -5.420 1.00 0.37 C ATOM 1590 CG ARG A 105 -2.632 -10.650 -6.034 1.00 0.64 C ATOM 1591 CD ARG A 105 -2.655 -12.146 -5.805 1.00 0.57 C ATOM 1592 NE ARG A 105 -1.441 -12.761 -6.341 1.00 1.11 N ATOM 1593 CZ ARG A 105 -1.303 -14.060 -6.606 1.00 1.36 C ATOM 1594 NH1 ARG A 105 -2.280 -14.908 -6.328 1.00 1.37 N ATOM 1595 NH2 ARG A 105 -0.181 -14.510 -7.161 1.00 1.95 N ATOM 0 H ARG A 105 -2.060 -8.116 -4.389 1.00 0.28 H new ATOM 0 HA ARG A 105 -4.018 -8.159 -6.610 1.00 0.26 H new ATOM 0 HB2 ARG A 105 -3.878 -10.185 -4.359 1.00 0.37 H new ATOM 0 HB3 ARG A 105 -4.739 -10.314 -5.880 1.00 0.37 H new ATOM 0 HG2 ARG A 105 -2.610 -10.452 -7.106 1.00 0.64 H new ATOM 0 HG3 ARG A 105 -1.714 -10.237 -5.615 1.00 0.64 H new ATOM 0 HD2 ARG A 105 -2.737 -12.356 -4.739 1.00 0.57 H new ATOM 0 HD3 ARG A 105 -3.533 -12.580 -6.284 1.00 0.57 H new ATOM 0 HE ARG A 105 -0.643 -12.153 -6.525 1.00 1.11 H new ATOM 0 HH11 ARG A 105 -3.146 -14.569 -5.908 1.00 1.37 H new ATOM 0 HH12 ARG A 105 -2.168 -15.901 -6.534 1.00 1.37 H new ATOM 0 HH21 ARG A 105 0.574 -13.861 -7.384 1.00 1.95 H new ATOM 0 HH22 ARG A 105 -0.075 -15.504 -7.364 1.00 1.95 H new ATOM 1609 N VAL A 106 -5.800 -7.236 -5.234 1.00 0.28 N ATOM 1610 CA VAL A 106 -6.861 -6.569 -4.494 1.00 0.31 C ATOM 1611 C VAL A 106 -8.086 -7.472 -4.441 1.00 0.28 C ATOM 1612 O VAL A 106 -8.839 -7.564 -5.407 1.00 0.34 O ATOM 1613 CB VAL A 106 -7.234 -5.223 -5.147 1.00 0.39 C ATOM 1614 CG1 VAL A 106 -8.202 -4.437 -4.279 1.00 1.44 C ATOM 1615 CG2 VAL A 106 -5.988 -4.401 -5.436 1.00 1.41 C ATOM 0 H VAL A 106 -5.952 -7.258 -6.242 1.00 0.28 H new ATOM 0 HA VAL A 106 -6.504 -6.368 -3.484 1.00 0.31 H new ATOM 0 HB VAL A 106 -7.732 -5.440 -6.092 1.00 0.39 H new ATOM 0 HG11 VAL A 106 -8.445 -3.493 -4.768 1.00 1.44 H new ATOM 0 HG12 VAL A 106 -9.114 -5.016 -4.135 1.00 1.44 H new ATOM 0 HG13 VAL A 106 -7.742 -4.237 -3.311 1.00 1.44 H new ATOM 0 HG21 VAL A 106 -6.275 -3.456 -5.897 1.00 1.41 H new ATOM 0 HG22 VAL A 106 -5.457 -4.205 -4.504 1.00 1.41 H new ATOM 0 HG23 VAL A 106 -5.337 -4.953 -6.115 1.00 1.41 H new ATOM 1625 N ASN A 107 -8.254 -8.150 -3.314 1.00 0.28 N ATOM 1626 CA ASN A 107 -9.256 -9.204 -3.158 1.00 0.28 C ATOM 1627 C ASN A 107 -9.010 -10.282 -4.206 1.00 0.29 C ATOM 1628 O ASN A 107 -9.888 -10.655 -4.981 1.00 0.38 O ATOM 1629 CB ASN A 107 -10.678 -8.643 -3.232 1.00 0.30 C ATOM 1630 CG ASN A 107 -11.783 -9.679 -3.034 1.00 0.96 C ATOM 1631 OD1 ASN A 107 -12.837 -9.597 -3.662 1.00 1.57 O ATOM 1632 ND2 ASN A 107 -11.574 -10.634 -2.141 1.00 1.65 N ATOM 0 H ASN A 107 -7.697 -7.986 -2.475 1.00 0.28 H new ATOM 0 HA ASN A 107 -9.159 -9.650 -2.168 1.00 0.28 H new ATOM 0 HB2 ASN A 107 -10.787 -7.866 -2.476 1.00 0.30 H new ATOM 0 HB3 ASN A 107 -10.816 -8.165 -4.202 1.00 0.30 H new ATOM 0 HD21 ASN A 107 -12.298 -11.328 -1.958 1.00 1.65 H new ATOM 0 HD22 ASN A 107 -10.689 -10.675 -1.636 1.00 1.65 H new ATOM 1639 N GLY A 108 -7.768 -10.740 -4.243 1.00 0.29 N ATOM 1640 CA GLY A 108 -7.380 -11.784 -5.166 1.00 0.35 C ATOM 1641 C GLY A 108 -6.996 -11.257 -6.536 1.00 0.32 C ATOM 1642 O GLY A 108 -6.293 -11.922 -7.294 1.00 0.42 O ATOM 0 H GLY A 108 -7.015 -10.402 -3.643 1.00 0.29 H new ATOM 0 HA2 GLY A 108 -6.539 -12.336 -4.747 1.00 0.35 H new ATOM 0 HA3 GLY A 108 -8.203 -12.490 -5.273 1.00 0.35 H new ATOM 1646 N HIS A 109 -7.444 -10.051 -6.837 1.00 0.26 N ATOM 1647 CA HIS A 109 -7.307 -9.476 -8.169 1.00 0.27 C ATOM 1648 C HIS A 109 -5.906 -8.924 -8.412 1.00 0.23 C ATOM 1649 O HIS A 109 -5.553 -7.882 -7.869 1.00 0.24 O ATOM 1650 CB HIS A 109 -8.324 -8.351 -8.346 1.00 0.33 C ATOM 1651 CG HIS A 109 -9.749 -8.806 -8.380 1.00 0.44 C ATOM 1652 ND1 HIS A 109 -10.751 -8.630 -7.489 1.00 0.57 N flip ATOM 1653 CD2 HIS A 109 -10.289 -9.526 -9.419 1.00 0.53 C flip ATOM 1654 CE1 HIS A 109 -11.866 -9.236 -7.999 1.00 0.68 C flip ATOM 1655 NE2 HIS A 109 -11.559 -9.769 -9.167 1.00 0.65 N flip ATOM 0 H HIS A 109 -7.913 -9.441 -6.168 1.00 0.26 H new ATOM 0 HA HIS A 109 -7.486 -10.272 -8.891 1.00 0.27 H new ATOM 0 HB2 HIS A 109 -8.203 -7.637 -7.532 1.00 0.33 H new ATOM 0 HB3 HIS A 109 -8.103 -7.820 -9.272 1.00 0.33 H new ATOM 0 HD1 HIS A 109 -10.687 -8.136 -6.599 1.00 0.57 H new ATOM 0 HD2 HIS A 109 -9.756 -9.843 -10.303 1.00 0.53 H new ATOM 0 HE1 HIS A 109 -12.836 -9.272 -7.525 1.00 0.68 H new ATOM 1664 N THR A 110 -5.116 -9.606 -9.231 1.00 0.27 N ATOM 1665 CA THR A 110 -3.776 -9.130 -9.554 1.00 0.30 C ATOM 1666 C THR A 110 -3.830 -7.866 -10.398 1.00 0.30 C ATOM 1667 O THR A 110 -3.989 -7.920 -11.617 1.00 0.48 O ATOM 1668 CB THR A 110 -2.942 -10.189 -10.295 1.00 0.40 C ATOM 1669 OG1 THR A 110 -3.754 -10.886 -11.249 1.00 0.77 O ATOM 1670 CG2 THR A 110 -2.335 -11.175 -9.323 1.00 0.61 C ATOM 0 H THR A 110 -5.376 -10.484 -9.681 1.00 0.27 H new ATOM 0 HA THR A 110 -3.294 -8.915 -8.600 1.00 0.30 H new ATOM 0 HB THR A 110 -2.136 -9.676 -10.819 1.00 0.40 H new ATOM 0 HG1 THR A 110 -4.217 -10.238 -11.820 1.00 0.77 H new ATOM 0 HG21 THR A 110 -1.750 -11.913 -9.871 1.00 0.61 H new ATOM 0 HG22 THR A 110 -1.687 -10.645 -8.624 1.00 0.61 H new ATOM 0 HG23 THR A 110 -3.129 -11.678 -8.771 1.00 0.61 H new ATOM 1678 N VAL A 111 -3.710 -6.729 -9.739 1.00 0.26 N ATOM 1679 CA VAL A 111 -3.693 -5.457 -10.430 1.00 0.29 C ATOM 1680 C VAL A 111 -2.281 -5.148 -10.891 1.00 0.29 C ATOM 1681 O VAL A 111 -2.058 -4.763 -12.039 1.00 0.38 O ATOM 1682 CB VAL A 111 -4.199 -4.317 -9.531 1.00 0.32 C ATOM 1683 CG1 VAL A 111 -4.347 -3.028 -10.326 1.00 0.93 C ATOM 1684 CG2 VAL A 111 -5.514 -4.706 -8.885 1.00 0.94 C ATOM 0 H VAL A 111 -3.623 -6.662 -8.725 1.00 0.26 H new ATOM 0 HA VAL A 111 -4.361 -5.532 -11.288 1.00 0.29 H new ATOM 0 HB VAL A 111 -3.465 -4.143 -8.744 1.00 0.32 H new ATOM 0 HG11 VAL A 111 -4.706 -2.235 -9.670 1.00 0.93 H new ATOM 0 HG12 VAL A 111 -3.380 -2.744 -10.743 1.00 0.93 H new ATOM 0 HG13 VAL A 111 -5.061 -3.180 -11.136 1.00 0.93 H new ATOM 0 HG21 VAL A 111 -5.863 -3.891 -8.251 1.00 0.94 H new ATOM 0 HG22 VAL A 111 -6.255 -4.906 -9.659 1.00 0.94 H new ATOM 0 HG23 VAL A 111 -5.371 -5.601 -8.280 1.00 0.94 H new ATOM 1694 N VAL A 112 -1.323 -5.339 -9.992 1.00 0.27 N ATOM 1695 CA VAL A 112 0.073 -5.142 -10.332 1.00 0.28 C ATOM 1696 C VAL A 112 0.833 -6.445 -10.146 1.00 0.28 C ATOM 1697 O VAL A 112 1.385 -6.718 -9.085 1.00 0.27 O ATOM 1698 CB VAL A 112 0.730 -4.047 -9.465 1.00 0.29 C ATOM 1699 CG1 VAL A 112 2.080 -3.646 -10.037 1.00 0.35 C ATOM 1700 CG2 VAL A 112 -0.177 -2.835 -9.337 1.00 0.33 C ATOM 0 H VAL A 112 -1.490 -5.628 -9.028 1.00 0.27 H new ATOM 0 HA VAL A 112 0.115 -4.821 -11.373 1.00 0.28 H new ATOM 0 HB VAL A 112 0.887 -4.458 -8.468 1.00 0.29 H new ATOM 0 HG11 VAL A 112 2.526 -2.873 -9.411 1.00 0.35 H new ATOM 0 HG12 VAL A 112 2.737 -4.515 -10.063 1.00 0.35 H new ATOM 0 HG13 VAL A 112 1.947 -3.261 -11.048 1.00 0.35 H new ATOM 0 HG21 VAL A 112 0.310 -2.079 -8.721 1.00 0.33 H new ATOM 0 HG22 VAL A 112 -0.376 -2.424 -10.327 1.00 0.33 H new ATOM 0 HG23 VAL A 112 -1.117 -3.131 -8.871 1.00 0.33 H new ATOM 1710 N LYS A 113 0.855 -7.241 -11.191 1.00 0.33 N ATOM 1711 CA LYS A 113 1.616 -8.473 -11.213 1.00 0.37 C ATOM 1712 C LYS A 113 2.869 -8.244 -12.050 1.00 0.41 C ATOM 1713 O LYS A 113 2.971 -8.677 -13.204 1.00 0.68 O ATOM 1714 CB LYS A 113 0.718 -9.588 -11.776 1.00 0.44 C ATOM 1715 CG LYS A 113 1.426 -10.875 -12.190 1.00 1.24 C ATOM 1716 CD LYS A 113 2.131 -11.562 -11.037 1.00 2.09 C ATOM 1717 CE LYS A 113 2.718 -12.896 -11.475 1.00 3.07 C ATOM 1718 NZ LYS A 113 3.386 -13.607 -10.354 1.00 4.01 N ATOM 0 H LYS A 113 0.344 -7.053 -12.054 1.00 0.33 H new ATOM 0 HA LYS A 113 1.934 -8.779 -10.216 1.00 0.37 H new ATOM 0 HB2 LYS A 113 -0.033 -9.836 -11.026 1.00 0.44 H new ATOM 0 HB3 LYS A 113 0.186 -9.195 -12.642 1.00 0.44 H new ATOM 0 HG2 LYS A 113 0.698 -11.560 -12.623 1.00 1.24 H new ATOM 0 HG3 LYS A 113 2.153 -10.648 -12.970 1.00 1.24 H new ATOM 0 HD2 LYS A 113 2.924 -10.919 -10.656 1.00 2.09 H new ATOM 0 HD3 LYS A 113 1.428 -11.721 -10.219 1.00 2.09 H new ATOM 0 HE2 LYS A 113 1.926 -13.524 -11.882 1.00 3.07 H new ATOM 0 HE3 LYS A 113 3.436 -12.730 -12.278 1.00 3.07 H new ATOM 0 HZ1 LYS A 113 3.682 -14.553 -10.670 1.00 4.01 H new ATOM 0 HZ2 LYS A 113 4.221 -13.067 -10.049 1.00 4.01 H new ATOM 0 HZ3 LYS A 113 2.723 -13.700 -9.558 1.00 4.01 H new ATOM 1732 N ASP A 114 3.819 -7.552 -11.429 1.00 0.39 N ATOM 1733 CA ASP A 114 5.043 -7.089 -12.099 1.00 0.45 C ATOM 1734 C ASP A 114 5.710 -5.989 -11.287 1.00 0.38 C ATOM 1735 O ASP A 114 6.592 -5.302 -11.788 1.00 0.45 O ATOM 1736 CB ASP A 114 4.748 -6.518 -13.499 1.00 0.63 C ATOM 1737 CG ASP A 114 3.991 -5.197 -13.453 1.00 1.33 C ATOM 1738 OD1 ASP A 114 2.745 -5.218 -13.339 1.00 1.52 O ATOM 1739 OD2 ASP A 114 4.640 -4.129 -13.517 1.00 1.96 O ATOM 0 H ASP A 114 3.767 -7.293 -10.444 1.00 0.39 H new ATOM 0 HA ASP A 114 5.696 -7.957 -12.189 1.00 0.45 H new ATOM 0 HB2 ASP A 114 5.688 -6.374 -14.033 1.00 0.63 H new ATOM 0 HB3 ASP A 114 4.167 -7.244 -14.067 1.00 0.63 H new ATOM 1744 N LEU A 115 5.293 -5.828 -10.036 1.00 0.33 N ATOM 1745 CA LEU A 115 5.692 -4.667 -9.251 1.00 0.34 C ATOM 1746 C LEU A 115 7.192 -4.681 -8.959 1.00 0.37 C ATOM 1747 O LEU A 115 7.649 -5.364 -8.051 1.00 0.47 O ATOM 1748 CB LEU A 115 4.889 -4.599 -7.947 1.00 0.38 C ATOM 1749 CG LEU A 115 4.558 -3.193 -7.443 1.00 0.45 C ATOM 1750 CD1 LEU A 115 4.419 -3.228 -5.945 1.00 1.18 C ATOM 1751 CD2 LEU A 115 5.605 -2.165 -7.852 1.00 1.07 C ATOM 0 H LEU A 115 4.683 -6.483 -9.547 1.00 0.33 H new ATOM 0 HA LEU A 115 5.477 -3.775 -9.840 1.00 0.34 H new ATOM 0 HB2 LEU A 115 3.955 -5.143 -8.088 1.00 0.38 H new ATOM 0 HB3 LEU A 115 5.448 -5.121 -7.170 1.00 0.38 H new ATOM 0 HG LEU A 115 3.619 -2.884 -7.903 1.00 0.45 H new ATOM 0 HD11 LEU A 115 4.183 -2.229 -5.578 1.00 1.18 H new ATOM 0 HD12 LEU A 115 3.618 -3.914 -5.670 1.00 1.18 H new ATOM 0 HD13 LEU A 115 5.355 -3.566 -5.501 1.00 1.18 H new ATOM 0 HD21 LEU A 115 5.322 -1.185 -7.469 1.00 1.07 H new ATOM 0 HD22 LEU A 115 6.574 -2.449 -7.441 1.00 1.07 H new ATOM 0 HD23 LEU A 115 5.670 -2.125 -8.939 1.00 1.07 H new ATOM 1763 N ASP A 116 7.944 -3.938 -9.752 1.00 0.39 N ATOM 1764 CA ASP A 116 9.366 -3.752 -9.523 1.00 0.44 C ATOM 1765 C ASP A 116 9.639 -2.299 -9.146 1.00 0.43 C ATOM 1766 O ASP A 116 9.801 -1.420 -9.998 1.00 0.48 O ATOM 1767 CB ASP A 116 10.194 -4.193 -10.745 1.00 0.53 C ATOM 1768 CG ASP A 116 9.815 -3.517 -12.054 1.00 1.28 C ATOM 1769 OD1 ASP A 116 8.624 -3.179 -12.257 1.00 1.93 O ATOM 1770 OD2 ASP A 116 10.719 -3.344 -12.895 1.00 1.83 O ATOM 0 H ASP A 116 7.587 -3.447 -10.572 1.00 0.39 H new ATOM 0 HA ASP A 116 9.676 -4.387 -8.693 1.00 0.44 H new ATOM 0 HB2 ASP A 116 11.247 -3.996 -10.543 1.00 0.53 H new ATOM 0 HB3 ASP A 116 10.090 -5.271 -10.866 1.00 0.53 H new ATOM 1775 N ILE A 117 9.681 -2.063 -7.841 1.00 0.44 N ATOM 1776 CA ILE A 117 9.731 -0.715 -7.294 1.00 0.46 C ATOM 1777 C ILE A 117 10.977 0.036 -7.750 1.00 0.48 C ATOM 1778 O ILE A 117 10.880 1.184 -8.183 1.00 0.51 O ATOM 1779 CB ILE A 117 9.675 -0.741 -5.751 1.00 0.52 C ATOM 1780 CG1 ILE A 117 8.459 -1.546 -5.280 1.00 0.56 C ATOM 1781 CG2 ILE A 117 9.625 0.677 -5.194 1.00 0.58 C ATOM 1782 CD1 ILE A 117 8.382 -1.723 -3.777 1.00 0.82 C ATOM 0 H ILE A 117 9.681 -2.799 -7.135 1.00 0.44 H new ATOM 0 HA ILE A 117 8.856 -0.187 -7.674 1.00 0.46 H new ATOM 0 HB ILE A 117 10.578 -1.223 -5.378 1.00 0.52 H new ATOM 0 HG12 ILE A 117 7.552 -1.049 -5.624 1.00 0.56 H new ATOM 0 HG13 ILE A 117 8.482 -2.529 -5.751 1.00 0.56 H new ATOM 0 HG21 ILE A 117 9.586 0.639 -4.105 1.00 0.58 H new ATOM 0 HG22 ILE A 117 10.516 1.222 -5.506 1.00 0.58 H new ATOM 0 HG23 ILE A 117 8.738 1.185 -5.571 1.00 0.58 H new ATOM 0 HD11 ILE A 117 7.494 -2.303 -3.524 1.00 0.82 H new ATOM 0 HD12 ILE A 117 9.271 -2.248 -3.426 1.00 0.82 H new ATOM 0 HD13 ILE A 117 8.326 -0.746 -3.298 1.00 0.82 H new ATOM 1794 N PHE A 118 12.131 -0.616 -7.665 1.00 0.54 N ATOM 1795 CA PHE A 118 13.401 -0.008 -8.052 1.00 0.62 C ATOM 1796 C PHE A 118 13.360 0.553 -9.470 1.00 0.65 C ATOM 1797 O PHE A 118 13.952 1.592 -9.747 1.00 0.74 O ATOM 1798 CB PHE A 118 14.525 -1.032 -7.934 1.00 0.70 C ATOM 1799 CG PHE A 118 15.882 -0.477 -8.260 1.00 0.81 C ATOM 1800 CD1 PHE A 118 16.576 0.288 -7.338 1.00 0.89 C ATOM 1801 CD2 PHE A 118 16.462 -0.721 -9.493 1.00 0.92 C ATOM 1802 CE1 PHE A 118 17.823 0.799 -7.642 1.00 1.02 C ATOM 1803 CE2 PHE A 118 17.707 -0.212 -9.802 1.00 1.06 C ATOM 1804 CZ PHE A 118 18.388 0.548 -8.876 1.00 1.08 C ATOM 0 H PHE A 118 12.214 -1.575 -7.328 1.00 0.54 H new ATOM 0 HA PHE A 118 13.586 0.825 -7.373 1.00 0.62 H new ATOM 0 HB2 PHE A 118 14.538 -1.429 -6.919 1.00 0.70 H new ATOM 0 HB3 PHE A 118 14.314 -1.868 -8.600 1.00 0.70 H new ATOM 0 HD1 PHE A 118 16.138 0.487 -6.371 1.00 0.89 H new ATOM 0 HD2 PHE A 118 15.934 -1.317 -10.222 1.00 0.92 H new ATOM 0 HE1 PHE A 118 18.355 1.394 -6.915 1.00 1.02 H new ATOM 0 HE2 PHE A 118 18.147 -0.409 -10.768 1.00 1.06 H new ATOM 0 HZ PHE A 118 19.363 0.947 -9.116 1.00 1.08 H new ATOM 1814 N ASP A 119 12.677 -0.129 -10.373 1.00 0.61 N ATOM 1815 CA ASP A 119 12.559 0.359 -11.744 1.00 0.68 C ATOM 1816 C ASP A 119 11.643 1.570 -11.809 1.00 0.69 C ATOM 1817 O ASP A 119 11.921 2.536 -12.522 1.00 0.81 O ATOM 1818 CB ASP A 119 12.031 -0.729 -12.674 1.00 0.68 C ATOM 1819 CG ASP A 119 11.895 -0.250 -14.110 1.00 0.82 C ATOM 1820 OD1 ASP A 119 12.862 -0.381 -14.890 1.00 0.96 O ATOM 1821 OD2 ASP A 119 10.809 0.253 -14.474 1.00 0.89 O ATOM 0 H ASP A 119 12.200 -1.012 -10.190 1.00 0.61 H new ATOM 0 HA ASP A 119 13.557 0.647 -12.074 1.00 0.68 H new ATOM 0 HB2 ASP A 119 12.702 -1.587 -12.642 1.00 0.68 H new ATOM 0 HB3 ASP A 119 11.060 -1.070 -12.315 1.00 0.68 H new ATOM 1826 N ARG A 120 10.568 1.524 -11.037 1.00 0.61 N ATOM 1827 CA ARG A 120 9.540 2.549 -11.095 1.00 0.66 C ATOM 1828 C ARG A 120 10.000 3.844 -10.433 1.00 0.75 C ATOM 1829 O ARG A 120 9.781 4.929 -10.964 1.00 0.97 O ATOM 1830 CB ARG A 120 8.262 2.042 -10.430 1.00 0.63 C ATOM 1831 CG ARG A 120 7.699 0.782 -11.071 1.00 0.59 C ATOM 1832 CD ARG A 120 7.457 0.967 -12.561 1.00 0.72 C ATOM 1833 NE ARG A 120 6.872 -0.225 -13.171 1.00 1.02 N ATOM 1834 CZ ARG A 120 6.488 -0.304 -14.443 1.00 1.31 C ATOM 1835 NH1 ARG A 120 6.706 0.715 -15.266 1.00 1.69 N ATOM 1836 NH2 ARG A 120 5.919 -1.415 -14.899 1.00 1.65 N ATOM 0 H ARG A 120 10.385 0.783 -10.360 1.00 0.61 H new ATOM 0 HA ARG A 120 9.341 2.767 -12.144 1.00 0.66 H new ATOM 0 HB2 ARG A 120 8.464 1.845 -9.377 1.00 0.63 H new ATOM 0 HB3 ARG A 120 7.507 2.827 -10.468 1.00 0.63 H new ATOM 0 HG2 ARG A 120 8.391 -0.046 -10.915 1.00 0.59 H new ATOM 0 HG3 ARG A 120 6.763 0.512 -10.581 1.00 0.59 H new ATOM 0 HD2 ARG A 120 6.794 1.818 -12.718 1.00 0.72 H new ATOM 0 HD3 ARG A 120 8.400 1.202 -13.055 1.00 0.72 H new ATOM 0 HE ARG A 120 6.750 -1.050 -12.584 1.00 1.02 H new ATOM 0 HH11 ARG A 120 7.167 1.558 -14.923 1.00 1.69 H new ATOM 0 HH12 ARG A 120 6.412 0.655 -16.241 1.00 1.69 H new ATOM 0 HH21 ARG A 120 5.776 -2.208 -14.274 