USER MOD reduce.3.24.130724 H: found=0, std=0, add=955, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 956 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 103 ASN : amide:sc= -6.48! C(o=-5.2!,f=-12!) USER MOD Set 1.2: A 107 LYS NZ :NH3+ 149:sc= 1.33 (180deg=-0.0187) USER MOD Set 1.3: A 145 SER OG : rot 180:sc=-0.00982 USER MOD Set 2.1: A 141 GLN : amide:sc= -0.151 X(o=-0.45,f=-0.19) USER MOD Set 2.2: A 147 TYR OH : rot 180:sc= -0.296 USER MOD Set 3.1: A 84 GLN : amide:sc= 0.07 K(o=1.3,f=-9.6!) USER MOD Set 3.2: A 88 LYS NZ :NH3+ -160:sc= 1.21 (180deg=0) USER MOD Set 4.1: A 85 THR OG1 : rot 110:sc= 0.522 USER MOD Set 4.2: A 183 MET CE :methyl -170:sc= -1.58 (180deg=-1.74) USER MOD Set 5.1: A 80 HIS : no HD1:sc= 0.346 K(o=-0.41,f=-11!) USER MOD Set 5.2: A 104 THR OG1 : rot 180:sc= -0.757 USER MOD Single : A 76 GLN : amide:sc= -6.79! C(o=-6.8!,f=-11!) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot -150:sc=-0.00167 USER MOD Single : A 87 THR OG1 : rot -140:sc= -0.137 USER MOD Single : A 90 THR OG1 : rot 140:sc= -1.32! USER MOD Single : A 92 CYS SG : rot 36:sc= 0.0506 USER MOD Single : A 93 SER OG : rot 180:sc= -0.163 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 LYS NZ :NH3+ 159:sc= 1.21 (180deg=0.85) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 112 LYS NZ :NH3+ -172:sc= -0.0134 (180deg=-0.117) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 HIS : no HD1:sc= -2.03 K(o=-2,f=-7.4!) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 ASN : amide:sc= 0.0157 K(o=0.016,f=-8.1!) USER MOD Single : A 125 LYS NZ :NH3+ -169:sc= -0.012 (180deg=-0.148) USER MOD Single : A 128 LYS NZ :NH3+ 171:sc= 0.875 (180deg=0.835) USER MOD Single : A 131 ASN : amide:sc= 0.54 K(o=0.54,f=-0.93) USER MOD Single : A 135 LYS NZ :NH3+ -167:sc= -0.0206 (180deg=-0.183) USER MOD Single : A 139 SER OG : rot -30:sc= 0 USER MOD Single : A 140 ASN : amide:sc= 0.68 K(o=0.68,f=-0.6) USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 THR OG1 : rot 112:sc= 1.13 USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 MET CE :methyl -121:sc= -0.76 (180deg=-3.4!) USER MOD Single : A 156 LYS NZ :NH3+ 168:sc= -0.0185 (180deg=-0.196) USER MOD Single : A 160 TYR OH : rot 8:sc= 1.29 USER MOD Single : A 163 LYS NZ :NH3+ -130:sc= 0.177 (180deg=-0.221) USER MOD Single : A 165 TYR OH : rot 180:sc= -0.206 USER MOD Single : A 166 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.024) USER MOD Single : A 170 TYR OH : rot 180:sc= 0 USER MOD Single : A 173 ASN : amide:sc= -0.074 K(o=-0.074,f=-0.81) USER MOD Single : A 175 SER OG : rot 180:sc= 0 USER MOD Single : A 176 THR OG1 : rot 127:sc= -1.67! USER MOD Single : A 180 SER OG : rot 140:sc= 0.966 USER MOD Single : A 187 LYS NZ :NH3+ -165:sc= -0.0362 (180deg=-0.283) USER MOD Single : A 