1.00 1.65 H new ATOM 0 HH22 ARG A 120 5.625 -1.474 -15.874 1.00 1.65 H new ATOM 1850 N VAL A 121 10.634 3.733 -9.275 1.00 0.65 N ATOM 1851 CA VAL A 121 11.100 4.918 -8.559 1.00 0.75 C ATOM 1852 C VAL A 121 12.541 5.266 -8.916 1.00 0.80 C ATOM 1853 O VAL A 121 12.912 6.437 -8.941 1.00 0.95 O ATOM 1854 CB VAL A 121 10.972 4.772 -7.024 1.00 0.79 C ATOM 1855 CG1 VAL A 121 9.517 4.624 -6.624 1.00 1.42 C ATOM 1856 CG2 VAL A 121 11.790 3.598 -6.508 1.00 1.49 C ATOM 0 H VAL A 121 10.837 2.847 -8.813 1.00 0.65 H new ATOM 0 HA VAL A 121 10.448 5.730 -8.880 1.00 0.75 H new ATOM 0 HB VAL A 121 11.369 5.679 -6.569 1.00 0.79 H new ATOM 0 HG11 VAL A 121 9.446 4.522 -5.541 1.00 1.42 H new ATOM 0 HG12 VAL A 121 8.960 5.505 -6.943 1.00 1.42 H new ATOM 0 HG13 VAL A 121 9.097 3.738 -7.100 1.00 1.42 H new ATOM 0 HG21 VAL A 121 11.678 3.524 -5.426 1.00 1.49 H new ATOM 0 HG22 VAL A 121 11.438 2.677 -6.973 1.00 1.49 H new ATOM 0 HG23 VAL A 121 12.841 3.751 -6.754 1.00 1.49 H new ATOM 1866 N GLY A 122 13.348 4.252 -9.198 1.00 0.76 N ATOM 1867 CA GLY A 122 14.740 4.483 -9.533 1.00 0.89 C ATOM 1868 C GLY A 122 15.605 4.587 -8.297 1.00 1.00 C ATOM 1869 O GLY A 122 16.418 3.706 -8.020 1.00 1.40 O ATOM 0 H GLY A 122 13.064 3.272 -9.201 1.00 0.76 H new ATOM 0 HA2 GLY A 122 15.102 3.670 -10.163 1.00 0.89 H new ATOM 0 HA3 GLY A 122 14.826 5.400 -10.115 1.00 0.89 H new ATOM 1873 N HIS A 123 15.433 5.667 -7.559 1.00 1.10 N ATOM 1874 CA HIS A 123 16.133 5.856 -6.299 1.00 1.36 C ATOM 1875 C HIS A 123 15.138 5.872 -5.147 1.00 1.08 C ATOM 1876 O HIS A 123 13.927 5.929 -5.373 1.00 1.41 O ATOM 1877 CB HIS A 123 16.965 7.138 -6.325 1.00 2.01 C ATOM 1878 CG HIS A 123 18.181 7.034 -7.197 1.00 2.61 C ATOM 1879 ND1 HIS A 123 19.367 6.496 -6.759 1.00 3.35 N ATOM 1880 CD2 HIS A 123 18.385 7.386 -8.487 1.00 3.26 C ATOM 1881 CE1 HIS A 123 20.250 6.520 -7.736 1.00 4.11 C ATOM 1882 NE2 HIS A 123 19.681 7.054 -8.800 1.00 4.08 N ATOM 0 H HIS A 123 14.810 6.434 -7.812 1.00 1.10 H new ATOM 0 HA HIS A 123 16.819 5.021 -6.152 1.00 1.36 H new ATOM 0 HB2 HIS A 123 16.343 7.961 -6.677 1.00 2.01 H new ATOM 0 HB3 HIS A 123 17.274 7.384 -5.309 1.00 2.01 H new ATOM 0 HD2 HIS A 123 17.663 7.843 -9.148 1.00 3.26 H new ATOM 0 HE1 HIS A 123 21.268 6.163 -7.676 1.00 4.11 H new ATOM 0 HE2 HIS A 123 20.129 7.197 -9.705 1.00 4.08 H new ATOM 1891 N SER A 124 15.653 5.820 -3.923 1.00 1.19 N ATOM 1892 CA SER A 124 14.820 5.691 -2.733 1.00 1.00 C ATOM 1893 C SER A 124 13.836 6.856 -2.588 1.00 1.02 C ATOM 1894 O SER A 124 14.188 7.934 -2.104 1.00 1.97 O ATOM 1895 CB SER A 124 15.713 5.592 -1.495 1.00 1.06 C ATOM 1896 OG SER A 124 16.662 4.547 -1.646 1.00 1.72 O ATOM 0 H SER A 124 16.653 5.866 -3.729 1.00 1.19 H new ATOM 0 HA SER A 124 14.226 4.783 -2.835 1.00 1.00 H new ATOM 0 HB2 SER A 124 16.229 6.539 -1.335 1.00 1.06 H new ATOM 0 HB3 SER A 124 15.101 5.410 -0.612 1.00 1.06 H new ATOM 0 HG SER A 124 17.226 4.499 -0.846 1.00 1.72 H new ATOM 1902 N THR A 125 12.607 6.622 -3.033 1.00 0.66 N ATOM 1903 CA THR A 125 11.522 7.586 -2.920 1.00 0.53 C ATOM 1904 C THR A 125 10.212 6.835 -2.672 1.00 0.48 C ATOM 1905 O THR A 125 10.229 5.641 -2.363 1.00 0.60 O ATOM 1906 CB THR A 125 11.388 8.442 -4.197 1.00 0.60 C ATOM 1907 OG1 THR A 125 11.289 7.597 -5.348 1.00 0.81 O ATOM 1908 CG2 THR A 125 12.569 9.385 -4.367 1.00 0.85 C ATOM 0 H THR A 125 12.334 5.750 -3.486 1.00 0.66 H new ATOM 0 HA THR A 125 11.743 8.255 -2.089 1.00 0.53 H new ATOM 0 HB THR A 125 10.483 9.041 -4.096 1.00 0.60 H new ATOM 0 HG1 THR A 125 11.203 8.149 -6.153 1.00 0.81 H new ATOM 0 HG21 THR A 125 12.439 9.971 -5.277 1.00 0.85 H new ATOM 0 HG22 THR A 125 12.626 10.055 -3.509 1.00 0.85 H new ATOM 0 HG23 THR A 125 13.490 8.806 -4.437 1.00 0.85 H new ATOM 1916 N ALA A 126 9.085 7.517 -2.816 1.00 0.44 N ATOM 1917 CA ALA A 126 7.793 6.909 -2.539 1.00 0.45 C ATOM 1918 C ALA A 126 7.087 6.474 -3.822 1.00 0.40 C ATOM 1919 O ALA A 126 6.774 7.301 -4.681 1.00 0.50 O ATOM 1920 CB ALA A 126 6.918 7.877 -1.759 1.00 0.57 C ATOM 0 H ALA A 126 9.039 8.489 -3.122 1.00 0.44 H new ATOM 0 HA ALA A 126 7.966 6.016 -1.939 1.00 0.45 H new ATOM 0 HB1 ALA A 126 5.953 7.413 -1.556 1.00 0.57 H new ATOM 0 HB2 ALA A 126 7.404 8.129 -0.817 1.00 0.57 H new ATOM 0 HB3 ALA A 126 6.768 8.785 -2.344 1.00 0.57 H new ATOM 1926 N HIS A 127 6.840 5.176 -3.942 1.00 0.33 N ATOM 1927 CA HIS A 127 6.081 4.634 -5.064 1.00 0.32 C ATOM 1928 C HIS A 127 4.626 4.482 -4.656 1.00 0.34 C ATOM 1929 O HIS A 127 4.347 4.030 -3.561 1.00 0.55 O ATOM 1930 CB HIS A 127 6.633 3.265 -5.481 1.00 0.34 C ATOM 1931 CG HIS A 127 5.944 2.681 -6.676 1.00 0.38 C ATOM 1932 ND1 HIS A 127 5.972 3.265 -7.920 1.00 0.44 N ATOM 1933 CD2 HIS A 127 5.186 1.567 -6.807 1.00 0.48 C ATOM 1934 CE1 HIS A 127 5.266 2.539 -8.761 1.00 0.50 C ATOM 1935 NE2 HIS A 127 4.776 1.502 -8.115 1.00 0.51 N ATOM 0 H HIS A 127 7.156 4.475 -3.272 1.00 0.33 H new ATOM 0 HA HIS A 127 6.167 5.318 -5.908 1.00 0.32 H new ATOM 0 HB2 HIS A 127 7.697 3.362 -5.696 1.00 0.34 H new ATOM 0 HB3 HIS A 127 6.539 2.574 -4.643 1.00 0.34 H new ATOM 0 HD2 HIS A 127 4.948 0.860 -6.026 1.00 0.48 H new ATOM 0 HE1 HIS A 127 5.114 2.758 -9.808 1.00 0.50 H new ATOM 0 HE2 HIS A 127 4.189 0.772 -8.519 1.00 0.51 H new ATOM 1944 N ASP A 128 3.693 4.848 -5.508 1.00 0.38 N ATOM 1945 CA ASP A 128 2.290 4.690 -5.158 1.00 0.47 C ATOM 1946 C ASP A 128 1.493 4.035 -6.270 1.00 0.46 C ATOM 1947 O ASP A 128 1.623 4.384 -7.442 1.00 0.61 O ATOM 1948 CB ASP A 128 1.654 6.028 -4.751 1.00 0.66 C ATOM 1949 CG ASP A 128 2.087 7.202 -5.609 1.00 0.99 C ATOM 1950 OD1 ASP A 128 1.906 7.158 -6.837 1.00 1.36 O ATOM 1951 OD2 ASP A 128 2.620 8.182 -5.040 1.00 1.64 O ATOM 0 H ASP A 128 3.869 5.249 -6.429 1.00 0.38 H new ATOM 0 HA ASP A 128 2.259 4.024 -4.296 1.00 0.47 H new ATOM 0 HB2 ASP A 128 0.569 5.934 -4.803 1.00 0.66 H new ATOM 0 HB3 ASP A 128 1.907 6.238 -3.712 1.00 0.66 H new ATOM 1956 N GLU A 129 0.705 3.041 -5.887 1.00 0.40 N ATOM 1957 CA GLU A 129 -0.266 2.436 -6.780 1.00 0.41 C ATOM 1958 C GLU A 129 -1.663 2.801 -6.300 1.00 0.33 C ATOM 1959 O GLU A 129 -2.073 2.412 -5.202 1.00 0.39 O ATOM 1960 CB GLU A 129 -0.117 0.913 -6.822 1.00 0.53 C ATOM 1961 CG GLU A 129 1.199 0.422 -7.398 1.00 0.97 C ATOM 1962 CD GLU A 129 1.359 0.758 -8.866 1.00 0.72 C ATOM 1963 OE1 GLU A 129 0.395 0.582 -9.636 1.00 1.12 O ATOM 1964 OE2 GLU A 129 2.464 1.182 -9.262 1.00 0.75 O ATOM 0 H GLU A 129 0.722 2.634 -4.952 1.00 0.40 H new ATOM 0 HA GLU A 129 -0.097 2.813 -7.788 1.00 0.41 H new ATOM 0 HB2 GLU A 129 -0.224 0.523 -5.810 1.00 0.53 H new ATOM 0 HB3 GLU A 129 -0.934 0.497 -7.412 1.00 0.53 H new ATOM 0 HG2 GLU A 129 2.023 0.863 -6.837 1.00 0.97 H new ATOM 0 HG3 GLU A 129 1.267 -0.658 -7.268 1.00 0.97 H new ATOM 1971 N ILE A 130 -2.371 3.574 -7.101 1.00 0.28 N ATOM 1972 CA ILE A 130 -3.718 3.999 -6.758 1.00 0.24 C ATOM 1973 C ILE A 130 -4.718 3.068 -7.425 1.00 0.25 C ATOM 1974 O ILE A 130 -4.873 3.086 -8.646 1.00 0.31 O ATOM 1975 CB ILE A 130 -3.979 5.450 -7.216 1.00 0.29 C ATOM 1976 CG1 ILE A 130 -2.863 6.369 -6.714 1.00 0.39 C ATOM 1977 CG2 ILE A 130 -5.339 5.933 -6.721 1.00 0.31 C ATOM 1978 CD1 ILE A 130 -2.916 7.762 -7.301 1.00 0.74 C ATOM 0 H ILE A 130 -2.035 3.923 -7.999 1.00 0.28 H new ATOM 0 HA ILE A 130 -3.829 3.960 -5.674 1.00 0.24 H new ATOM 0 HB ILE A 130 -3.987 5.476 -8.306 1.00 0.29 H new ATOM 0 HG12 ILE A 130 -2.922 6.439 -5.628 1.00 0.39 H new ATOM 0 HG13 ILE A 130 -1.899 5.920 -6.952 1.00 0.39 H new ATOM 0 HG21 ILE A 130 -5.504 6.958 -7.054 1.00 0.31 H new ATOM 0 HG22 ILE A 130 -6.122 5.290 -7.123 1.00 0.31 H new ATOM 0 HG23 ILE A 130 -5.364 5.897 -5.632 1.00 0.31 H new ATOM 0 HD11 ILE A 130 -2.095 8.357 -6.900 1.00 0.74 H new ATOM 0 HD12 ILE A 130 -2.826 7.703 -8.386 1.00 0.74 H new ATOM 0 HD13 ILE A 130 -3.865 8.231 -7.041 1.00 0.74 H new ATOM 1990 N ILE A 131 -5.389 2.254 -6.631 1.00 0.24 N ATOM 1991 CA ILE A 131 -6.229 1.197 -7.165 1.00 0.28 C ATOM 1992 C ILE A 131 -7.684 1.398 -6.754 1.00 0.25 C ATOM 1993 O ILE A 131 -8.115 0.908 -5.709 1.00 0.26 O ATOM 1994 CB ILE A 131 -5.754 -0.194 -6.682 1.00 0.35 C ATOM 1995 CG1 ILE A 131 -4.243 -0.363 -6.894 1.00 0.40 C ATOM 1996 CG2 ILE A 131 -6.514 -1.295 -7.402 1.00 0.40 C ATOM 1997 CD1 ILE A 131 -3.795 -0.213 -8.335 1.00 1.25 C ATOM 0 H ILE A 131 -5.369 2.304 -5.612 1.00 0.24 H new ATOM 0 HA ILE A 131 -6.151 1.242 -8.251 1.00 0.28 H new ATOM 0 HB ILE A 131 -5.959 -0.268 -5.614 1.00 0.35 H new ATOM 0 HG12 ILE A 131 -3.718 0.372 -6.284 1.00 0.40 H new ATOM 0 HG13 ILE A 131 -3.945 -1.348 -6.534 1.00 0.40 H new ATOM 0 HG21 ILE A 131 -6.167 -2.267 -7.050 1.00 0.40 H new ATOM 0 HG22 ILE A 131 -7.580 -1.195 -7.198 1.00 0.40 H new ATOM 0 HG23 ILE A 131 -6.341 -1.215 -8.475 1.00 0.40 H new ATOM 0 HD11 ILE A 131 -2.715 -0.347 -8.396 1.00 1.25 H new ATOM 0 HD12 ILE A 131 -4.289 -0.965 -8.950 1.00 1.25 H new ATOM 0 HD13 ILE A 131 -4.058 0.781 -8.696 1.00 1.25 H new ATOM 2009 N PRO A 132 -8.451 2.156 -7.549 1.00 0.24 N ATOM 2010 CA PRO A 132 -9.879 2.346 -7.315 1.00 0.23 C ATOM 2011 C PRO A 132 -10.686 1.107 -7.697 1.00 0.23 C ATOM 2012 O PRO A 132 -10.559 0.582 -8.809 1.00 0.25 O ATOM 2013 CB PRO A 132 -10.251 3.532 -8.222 1.00 0.26 C ATOM 2014 CG PRO A 132 -8.954 4.074 -8.724 1.00 0.29 C ATOM 2015 CD PRO A 132 -8.002 2.915 -8.720 1.00 0.28 C ATOM 0 HA PRO A 132 -10.098 2.526 -6.262 1.00 0.23 H new ATOM 0 HB2 PRO A 132 -10.887 3.211 -9.047 1.00 0.26 H new ATOM 0 HB3 PRO A 132 -10.805 4.290 -7.669 1.00 0.26 H new ATOM 0 HG2 PRO A 132 -9.064 4.487 -9.727 1.00 0.29 H new ATOM 0 HG3 PRO A 132 -8.593 4.880 -8.085 1.00 0.29 H new ATOM 0 HD2 PRO A 132 -8.069 2.329 -9.636 1.00 0.28 H new ATOM 0 HD3 PRO A 132 -6.966 3.239 -8.624 1.00 0.28 H new ATOM 2023 N ILE A 133 -11.501 0.641 -6.766 1.00 0.21 N ATOM 2024 CA ILE A 133 -12.372 -0.494 -6.997 1.00 0.21 C ATOM 2025 C ILE A 133 -13.811 -0.007 -7.046 1.00 0.19 C ATOM 2026 O ILE A 133 -14.176 0.935 -6.343 1.00 0.26 O ATOM 2027 CB ILE A 133 -12.237 -1.576 -5.886 1.00 0.23 C ATOM 2028 CG1 ILE A 133 -13.098 -1.240 -4.665 1.00 0.25 C ATOM 2029 CG2 ILE A 133 -10.790 -1.718 -5.449 1.00 0.26 C ATOM 2030 CD1 ILE A 133 -13.006 -2.266 -3.556 1.00 0.27 C ATOM 0 H ILE A 133 -11.576 1.040 -5.830 1.00 0.21 H new ATOM 0 HA ILE A 133 -12.081 -0.953 -7.942 1.00 0.21 H new ATOM 0 HB ILE A 133 -12.586 -2.517 -6.312 1.00 0.23 H new ATOM 0 HG12 ILE A 133 -12.796 -0.268 -4.275 1.00 0.25 H new ATOM 0 HG13 ILE A 133 -14.138 -1.149 -4.979 1.00 0.25 H new ATOM 0 HG21 ILE A 133 -10.718 -2.479 -4.672 1.00 0.26 H new ATOM 0 HG22 ILE A 133 -10.179 -2.012 -6.303 1.00 0.26 H new ATOM 0 HG23 ILE A 133 -10.433 -0.765 -5.058 1.00 0.26 H new ATOM 0 HD11 ILE A 133 -13.642 -1.961 -2.725 1.00 0.27 H new ATOM 0 HD12 ILE A 133 -13.336 -3.236 -3.929 1.00 0.27 H new ATOM 0 HD13 ILE A 133 -11.974 -2.341 -3.214 1.00 0.27 H new ATOM 2042 N SER A 134 -14.618 -0.617 -7.882 1.00 0.19 N ATOM 2043 CA SER A 134 -16.018 -0.260 -7.957 1.00 0.21 C ATOM 2044 C SER A 134 -16.889 -1.435 -7.539 1.00 0.22 C ATOM 2045 O SER A 134 -17.000 -2.435 -8.254 1.00 0.25 O ATOM 2046 CB SER A 134 -16.366 0.215 -9.371 1.00 0.26 C ATOM 2047 OG SER A 134 -15.820 -0.648 -10.354 1.00 1.24 O ATOM 0 H SER A 134 -14.332 -1.361 -8.519 1.00 0.19 H new ATOM 0 HA SER A 134 -16.212 0.561 -7.267 1.00 0.21 H new ATOM 0 HB2 SER A 134 -17.449 0.260 -9.485 1.00 0.26 H new ATOM 0 HB3 SER A 134 -15.987 1.226 -9.521 1.00 0.26 H new ATOM 0 HG SER A 134 -16.060 -0.321 -11.246 1.00 1.24 H new ATOM 2053 N ILE A 135 -17.484 -1.330 -6.364 1.00 0.23 N ATOM 2054 CA ILE A 135 -18.379 -2.366 -5.883 1.00 0.25 C ATOM 2055 C ILE A 135 -19.803 -1.952 -6.147 1.00 0.29 C ATOM 2056 O ILE A 135 -20.175 -0.821 -5.854 1.00 0.34 O ATOM 2057 CB ILE A 135 -18.243 -2.627 -4.370 1.00 0.26 C ATOM 2058 CG1 ILE A 135 -16.777 -2.715 -3.971 1.00 0.28 C ATOM 2059 CG2 ILE A 135 -18.996 -3.893 -3.978 1.00 0.30 C ATOM 2060 CD1 ILE A 135 -16.547 -3.322 -2.603 1.00 0.32 C ATOM 0 H ILE A 135 -17.364 -0.541 -5.728 1.00 0.23 H new ATOM 0 HA ILE A 135 -18.111 -3.280 -6.413 1.00 0.25 H new ATOM 0 HB ILE A 135 -18.687 -1.790 -3.832 1.00 0.26 H new ATOM 0 HG12 ILE A 135 -16.244 -3.307 -4.714 1.00 0.28 H new ATOM 0 HG13 ILE A 135 -16.345 -1.715 -3.991 1.00 0.28 H new ATOM 0 HG21 ILE A 135 -18.890 -4.063 -2.907 1.00 0.30 H new ATOM 0 HG22 ILE A 135 -20.052 -3.779 -4.224 1.00 0.30 H new ATOM 0 HG23 ILE A 135 -18.586 -4.744 -4.522 1.00 0.30 H new ATOM 0 HD11 ILE A 135 -15.478 -3.350 -2.392 1.00 0.32 H new ATOM 0 HD12 ILE A 135 -17.050 -2.718 -1.848 1.00 0.32 H new ATOM 0 HD13 ILE A 135 -16.947 -4.336 -2.583 1.00 0.32 H new ATOM 2072 N LYS A 136 -20.582 -2.854 -6.715 1.00 0.31 N ATOM 2073 CA LYS A 136 -22.003 -2.628 -6.906 1.00 0.37 C ATOM 2074 C LYS A 136 -22.752 -3.946 -6.820 1.00 0.40 C ATOM 2075 O LYS A 136 -22.365 -4.929 -7.455 1.00 0.42 O ATOM 2076 CB LYS A 136 -22.290 -1.961 -8.254 1.00 0.46 C ATOM 2077 CG LYS A 136 -21.771 -0.537 -8.369 1.00 0.66 C ATOM 2078 CD LYS A 136 -22.598 0.425 -7.531 1.00 1.28 C ATOM 2079 CE LYS A 136 -22.025 1.833 -7.554 1.00 1.51 C ATOM 2080 NZ LYS A 136 -22.927 2.808 -6.883 1.00 1.95 N ATOM 0 H LYS A 136 -20.251 -3.757 -7.055 1.00 0.31 H new ATOM 0 HA LYS A 136 -22.343 -1.957 -6.117 1.00 0.37 H new ATOM 0 HB2 LYS A 136 -21.845 -2.563 -9.046 1.00 0.46 H new ATOM 0 HB3 LYS A 136 -23.367 -1.958 -8.423 1.00 0.46 H new ATOM 0 HG2 LYS A 136 -20.730 -0.500 -8.047 1.00 0.66 H new ATOM 0 HG3 LYS A 136 -21.793 -0.224 -9.413 1.00 0.66 H new ATOM 0 HD2 LYS A 136 -23.622 0.444 -7.904 1.00 1.28 H new ATOM 0 HD3 LYS A 136 -22.640 0.067 -6.502 1.00 1.28 H new ATOM 0 HE2 LYS A 136 -21.053 1.838 -7.061 1.00 1.51 H new ATOM 0 HE3 LYS A 136 -21.860 2.141 -8.586 1.00 1.51 H new ATOM 0 HZ1 LYS A 136 -22.502 3.756 -6.919 1.00 1.95 H new ATOM 0 HZ2 LYS A 136 -23.846 2.822 -7.369 1.00 1.95 H new ATOM 0 HZ3 LYS A 136 -23.064 2.528 -5.891 1.00 1.95 H new ATOM 2094 N LYS A 137 -23.798 -3.964 -6.005 1.00 0.46 N ATOM 2095 CA LYS A 137 -24.653 -5.140 -5.839 1.00 0.54 C ATOM 2096 C LYS A 137 -23.863 -6.338 -5.312 1.00 0.48 C ATOM 2097 O LYS A 137 -24.236 -7.490 -5.530 1.00 0.54 O ATOM 2098 CB LYS A 137 -25.344 -5.497 -7.159 1.00 0.65 C ATOM 2099 CG LYS A 137 -26.272 -4.408 -7.672 1.00 0.81 C ATOM 2100 CD LYS A 137 -26.926 -4.799 -8.987 1.00 1.53 C ATOM 2101 CE LYS A 137 -25.893 -5.032 -10.076 1.00 2.40 C ATOM 2102 NZ LYS A 137 -26.522 -5.339 -11.385 1.00 3.13 N ATOM 0 H LYS A 137 -24.081 -3.165 -5.438 1.00 0.46 H new ATOM 0 HA LYS A 137 -25.415 -4.890 -5.100 1.00 0.54 H new ATOM 0 HB2 LYS A 137 -24.585 -5.701 -7.914 1.00 0.65 H new ATOM 0 HB3 LYS A 137 -25.915 -6.416 -7.024 1.00 0.65 H new ATOM 0 HG2 LYS A 137 -27.043 -4.207 -6.928 1.00 0.81 H new ATOM 0 HG3 LYS A 137 -25.709 -3.484 -7.806 1.00 0.81 H new ATOM 0 HD2 LYS A 137 -27.517 -5.704 -8.845 1.00 1.53 H new ATOM 0 HD3 LYS A 137 -27.615 -4.014 -9.299 1.00 1.53 H new ATOM 0 HE2 LYS A 137 -25.265 -4.147 -10.175 1.00 2.40 H new ATOM 0 HE3 LYS A 137 -25.240 -5.855 -9.786 1.00 2.40 H new ATOM 0 HZ1 LYS A 137 -25.781 -5.491 -12.099 1.00 3.13 H new ATOM 0 HZ2 LYS A 137 -27.101 -6.198 -11.299 1.00 3.13 H new ATOM 0 HZ3 LYS A 137 -27.125 -4.543 -11.676 1.00 3.13 H new ATOM 2116 N GLY A 138 -22.766 -6.056 -4.625 1.00 0.41 N ATOM 2117 CA GLY A 138 -21.980 -7.115 -4.025 1.00 0.40 C ATOM 2118 C GLY A 138 -20.903 -7.644 -4.949 1.00 0.37 C ATOM 2119 O GLY A 138 -20.270 -8.657 -4.656 1.00 0.39 O ATOM 0 H GLY A 138 -22.406 -5.114 -4.472 1.00 0.41 H new ATOM 0 HA2 GLY A 138 -21.517 -6.744 -3.111 1.00 0.40 H new ATOM 0 HA3 GLY A 138 -22.640 -7.933 -3.739 1.00 0.40 H new ATOM 2123 N LYS A 139 -20.702 -6.983 -6.078 1.00 0.37 N ATOM 2124 CA LYS A 139 -19.635 -7.360 -6.990 1.00 0.36 C ATOM 2125 C LYS A 139 -18.572 -6.279 -7.007 1.00 0.32 C ATOM 2126 O LYS A 139 -18.888 -5.093 -6.999 1.00 0.40 O ATOM 2127 CB LYS A 139 -20.160 -7.611 -8.406 1.00 0.44 C ATOM 2128 CG LYS A 139 -21.086 -8.812 -8.524 1.00 0.87 C ATOM 2129 CD LYS A 139 -22.476 -8.511 -7.990 1.00 1.14 C ATOM 2130 CE LYS A 139 -23.304 -9.773 -7.839 1.00 1.64 C ATOM 2131 NZ LYS A 139 -24.694 -9.474 -7.396 1.00 2.23 N ATOM 0 H LYS A 139 -21.261 -6.186 -6.383 1.00 0.37 H new ATOM 0 HA LYS A 139 -19.201 -8.294 -6.633 1.00 0.36 H new ATOM 0 HB2 LYS A 139 -20.691 -6.722 -8.747 1.00 0.44 H new ATOM 0 HB3 LYS A 139 -19.312 -7.753 -9.076 1.00 0.44 H new ATOM 0 HG2 LYS A 139 -21.156 -9.115 -9.569 1.00 0.87 H new ATOM 0 HG3 LYS A 139 -20.661 -9.653 -7.976 1.00 0.87 H new ATOM 0 HD2 LYS A 139 -22.395 -8.011 -7.025 1.00 1.14 H new ATOM 0 HD3 LYS A 139 -22.984 -7.821 -8.664 1.00 1.14 H new ATOM 0 HE2 LYS A 139 -23.332 -10.305 -8.790 1.00 1.64 H new ATOM 0 HE3 LYS A 139 -22.827 -10.436 -7.117 1.00 1.64 H new ATOM 0 HZ1 LYS A 139 -25.164 -10.356 -7.110 1.00 2.23 H new ATOM 0 HZ2 LYS A 139 -24.668 -8.818 -6.589 1.00 2.23 H new ATOM 0 HZ3 LYS A 139 -25.222 -9.039 -8.179 1.00 2.23 H new ATOM 2145 N LEU A 140 -17.323 -6.698 -7.037 1.00 0.33 N ATOM 2146 CA LEU A 140 -16.201 -5.795 -6.887 1.00 0.30 C ATOM 2147 C LEU A 140 -15.387 -5.764 -8.180 1.00 0.31 C ATOM 2148 O LEU A 140 -14.811 -6.774 -8.589 1.00 0.41 O ATOM 2149 CB LEU A 140 -15.354 -6.281 -5.704 1.00 0.32 C ATOM 2150 CG LEU A 140 -14.362 -5.286 -5.109 1.00 0.32 C ATOM 2151 CD1 LEU A 140 -13.984 -5.718 -3.703 1.00 0.39 C ATOM 2152 CD2 LEU A 140 -13.117 -5.190 -5.965 1.00 0.37 C ATOM 0 H LEU A 140 -17.058 -7.674 -7.166 1.00 0.33 H new ATOM 0 HA LEU A 140 -16.543 -4.779 -6.690 1.00 0.30 H new ATOM 0 HB2 LEU A 140 -16.031 -6.600 -4.911 1.00 0.32 H new ATOM 0 HB3 LEU A 140 -14.799 -7.163 -6.024 1.00 0.32 H new ATOM 0 HG LEU A 140 -14.835 -4.305 -5.076 1.00 0.32 H new ATOM 0 HD11 LEU A 140 -13.275 -5.005 -3.281 1.00 0.39 H new ATOM 0 HD12 LEU A 140 -14.878 -5.753 -3.080 1.00 0.39 H new ATOM 0 HD13 LEU A 140 -13.527 -6.707 -3.737 1.00 0.39 H new ATOM 0 HD21 LEU A 140 -12.424 -4.475 -5.521 1.00 0.37 H new ATOM 0 HD22 LEU A 140 -12.640 -6.168 -6.024 1.00 0.37 H new ATOM 0 HD23 LEU A 140 -13.389 -4.858 -6.967 1.00 0.37 H new ATOM 2164 N SER A 141 -15.351 -4.607 -8.822 1.00 0.28 N ATOM 2165 CA SER A 141 -14.646 -4.457 -10.085 1.00 0.31 C ATOM 2166 C SER A 141 -13.384 -3.617 -9.906 1.00 0.28 C ATOM 2167 O SER A 141 -13.451 -2.439 -9.575 1.00 0.36 O ATOM 2168 CB SER A 141 -15.567 -3.807 -11.119 1.00 0.39 C ATOM 2169 OG SER A 141 -16.846 -4.421 -11.114 1.00 1.19 O ATOM 0 H SER A 141 -15.803 -3.756 -8.488 1.00 0.28 H new ATOM 0 HA SER A 141 -14.351 -5.446 -10.436 1.00 0.31 H new ATOM 0 HB2 SER A 141 -15.669 -2.743 -10.904 1.00 0.39 H new ATOM 0 HB3 SER A 141 -15.123 -3.890 -12.111 1.00 0.39 H new ATOM 0 HG SER A 141 -17.419 -3.989 -11.781 1.00 1.19 H new ATOM 2175 N VAL A 142 -12.232 -4.226 -10.115 1.00 0.33 N ATOM 2176 CA VAL A 142 -10.971 -3.516 -10.003 1.00 0.35 C ATOM 2177 C VAL A 142 -10.388 -3.254 -11.382 1.00 0.43 C ATOM 2178 O VAL A 142 -9.871 -4.174 -12.022 1.00 0.48 O ATOM 2179 CB VAL A 142 -9.937 -4.296 -9.175 1.00 0.35 C ATOM 2180 CG1 VAL A 142 -8.640 -3.514 -9.070 1.00 0.92 C ATOM 2181 CG2 VAL A 142 -10.472 -4.617 -7.796 1.00 0.83 C ATOM 0 H VAL A 142 -12.143 -5.211 -10.363 1.00 0.33 H new ATOM 0 HA VAL A 142 -11.185 -2.576 -9.494 1.00 0.35 H new ATOM 0 HB VAL A 142 -9.738 -5.237 -9.688 1.00 0.35 H new ATOM 0 HG11 VAL A 142 -7.920 -4.081 -8.480 1.00 0.92 H new ATOM 0 HG12 VAL A 142 -8.237 -3.342 -10.068 1.00 0.92 H new ATOM 0 HG13 VAL A 142 -8.831 -2.556 -8.586 1.00 0.92 H new ATOM 0 HG21 VAL A 142 -9.719 -5.169 -7.233 1.00 0.83 H new ATOM 0 HG22 VAL A 142 -10.709 -3.691 -7.273 1.00 0.83 H new ATOM 0 HG23 VAL A 142 -11.373 -5.223 -7.887 1.00 0.83 H new ATOM 2191 N GLN A 143 -10.486 -2.005 -11.829 1.00 0.56 N ATOM 2192 CA GLN A 143 -9.967 -1.587 -13.132 1.00 0.70 C ATOM 2193 C GLN A 143 -10.709 -2.295 -14.269 1.00 0.82 C ATOM 2194 O GLN A 143 -11.641 -1.739 -14.847 1.00 1.45 O ATOM 2195 CB GLN A 143 -8.455 -1.845 -13.236 1.00 0.74 C ATOM 2196 CG GLN A 143 -7.623 -1.077 -12.218 1.00 0.83 C ATOM 2197 CD GLN A 143 -7.746 0.425 -12.375 1.00 1.15 C ATOM 2198 OE1 GLN A 143 -8.679 1.025 -11.651 1.00 1.88 O flip ATOM 2199 NE2 GLN A 143 -6.998 1.045 -13.129 1.00 1.11 N flip ATOM 0 H GLN A 143 -10.927 -1.253 -11.300 1.00 0.56 H new ATOM 0 HA GLN A 143 -10.136 -0.514 -13.226 1.00 0.70 H new ATOM 0 HB2 GLN A 143 -8.270 -2.912 -13.110 1.00 0.74 H new ATOM 0 HB3 GLN A 143 -8.120 -1.579 -14.238 1.00 0.74 H new ATOM 0 HG2 GLN A 143 -7.935 -1.360 -11.213 1.00 0.83 H new ATOM 0 HG3 GLN A 143 -6.576 -1.364 -12.320 1.00 0.83 H new ATOM 0 HE21 GLN A 143 -6.292 0.546 -13.670 1.00 1.11 H new ATOM 0 HE22 GLN A 143 -7.084 2.058 -13.213 1.00 1.11 H new ATOM 2208 N GLY A 144 -10.303 -3.519 -14.574 1.00 0.86 N ATOM 2209 CA GLY A 144 -10.966 -4.288 -15.608 1.00 0.96 C ATOM 2210 C GLY A 144 -11.321 -5.687 -15.145 1.00 0.85 C ATOM 2211 O GLY A 144 -11.860 -6.484 -15.909 1.00 1.02 O ATOM 0 H GLY A 144 -9.523 -3.995 -14.122 1.00 0.86 H new ATOM 0 HA2 GLY A 144 -11.873 -3.769 -15.919 1.00 0.96 H new ATOM 0 HA3 GLY A 144 -10.319 -4.350 -16.483 1.00 0.96 H new ATOM 2215 N GLU A 145 -11.015 -5.983 -13.889 1.00 0.66 N ATOM 2216 CA GLU A 145 -11.284 -7.296 -13.321 1.00 0.65 C ATOM 2217 C GLU A 145 -12.568 -7.257 -12.505 1.00 0.52 C ATOM 2218 O GLU A 145 -12.619 -6.607 -11.460 1.00 0.55 O ATOM 2219 CB GLU A 145 -10.119 -7.732 -12.427 1.00 0.74 C ATOM 2220 CG GLU A 145 -8.774 -7.776 -13.139 1.00 1.06 C ATOM 2221 CD GLU A 145 -8.736 -8.800 -14.253 1.00 1.35 C ATOM 2222 OE1 GLU A 145 -8.705 -10.012 -13.952 1.00 1.95 O ATOM 2223 OE2 GLU A 145 -8.728 -8.398 -15.436 1.00 1.84 O ATOM 0 H GLU A 145 -10.578 -5.327 -13.241 1.00 0.66 H new ATOM 0 HA GLU A 145 -11.397 -8.013 -14.134 1.00 0.65 H new ATOM 0 HB2 GLU A 145 -10.048 -7.048 -11.581 1.00 0.74 H new ATOM 0 HB3 GLU A 145 -10.336 -8.720 -12.021 1.00 0.74 H new ATOM 0 HG2 GLU A 145 -8.552 -6.791 -13.549 1.00 1.06 H new ATOM 0 HG3 GLU A 145 -7.992 -8.004 -12.415 1.00 1.06 H new ATOM 2230 N VAL A 146 -13.595 -7.951 -12.969 1.00 0.59 N ATOM 2231 CA VAL A 146 -14.883 -7.939 -12.290 1.00 0.54 C ATOM 2232 C VAL A 146 -15.237 -9.319 -11.737 1.00 0.53 C ATOM 2233 O VAL A 146 -15.354 -10.298 -12.479 1.00 0.67 O ATOM 2234 CB VAL A 146 -16.014 -7.431 -13.219 1.00 0.64 C ATOM 2235 CG1 VAL A 146 -16.047 -8.204 -14.529 1.00 0.92 C ATOM 2236 CG2 VAL A 146 -17.368 -7.508 -12.522 1.00 0.92 C ATOM 0 H VAL A 146 -13.563 -8.528 -13.810 1.00 0.59 H new ATOM 0 HA VAL A 146 -14.791 -7.246 -11.454 1.00 0.54 H new ATOM 0 HB VAL A 146 -15.802 -6.387 -13.450 1.00 0.64 H new ATOM 0 HG11 VAL A 146 -16.852 -7.822 -15.157 1.00 0.92 H new ATOM 0 HG12 VAL A 146 -15.095 -8.084 -15.046 1.00 0.92 H new ATOM 0 HG13 VAL A 146 -16.218 -9.261 -14.324 1.00 0.92 H new ATOM 0 HG21 VAL A 146 -18.145 -7.146 -13.195 1.00 0.92 H new ATOM 0 HG22 VAL A 146 -17.578 -8.542 -12.248 1.00 0.92 H new ATOM 0 HG23 VAL A 146 -17.350 -6.891 -11.623 1.00 0.92 H new ATOM 2246 N SER A 147 -15.395 -9.384 -10.427 1.00 0.47 N ATOM 2247 CA SER A 147 -15.791 -10.609 -9.752 1.00 0.47 C ATOM 2248 C SER A 147 -16.662 -10.255 -8.560 1.00 0.48 C ATOM 2249 O SER A 147 -16.593 -9.138 -8.052 1.00 0.79 O ATOM 2250 CB SER A 147 -14.560 -11.384 -9.272 1.00 0.54 C ATOM 2251 OG SER A 147 -13.663 -11.658 -10.338 1.00 1.27 O ATOM 0 H SER A 147 -15.253 -8.591 -9.801 1.00 0.47 H new ATOM 0 HA SER A 147 -16.344 -11.237 -10.450 1.00 0.47 H new ATOM 0 HB2 SER A 147 -14.045 -10.809 -8.502 1.00 0.54 H new ATOM 0 HB3 SER A 147 -14.876 -12.321 -8.813 1.00 0.54 H new ATOM 0 HG SER A 147 -12.832 -11.157 -10.203 1.00 1.27 H new ATOM 2257 N THR A 148 -17.492 -11.185 -8.124 1.00 0.41 N ATOM 2258 CA THR A 148 -18.306 -10.967 -6.944 1.00 0.40 C ATOM 2259 C THR A 148 -17.423 -10.783 -5.710 1.00 0.39 C ATOM 2260 O THR A 148 -16.401 -11.458 -5.557 1.00 0.46 O ATOM 2261 CB THR A 148 -19.279 -12.138 -6.712 1.00 0.46 C ATOM 2262 OG1 THR A 148 -18.556 -13.376 -6.663 1.00 1.45 O ATOM 2263 CG2 THR A 148 -20.327 -12.204 -7.813 1.00 1.28 C ATOM 0 H THR A 148 -17.619 -12.095 -8.568 1.00 0.41 H new ATOM 0 HA THR A 148 -18.888 -10.060 -7.109 1.00 0.40 H new ATOM 0 HB THR A 148 -19.785 -11.973 -5.761 1.00 0.46 H new ATOM 0 HG1 THR A 148 -19.182 -14.115 -6.513 1.00 1.45 H new ATOM 0 HG21 THR A 148 -21.001 -13.040 -7.624 1.00 1.28 H new ATOM 0 HG22 THR A 148 -20.897 -11.275 -7.829 1.00 1.28 H new ATOM 0 HG23 THR A 148 -19.835 -12.345 -8.776 1.00 1.28 H new ATOM 2271 N PHE A 149 -17.821 -9.863 -4.849 1.00 0.35 N ATOM 2272 CA PHE A 149 -17.099 -9.583 -3.618 1.00 0.32 C ATOM 2273 C PHE A 149 -17.446 -10.636 -2.575 1.00 0.35 C ATOM 2274 O PHE A 149 -18.587 -11.094 -2.509 1.00 0.43 O ATOM 2275 CB PHE A 149 -17.463 -8.174 -3.125 1.00 0.30 C ATOM 2276 CG PHE A 149 -17.161 -7.912 -1.674 1.00 0.30 C ATOM 2277 CD1 PHE A 149 -15.904 -7.484 -1.270 1.00 0.34 C ATOM 2278 CD2 PHE A 149 -18.142 -8.095 -0.712 1.00 0.38 C ATOM 2279 CE1 PHE A 149 -15.639 -7.248 0.061 1.00 0.42 C ATOM 2280 CE2 PHE A 149 -17.879 -7.860 0.620 1.00 0.46 C ATOM 2281 CZ PHE A 149 -16.625 -7.438 1.006 1.00 0.47 C ATOM 0 H PHE A 149 -18.653 -9.289 -4.982 1.00 0.35 H new ATOM 0 HA PHE A 149 -16.024 -9.620 -3.796 1.00 0.32 H new ATOM 0 HB2 PHE A 149 -16.926 -7.443 -3.730 1.00 0.30 H new ATOM 0 HB3 PHE A 149 -18.527 -8.009 -3.295 1.00 0.30 H new ATOM 0 HD1 PHE A 149 -15.127 -7.335 -2.005 1.00 0.34 H new ATOM 0 HD2 PHE A 149 -19.126 -8.426 -1.010 1.00 0.38 H new ATOM 0 HE1 PHE A 149 -14.658 -6.914 0.365 1.00 0.42 H new ATOM 0 HE2 PHE A 149 -18.653 -8.006 1.359 1.00 0.46 H new ATOM 0 HZ PHE A 149 -16.414 -7.256 2.050 1.00 0.47 H new ATOM 2291 N THR A 150 -16.469 -11.032 -1.775 1.00 0.37 N ATOM 2292 CA THR A 150 -16.681 -12.081 -0.798 1.00 0.48 C ATOM 2293 C THR A 150 -16.023 -11.749 0.545 1.00 0.43 C ATOM 2294 O THR A 150 -14.803 -11.840 0.700 1.00 0.82 O ATOM 2295 CB THR A 150 -16.180 -13.449 -1.331 1.00 0.78 C ATOM 2296 OG1 THR A 150 -16.223 -14.441 -0.296 1.00 1.79 O ATOM 2297 CG2 THR A 150 -14.766 -13.348 -1.892 1.00 1.25 C ATOM 0 H THR A 150 -15.526 -10.643 -1.785 1.00 0.37 H new ATOM 0 HA THR A 150 -17.756 -12.151 -0.629 1.00 0.48 H new ATOM 0 HB THR A 150 -16.847 -13.747 -2.140 1.00 0.78 H new ATOM 0 HG1 THR A 150 -15.905 -15.298 -0.650 1.00 1.79 H new ATOM 0 HG21 THR A 150 -14.448 -14.325 -2.256 1.00 1.25 H new ATOM 0 HG22 THR A 150 -14.751 -12.632 -2.714 1.00 1.25 H new ATOM 0 HG23 THR A 150 -14.086 -13.015 -1.108 1.00 1.25 H new ATOM 2305 N GLY A 151 -16.846 -11.326 1.502 1.00 0.42 N ATOM 2306 CA GLY A 151 -16.392 -11.135 2.870 1.00 0.37 C ATOM 2307 C GLY A 151 -15.604 -9.862 3.084 1.00 0.32 C ATOM 2308 O GLY A 151 -16.038 -8.981 3.830 1.00 0.34 O ATOM 0 H GLY A 151 -17.831 -11.110 1.351 1.00 0.42 H new ATOM 0 HA2 GLY A 151 -17.258 -11.130 3.532 1.00 0.37 H new ATOM 0 HA3 GLY A 151 -15.775 -11.985 3.159 1.00 0.37 H new ATOM 2312 N LYS A 152 -14.449 -9.754 2.450 1.00 0.29 N ATOM 2313 CA LYS A 152 -13.614 -8.582 2.628 1.00 0.28 C ATOM 2314 C LYS A 152 -12.698 -8.388 1.432 1.00 0.27 C ATOM 2315 O LYS A 152 -12.606 -9.250 0.559 1.00 0.33 O ATOM 2316 CB LYS A 152 -12.790 -8.682 3.928 1.00 0.36 C ATOM 2317 CG LYS A 152 -11.387 -9.265 3.784 1.00 0.44 C ATOM 2318 CD LYS A 152 -11.395 -10.774 3.634 1.00 0.62 C ATOM 2319 CE LYS A 152 -9.989 -11.332 3.506 1.00 0.77 C ATOM 2320 NZ LYS A 152 -9.979 -12.816 3.543 1.00 1.23 N ATOM 0 H LYS A 152 -14.072 -10.457 1.814 1.00 0.29 H new ATOM 0 HA LYS A 152 -14.268 -7.714 2.706 1.00 0.28 H new ATOM 0 HB2 LYS A 152 -12.706 -7.685 4.360 1.00 0.36 H new ATOM 0 HB3 LYS A 152 -13.345 -9.292 4.641 1.00 0.36 H new ATOM 0 HG2 LYS A 152 -10.900 -8.820 2.916 1.00 0.44 H new ATOM 0 HG3 LYS A 152 -10.793 -8.994 4.657 1.00 0.44 H new ATOM 0 HD2 LYS A 152 -11.888 -11.223 4.496 1.00 0.62 H new ATOM 0 HD3 LYS A 152 -11.977 -11.049 2.755 1.00 0.62 H new ATOM 0 HE2 LYS A 152 -9.546 -10.989 2.571 1.00 0.77 H new ATOM 0 HE3 LYS A 152 -9.369 -10.944 4.314 1.00 0.77 H new ATOM 0 HZ1 LYS A 152 -9.001 -13.159 3.453 1.00 1.23 H new ATOM 0 HZ2 LYS A 152 -10.379 -13.143 4.445 1.00 1.23 H new ATOM 0 HZ3 LYS A 152 -10.550 -13.187 2.757 1.00 1.23 H new ATOM 2334 N LEU A 153 -12.033 -7.246 1.402 1.00 0.23 N ATOM 2335 CA LEU A 153 -11.034 -6.973 0.386 1.00 0.24 C ATOM 2336 C LEU A 153 -9.742 -7.646 0.805 1.00 0.26 C ATOM 2337 O LEU A 153 -9.326 -7.518 1.949 1.00 0.44 O ATOM 2338 CB LEU A 153 -10.822 -5.468 0.221 1.00 0.26 C ATOM 2339 CG LEU A 153 -9.979 -5.071 -0.987 1.00 0.35 C ATOM 2340 CD1 LEU A 153 -10.752 -5.323 -2.270 1.00 1.17 C ATOM 2341 CD2 LEU A 153 -9.550 -3.617 -0.891 1.00 1.16 C ATOM 0 H LEU A 153 -12.169 -6.490 2.073 1.00 0.23 H new ATOM 0 HA LEU A 153 -11.369 -7.363 -0.575 1.00 0.24 H new ATOM 0 HB2 LEU A 153 -11.796 -4.984 0.142 1.00 0.26 H new ATOM 0 HB3 LEU A 153 -10.346 -5.081 1.122 1.00 0.26 H new ATOM 0 HG LEU A 153 -9.078 -5.685 -0.999 1.00 0.35 H new ATOM 0 HD11 LEU A 153 -10.141 -5.036 -3.126 1.00 1.17 H new ATOM 0 HD12 LEU A 153 -11.003 -6.381 -2.342 1.00 1.17 H new ATOM 0 HD13 LEU A 153 -11.668 -4.733 -2.265 1.00 1.17 H new ATOM 0 HD21 LEU A 153 -8.950 -3.356 -1.763 1.00 1.16 H new ATOM 0 HD22 LEU A 153 -10.433 -2.979 -0.854 1.00 1.16 H new ATOM 0 HD23 LEU A 153 -8.959 -3.471 0.013 1.00 1.16 H new ATOM 2353 N SER A 154 -9.114 -8.381 -0.086 1.00 0.24 N ATOM 2354 CA SER A 154 -7.988 -9.188 0.321 1.00 0.27 C ATOM 2355 C SER A 154 -6.740 -8.861 -0.479 1.00 0.30 C ATOM 2356 O SER A 154 -6.576 -9.301 -1.613 1.00 0.50 O ATOM 2357 CB SER A 154 -8.356 -10.657 0.179 1.00 0.38 C ATOM 2358 OG SER A 154 -9.190 -10.880 -0.936 1.00 1.35 O ATOM 0 H SER A 154 -9.357 -8.436 -1.075 1.00 0.24 H new ATOM 0 HA SER A 154 -7.757 -8.967 1.363 1.00 0.27 H new ATOM 0 HB2 SER A 154 -7.448 -11.252 0.079 1.00 0.38 H new ATOM 0 HB3 SER A 154 -8.860 -10.995 1.084 1.00 0.38 H new ATOM 0 HG SER A 154 -9.671 -11.726 -0.821 1.00 1.35 H new ATOM 2364 N VAL A 155 -5.843 -8.111 0.125 1.00 0.26 N ATOM 2365 CA VAL A 155 -4.658 -7.679 -0.584 1.00 0.28 C ATOM 2366 C VAL A 155 -3.523 -8.654 -0.346 1.00 0.29 C ATOM 2367 O VAL A 155 -2.815 -8.563 0.653 1.00 0.38 O ATOM 2368 CB VAL A 155 -4.218 -6.260 -0.165 1.00 0.34 C ATOM 2369 CG1 VAL A 155 -3.010 -5.804 -0.974 1.00 0.42 C ATOM 2370 CG2 VAL A 155 -5.368 -5.282 -0.331 1.00 0.39 C ATOM 0 H VAL A 155 -5.909 -7.792 1.091 1.00 0.26 H new ATOM 0 HA VAL A 155 -4.907 -7.653 -1.645 1.00 0.28 H new ATOM 0 HB VAL A 155 -3.930 -6.288 0.886 1.00 0.34 H new ATOM 0 HG11 VAL A 155 -2.719 -4.801 -0.660 1.00 0.42 H new ATOM 0 HG12 VAL A 155 -2.180 -6.491 -0.808 1.00 0.42 H new ATOM 0 HG13 VAL A 155 -3.265 -5.793 -2.034 1.00 0.42 H new ATOM 0 HG21 VAL A 155 -5.044 -4.285 -0.032 1.00 0.39 H new ATOM 0 HG22 VAL A 155 -5.682 -5.264 -1.375 1.00 0.39 H new ATOM 0 HG23 VAL A 155 -6.204 -5.594 0.294 1.00 0.39 H new ATOM 2380 N GLU A 156 -3.355 -9.583 -1.275 1.00 0.32 N ATOM 2381 CA GLU A 156 -2.288 -10.558 -1.185 1.00 0.40 C ATOM 2382 C GLU A 156 -1.135 -10.114 -2.053 1.00 0.36 C ATOM 2383 O GLU A 156 -1.294 -9.939 -3.263 1.00 0.42 O ATOM 2384 CB GLU A 156 -2.744 -11.953 -1.634 1.00 0.61 C ATOM 2385 CG GLU A 156 -3.554 -12.726 -0.603 1.00 0.73 C ATOM 2386 CD GLU A 156 -4.998 -12.278 -0.513 1.00 1.41 C ATOM 2387 OE1 GLU A 156 -5.791 -12.629 -1.421 1.00 1.92 O ATOM 2388 OE2 GLU A 156 -5.356 -11.610 0.476 1.00 1.98 O ATOM 0 H GLU A 156 -3.947 -9.679 -2.100 1.00 0.32 H new ATOM 0 HA GLU A 156 -1.984 -10.624 -0.140 1.00 0.40 H new ATOM 0 HB2 GLU A 156 -3.341 -11.850 -2.540 1.00 0.61 H new ATOM 0 HB3 GLU A 156 -1.864 -12.540 -1.897 1.00 0.61 H new ATOM 0 HG2 GLU A 156 -3.525 -13.787 -0.851 1.00 0.73 H new ATOM 0 HG3 GLU A 156 -3.085 -12.614 0.375 1.00 0.73 H new ATOM 2395 N PHE A 157 0.016 -9.908 -1.449 1.00 0.41 N ATOM 2396 CA PHE A 157 1.186 -9.583 -2.225 1.00 0.43 C ATOM 2397 C PHE A 157 2.232 -10.675 -2.094 1.00 0.43 C ATOM 2398 O PHE A 157 2.613 -11.093 -0.989 1.00 0.51 O ATOM 2399 CB PHE A 157 1.729 -8.186 -1.904 1.00 0.55 C ATOM 2400 CG PHE A 157 1.776 -7.812 -0.452 1.00 0.88 C ATOM 2401 CD1 PHE A 157 0.611 -7.526 0.242 1.00 1.46 C ATOM 2402 CD2 PHE A 157 2.985 -7.704 0.206 1.00 1.19 C ATOM 2403 CE1 PHE A 157 0.656 -7.151 1.567 1.00 2.17 C ATOM 2404 CE2 PHE A 157 3.036 -7.321 1.526 1.00 1.85 C ATOM 2405 CZ PHE A 157 1.870 -7.046 2.210 1.00 2.32 C ATOM 0 H PHE A 157 0.163 -9.959 -0.441 1.00 0.41 H new ATOM 0 HA PHE A 157 0.895 -9.541 -3.275 1.00 0.43 H new ATOM 0 HB2 PHE A 157 2.737 -8.108 -2.311 1.00 0.55 H new ATOM 0 HB3 PHE A 157 1.117 -7.452 -2.427 1.00 0.55 H new ATOM 0 HD1 PHE A 157 -0.342 -7.598 -0.261 1.00 1.46 H new ATOM 0 HD2 PHE A 157 3.901 -7.923 -0.322 1.00 1.19 H new ATOM 0 HE1 PHE A 157 -0.259 -6.940 2.101 1.00 2.17 H new ATOM 0 HE2 PHE A 157 3.989 -7.236 2.027 1.00 1.85 H new ATOM 0 HZ PHE A 157 1.909 -6.749 3.248 1.00 2.32 H new ATOM 2415 N VAL A 158 2.657 -11.149 -3.254 1.00 0.44 N ATOM 2416 CA VAL A 158 3.474 -12.351 -3.357 1.00 0.48 C ATOM 2417 C VAL A 158 4.910 -12.001 -3.716 1.00 0.48 C ATOM 2418 O VAL A 158 5.161 -11.052 -4.464 1.00 0.47 O ATOM 2419 CB VAL A 158 2.902 -13.322 -4.412 1.00 0.52 C ATOM 2420 CG1 VAL A 158 3.591 -14.678 -4.338 1.00 0.62 C ATOM 2421 CG2 VAL A 158 1.400 -13.472 -4.236 1.00 0.59 C ATOM 0 H VAL A 158 2.446 -10.713 -4.152 1.00 0.44 H new ATOM 0 HA VAL A 158 3.459 -12.840 -2.383 1.00 0.48 H new ATOM 0 HB VAL A 158 3.095 -12.903 -5.399 1.00 0.52 H new ATOM 0 HG11 VAL A 158 3.169 -15.342 -5.092 1.00 0.62 H new ATOM 0 HG12 VAL A 158 4.658 -14.554 -4.520 1.00 0.62 H new ATOM 0 HG13 VAL A 158 3.440 -15.109 -3.349 1.00 0.62 H new ATOM 0 HG21 VAL A 158 1.012 -14.160 -4.988 1.00 0.59 H new ATOM 0 HG22 VAL A 158 1.188 -13.864 -3.241 1.00 0.59 H new ATOM 0 HG23 VAL A 158 0.921 -12.500 -4.353 1.00 0.59 H new ATOM 2431 N LYS A 159 5.843 -12.768 -3.163 1.00 0.58 N ATOM 2432 CA LYS A 159 7.264 -12.521 -3.349 1.00 0.66 C ATOM 2433 C LYS A 159 7.690 -12.781 -4.794 1.00 0.63 C ATOM 2434 O LYS A 159 7.271 -13.762 -5.416 1.00 0.77 O ATOM 2435 CB LYS A 159 8.081 -13.401 -2.391 1.00 0.93 C ATOM 2436 CG LYS A 159 8.047 -14.887 -2.721 1.00 1.36 C ATOM 2437 CD LYS A 159 8.911 -15.692 -1.764 1.00 1.66 C ATOM 2438 CE LYS A 159 9.135 -17.115 -2.261 1.00 1.99 C ATOM 2439 NZ LYS A 159 7.861 -17.859 -2.448 1.00 2.26 N ATOM 0 H LYS A 159 5.634 -13.575 -2.575 1.00 0.58 H new ATOM 0 HA LYS A 159 7.456 -11.471 -3.126 1.00 0.66 H new ATOM 0 HB2 LYS A 159 9.117 -13.063 -2.400 1.00 0.93 H new ATOM 0 HB3 LYS A 159 7.708 -13.257 -1.377 1.00 0.93 H new ATOM 0 HG2 LYS A 159 7.019 -15.247 -2.675 1.00 1.36 H new ATOM 0 HG3 LYS A 159 8.394 -15.042 -3.743 1.00 1.36 H new ATOM 0 HD2 LYS A 159 9.873 -15.196 -1.639 1.00 1.66 H new ATOM 0 HD3 LYS A 159 8.437 -15.720 -0.783 1.00 1.66 H new ATOM 0 HE2 LYS A 159 9.677 -17.085 -3.206 1.00 1.99 H new ATOM 0 HE3 LYS A 159 9.764 -17.650 -1.550 1.00 1.99 H new ATOM 0 HZ1 LYS A 159 8.069 -18.849 -2.688 1.00 2.26 H new ATOM 0 HZ2 LYS A 159 7.307 -17.825 -1.569 1.00 2.26 H new ATOM 0 HZ3 LYS A 159 7.315 -17.424 -3.218 1.00 2.26 H new ATOM 2564 N VAL A 167 8.154 -2.348 1.562 1.00 0.49 N ATOM 2565 CA VAL A 167 7.417 -1.402 2.379 1.00 0.44 C ATOM 2566 C VAL A 167 6.012 -1.307 1.844 1.00 0.38 C ATOM 2567 O VAL A 167 5.834 -1.120 0.638 1.00 0.39 O ATOM 2568 CB VAL A 167 8.060 -0.003 2.335 1.00 0.53 C ATOM 2569 CG1 VAL A 167 7.308 0.976 3.221 1.00 1.15 C ATOM 2570 CG2 VAL A 167 9.520 -0.078 2.734 1.00 1.19 C ATOM 0 HA VAL A 167 7.425 -1.750 3.412 1.00 0.44 H new ATOM 0 HB VAL A 167 8.000 0.364 1.310 1.00 0.53 H new ATOM 0 HG11 VAL A 167 7.785 1.954 3.169 1.00 1.15 H new ATOM 0 HG12 VAL A 167 6.276 1.057 2.879 1.00 1.15 H new ATOM 0 HG13 VAL A 167 7.322 0.620 4.251 1.00 1.15 H new ATOM 0 HG21 VAL A 167 9.959 0.919 2.697 1.00 1.19 H new ATOM 0 HG22 VAL A 167 9.601 -0.473 3.747 1.00 1.19 H new ATOM 0 HG23 VAL A 167 10.052 -0.734 2.045 1.00 1.19 H new ATOM 2580 N CYS A 168 5.020 -1.382 2.725 1.00 0.38 N ATOM 2581 CA CYS A 168 3.644 -1.454 2.260 1.00 0.40 C ATOM 2582 C CYS A 168 2.726 -0.512 3.033 1.00 0.47 C ATOM 2583 O CYS A 168 2.097 -0.898 4.010 1.00 0.94 O ATOM 2584 CB CYS A 168 3.143 -2.890 2.356 1.00 0.48 C ATOM 2585 SG CYS A 168 1.519 -3.161 1.607 1.00 1.36 S ATOM 0 H CYS A 168 5.139 -1.394 3.738 1.00 0.38 H new ATOM 0 HA CYS A 168 3.626 -1.132 1.219 1.00 0.40 H new ATOM 0 HB2 CYS A 168 3.867 -3.548 1.875 1.00 0.48 H new ATOM 0 HB3 CYS A 168 3.099 -3.178 3.406 1.00 0.48 H new ATOM 0 HG CYS A 168 1.303 -4.438 1.490 1.00 1.36 H new ATOM 2591 N ALA A 169 2.646 0.710 2.542 1.00 0.29 N ATOM 2592 CA ALA A 169 1.832 1.781 3.116 1.00 0.28 C ATOM 2593 C ALA A 169 0.357 1.671 2.730 1.00 0.27 C ATOM 2594 O ALA A 169 -0.253 2.675 2.362 1.00 0.28 O ATOM 2595 CB ALA A 169 2.380 3.141 2.739 1.00 0.31 C ATOM 0 H ALA A 169 3.158 1.000 1.709 1.00 0.29 H new ATOM 0 HA ALA A 169 1.888 1.667 4.199 1.00 0.28 H new ATOM 0 HB1 ALA A 169 1.756 3.919 3.179 1.00 0.31 H new ATOM 0 HB2 ALA A 169 3.399 3.239 3.112 1.00 0.31 H new ATOM 0 HB3 ALA A 169 2.380 3.245 1.654 1.00 0.31 H new ATOM 2601 N LEU A 170 -0.138 0.434 2.647 1.00 0.28 N ATOM 2602 CA LEU A 170 -1.540 0.144 2.316 1.00 0.32 C ATOM 2603 C LEU A 170 -2.486 1.188 2.916 1.00 0.32 C ATOM 2604 O LEU A 170 -2.533 1.379 4.125 1.00 0.52 O ATOM 2605 CB LEU A 170 -1.913 -1.247 2.860 1.00 0.48 C ATOM 2606 CG LEU A 170 -3.111 -1.968 2.210 1.00 0.39 C ATOM 2607 CD1 LEU A 170 -4.312 -1.056 2.038 1.00 0.66 C ATOM 2608 CD2 LEU A 170 -2.705 -2.577 0.881 1.00 0.69 C ATOM 0 H LEU A 170 0.424 -0.402 2.808 1.00 0.28 H new ATOM 0 HA LEU A 170 -1.645 0.171 1.231 1.00 0.32 H new ATOM 0 HB2 LEU A 170 -1.039 -1.892 2.763 1.00 0.48 H new ATOM 0 HB3 LEU A 170 -2.118 -1.147 3.926 1.00 0.48 H new ATOM 0 HG LEU A 170 -3.414 -2.765 2.889 1.00 0.39 H new ATOM 0 HD11 LEU A 170 -5.128 -1.612 1.576 1.00 0.66 H new ATOM 0 HD12 LEU A 170 -4.631 -0.686 3.013 1.00 0.66 H new ATOM 0 HD13 LEU A 170 -4.041 -0.214 1.401 1.00 0.66 H new ATOM 0 HD21 LEU A 170 -3.562 -3.082 0.435 1.00 0.69 H new ATOM 0 HD22 LEU A 170 -2.359 -1.790 0.211 1.00 0.69 H new ATOM 0 HD23 LEU A 170 -1.902 -3.297 1.041 1.00 0.69 H new ATOM 2620 N PHE A 171 -3.234 1.862 2.065 1.00 0.27 N ATOM 2621 CA PHE A 171 -4.280 2.751 2.524 1.00 0.27 C ATOM 2622 C PHE A 171 -5.544 2.559 1.688 1.00 0.27 C ATOM 2623 O PHE A 171 -5.570 2.910 0.509 1.00 0.34 O ATOM 2624 CB PHE A 171 -3.784 4.200 2.459 1.00 0.32 C ATOM 2625 CG PHE A 171 -4.869 5.234 2.569 1.00 0.29 C ATOM 2626 CD1 PHE A 171 -5.903 5.061 3.469 1.00 0.33 C ATOM 2627 CD2 PHE A 171 -4.856 6.371 1.779 1.00 0.38 C ATOM 2628 CE1 PHE A 171 -6.902 6.000 3.584 1.00 0.41 C ATOM 2629 CE2 PHE A 171 -5.854 7.313 1.892 1.00 0.48 C ATOM 2630 CZ PHE A 171 -6.858 7.151 2.751 1.00 0.47 C ATOM 0 H PHE A 171 -3.136 1.810 1.051 1.00 0.27 H new ATOM 0 HA PHE A 171 -4.530 2.517 3.559 1.00 0.27 H new ATOM 0 HB2 PHE A 171 -3.063 4.361 3.261 1.00 0.32 H new ATOM 0 HB3 PHE A 171 -3.253 4.347 1.519 1.00 0.32 H new ATOM 0 HD1 PHE A 171 -5.927 4.178 4.090 1.00 0.33 H new ATOM 0 HD2 PHE A 171 -4.057 6.520 1.068 1.00 0.38 H new ATOM 0 HE1 PHE A 171 -7.705 5.865 4.294 1.00 0.41 H new ATOM 0 HE2 PHE A 171 -5.822 8.198 1.274 1.00 0.48 H new ATOM 0 HZ PHE A 171 -7.639 7.894 2.815 1.00 0.47 H new ATOM 2640 N ILE A 172 -6.588 1.980 2.281 1.00 0.23 N ATOM 2641 CA ILE A 172 -7.857 1.878 1.579 1.00 0.23 C ATOM 2642 C ILE A 172 -8.856 2.910 2.118 1.00 0.23 C ATOM 2643 O ILE A 172 -9.201 2.930 3.317 1.00 0.24 O ATOM 2644 CB ILE A 172 -8.492 0.468 1.614 1.00 0.23 C ATOM 2645 CG1 ILE A 172 -9.803 0.491 0.819 1.00 0.26 C ATOM 2646 CG2 ILE A 172 -8.722 -0.015 3.032 1.00 0.21 C ATOM 2647 CD1 ILE A 172 -10.577 -0.807 0.858 1.00 0.30 C ATOM 0 H ILE A 172 -6.579 1.585 3.221 1.00 0.23 H new ATOM 0 HA ILE A 172 -7.627 2.084 0.534 1.00 0.23 H new ATOM 0 HB ILE A 172 -7.799 -0.238 1.156 1.00 0.23 H new ATOM 0 HG12 ILE A 172 -10.436 1.289 1.207 1.00 0.26 H new ATOM 0 HG13 ILE A 172 -9.580 0.737 -0.219 1.00 0.26 H new ATOM 0 HG21 ILE A 172 -9.169 -1.009 3.010 1.00 0.21 H new ATOM 0 HG22 ILE A 172 -7.770 -0.057 3.561 1.00 0.21 H new ATOM 0 HG23 ILE A 172 -9.393 0.673 3.547 1.00 0.21 H new ATOM 0 HD11 ILE A 172 -11.490 -0.704 0.271 1.00 0.30 H new ATOM 0 HD12 ILE A 172 -9.966 -1.608 0.441 1.00 0.30 H new ATOM 0 HD13 ILE A 172 -10.834 -1.046 1.890 1.00 0.30 H new ATOM 2659 N MET A 173 -9.327 3.762 1.227 1.00 0.24 N ATOM 2660 CA MET A 173 -10.275 4.801 1.593 1.00 0.25 C ATOM 2661 C MET A 173 -11.573 4.609 0.817 1.00 0.27 C ATOM 2662 O MET A 173 -11.571 4.036 -0.274 1.00 0.31 O ATOM 2663 CB MET A 173 -9.660 6.184 1.352 1.00 0.28 C ATOM 2664 CG MET A 173 -9.310 6.483 -0.094 1.00 0.33 C ATOM 2665 SD MET A 173 -10.727 7.087 -1.016 1.00 0.99 S ATOM 2666 CE MET A 173 -11.274 8.358 0.117 1.00 0.50 C ATOM 0 H MET A 173 -9.068 3.756 0.240 1.00 0.24 H new ATOM 0 HA MET A 173 -10.509 4.730 2.655 1.00 0.25 H new ATOM 0 HB2 MET A 173 -10.358 6.943 1.706 1.00 0.28 H new ATOM 0 HB3 MET A 173 -8.757 6.274 1.956 1.00 0.28 H new ATOM 0 HG2 MET A 173 -8.512 7.225 -0.128 1.00 0.33 H new ATOM 0 HG3 MET A 173 -8.926 5.580 -0.569 1.00 0.33 H new ATOM 0 HE1 MET A 173 -11.556 9.249 -0.444 1.00 0.50 H new ATOM 0 HE2 MET A 173 -12.134 7.997 0.681 1.00 0.50 H new ATOM 0 HE3 MET A 173 -10.466 8.604 0.806 1.00 0.50 H new ATOM 2676 N LYS A 174 -12.681 5.061 1.385 1.00 0.30 N ATOM 2677 CA LYS A 174 -13.979 4.746 0.866 1.00 0.34 C ATOM 2678 C LYS A 174 -14.595 5.825 -0.026 1.00 0.30 C ATOM 2679 O LYS A 174 -14.493 7.024 0.229 1.00 0.33 O ATOM 2680 CB LYS A 174 -14.906 4.508 2.039 1.00 0.50 C ATOM 2681 CG LYS A 174 -16.331 4.335 1.617 1.00 0.69 C ATOM 2682 CD LYS A 174 -17.277 4.490 2.770 1.00 0.77 C ATOM 2683 CE LYS A 174 -18.659 4.211 2.277 1.00 0.74 C ATOM 2684 NZ LYS A 174 -19.651 4.128 3.376 1.00 1.22 N ATOM 0 H LYS A 174 -12.693 5.653 2.215 1.00 0.30 H new ATOM 0 HA LYS A 174 -13.854 3.868 0.233 1.00 0.34 H new ATOM 0 HB2 LYS A 174 -14.581 3.620 2.581 1.00 0.50 H new ATOM 0 HB3 LYS A 174 -14.835 5.347 2.731 1.00 0.50 H new ATOM 0 HG2 LYS A 174 -16.573 5.068 0.847 1.00 0.69 H new ATOM 0 HG3 LYS A 174 -16.461 3.349 1.171 1.00 0.69 H new ATOM 0 HD2 LYS A 174 -17.014 3.802 3.574 1.00 0.77 H new ATOM 0 HD3 LYS A 174 -17.215 5.498 3.180 1.00 0.77 H new ATOM 0 HE2 LYS A 174 -18.958 4.995 1.581 1.00 0.74 H new ATOM 0 HE3 LYS A 174 -18.660 3.274 1.720 1.00 0.74 H new ATOM 0 HZ1 LYS A 174 -20.611 4.103 2.976 1.00 1.22 H new ATOM 0 HZ2 LYS A 174 -19.484 3.264 3.930 1.00 1.22 H new ATOM 0 HZ3 LYS A 174 -19.555 4.959 3.994 1.00 1.22 H new ATOM 2698 N GLY A 175 -15.217 5.335 -1.079 1.00 0.28 N ATOM 2699 CA GLY A 175 -16.277 6.039 -1.775 1.00 0.28 C ATOM 2700 C GLY A 175 -15.892 6.653 -3.103 1.00 0.28 C ATOM 2701 O GLY A 175 -16.725 6.662 -4.012 1.00 0.31 O ATOM 0 H GLY A 175 -14.998 4.424 -1.482 1.00 0.28 H new ATOM 0 HA2 GLY A 175 -17.101 5.345 -1.941 1.00 0.28 H new ATOM 0 HA3 GLY A 175 -16.652 6.829 -1.125 1.00 0.28 H new ATOM 2705 N THR A 176 -14.625 7.037 -3.279 1.00 0.27 N ATOM 2706 CA THR A 176 -14.214 7.748 -4.494 1.00 0.32 C ATOM 2707 C THR A 176 -12.708 7.929 -4.609 1.00 0.38 C ATOM 2708 O THR A 176 -11.996 7.974 -3.614 1.00 0.44 O ATOM 2709 CB THR A 176 -14.795 9.156 -4.542 1.00 0.43 C ATOM 2710 OG1 THR A 176 -15.208 9.574 -3.233 1.00 0.57 O ATOM 2711 CG2 THR A 176 -15.951 9.262 -5.525 1.00 0.68 C ATOM 0 H THR A 176 -13.876 6.871 -2.607 1.00 0.27 H new ATOM 0 HA THR A 176 -14.583 7.120 -5.305 1.00 0.32 H new ATOM 0 HB THR A 176 -14.007 9.822 -4.894 1.00 0.43 H new ATOM 0 HG1 THR A 176 -15.577 10.480 -3.280 1.00 0.57 H new ATOM 0 HG21 THR A 176 -16.335 10.282 -5.527 1.00 0.68 H new ATOM 0 HG22 THR A 176 -15.603 9.003 -6.525 1.00 0.68 H new ATOM 0 HG23 THR A 176 -16.745 8.576 -5.228 1.00 0.68 H new ATOM 2719 N ALA A 177 -12.247 8.074 -5.852 1.00 0.50 N ATOM 2720 CA ALA A 177 -10.852 8.403 -6.138 1.00 0.65 C ATOM 2721 C ALA A 177 -10.622 9.911 -6.074 1.00 0.68 C ATOM 2722 O ALA A 177 -9.500 10.373 -5.895 1.00 0.86 O ATOM 2723 CB ALA A 177 -10.455 7.868 -7.509 1.00 0.82 C ATOM 0 H ALA A 177 -12.827 7.967 -6.684 1.00 0.50 H new ATOM 0 HA ALA A 177 -10.229 7.931 -5.379 1.00 0.65 H new ATOM 0 HB1 ALA A 177 -9.414 8.120 -7.710 1.00 0.82 H new ATOM 0 HB2 ALA A 177 -10.576 6.785 -7.526 1.00 0.82 H new ATOM 0 HB3 ALA A 177 -11.091 8.316 -8.273 1.00 0.82 H new ATOM 2729 N ASP A 178 -11.698 10.673 -6.218 1.00 0.61 N ATOM 2730 CA ASP A 178 -11.618 12.133 -6.273 1.00 0.68 C ATOM 2731 C ASP A 178 -11.548 12.745 -4.875 1.00 0.67 C ATOM 2732 O ASP A 178 -11.150 13.900 -4.704 1.00 0.79 O ATOM 2733 CB ASP A 178 -12.831 12.680 -7.040 1.00 0.82 C ATOM 2734 CG ASP A 178 -12.964 14.191 -6.965 1.00 1.38 C ATOM 2735 OD1 ASP A 178 -12.107 14.903 -7.529 1.00 1.60 O ATOM 2736 OD2 ASP A 178 -13.942 14.671 -6.355 1.00 2.16 O ATOM 0 H ASP A 178 -12.645 10.304 -6.300 1.00 0.61 H new ATOM 0 HA ASP A 178 -10.701 12.410 -6.793 1.00 0.68 H new ATOM 0 HB2 ASP A 178 -12.755 12.381 -8.086 1.00 0.82 H new ATOM 0 HB3 ASP A 178 -13.738 12.223 -6.643 1.00 0.82 H new