188 CYS SG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 73 23.151 3.313 -5.198 1.00 3.12 N ATOM 2 CA ARG A 73 23.505 4.282 -4.133 1.00 2.69 C ATOM 3 C ARG A 73 22.663 4.054 -2.882 1.00 2.08 C ATOM 4 O ARG A 73 23.029 4.491 -1.791 1.00 2.31 O ATOM 5 CB ARG A 73 23.304 5.719 -4.627 1.00 3.05 C ATOM 6 CG ARG A 73 21.865 6.043 -4.997 1.00 3.69 C ATOM 7 CD ARG A 73 21.701 7.493 -5.413 1.00 4.24 C ATOM 8 NE ARG A 73 20.322 7.798 -5.787 1.00 4.97 N ATOM 9 CZ ARG A 73 19.882 9.014 -6.100 1.00 5.85 C ATOM 10 NH1 ARG A 73 20.701 10.058 -6.047 1.00 6.18 N ATOM 11 NH2 ARG A 73 18.615 9.186 -6.456 1.00 6.67 N ATOM 0 HA ARG A 73 24.555 4.129 -3.882 1.00 2.69 H new ATOM 0 HB2 ARG A 73 23.635 6.410 -3.852 1.00 3.05 H new ATOM 0 HB3 ARG A 73 23.940 5.887 -5.496 1.00 3.05 H new ATOM 0 HG2 ARG A 73 21.544 5.393 -5.811 1.00 3.69 H new ATOM 0 HG3 ARG A 73 21.216 5.833 -4.147 1.00 3.69 H new ATOM 0 HD2 ARG A 73 22.007 8.143 -4.593 1.00 4.24 H new ATOM 0 HD3 ARG A 73 22.361 7.707 -6.254 1.00 4.24 H new ATOM 0 HE ARG A 73 19.653 7.028 -5.810 1.00 4.97 H new ATOM 0 HH11 ARG A 73 21.673 9.930 -5.765 1.00 6.18 H new ATOM 0 HH12 ARG A 73 20.358 10.988 -6.288 1.00 6.18 H new ATOM 0 HH21 ARG A 73 17.982 8.387 -6.489 1.00 6.67 H new ATOM 0 HH22 ARG A 73 18.275 10.117 -6.696 1.00 6.67 H new ATOM 25 N TRP A 74 21.544 3.363 -3.041 1.00 1.61 N ATOM 26 CA TRP A 74 20.616 3.142 -1.945 1.00 1.14 C ATOM 27 C TRP A 74 19.896 1.811 -2.144 1.00 0.96 C ATOM 28 O TRP A 74 19.068 1.673 -3.039 1.00 1.19 O ATOM 29 CB TRP A 74 19.620 4.307 -1.870 1.00 1.25 C ATOM 30 CG TRP A 74 18.593 4.173 -0.787 1.00 1.15 C ATOM 31 CD1 TRP A 74 17.243 4.151 -0.953 1.00 1.14 C ATOM 32 CD2 TRP A 74 18.829 4.048 0.621 1.00 1.26 C ATOM 33 NE1 TRP A 74 16.619 4.016 0.263 1.00 1.26 N ATOM 34 CE2 TRP A 74 17.572 3.954 1.245 1.00 1.34 C ATOM 35 CE3 TRP A 74 19.977 4.006 1.416 1.00 1.43 C ATOM 36 CZ2 TRP A 74 17.433 3.820 2.623 1.00 1.61 C ATOM 37 CZ3 TRP A 74 19.837 3.872 2.784 1.00 1.66 C ATOM 38 CH2 TRP A 74 18.572 3.781 3.375 1.00 1.75 C ATOM 0 H TRP A 74 21.257 2.944 -3.925 1.00 1.61 H new ATOM 0 HA TRP A 74 21.160 3.098 -1.002 1.00 1.14 H new ATOM 0 HB2 TRP A 74 20.174 5.233 -1.717 1.00 1.25 H new ATOM 0 HB3 TRP A 74 19.110 4.396 -2.829 1.00 1.25 H new ATOM 0 HD1 TRP A 74 16.736 4.228 -1.903 1.00 1.14 H new ATOM 0 HE1 TRP A 74 15.611 3.970 0.411 1.00 1.26 H new ATOM 0 HE3 TRP A 74 20.957 4.077 0.969 1.00 1.43 H new ATOM 0 HZ2 TRP A 74 16.458 3.749 3.082 1.00 1.61 H new ATOM 0 HZ3 TRP A 74 20.718 3.837 3.407 1.00 1.66 H new ATOM 0 HH2 TRP A 74 18.495 3.678 4.447 1.00 1.75 H new ATOM 49 N ASP A 75 20.218 0.838 -1.295 1.00 0.79 N ATOM 50 CA ASP A 75 19.743 -0.538 -1.471 1.00 0.78 C ATOM 51 C ASP A 75 18.226 -0.630 -1.342 1.00 0.67 C ATOM 52 O ASP A 75 17.603 -1.548 -1.860 1.00 0.92 O ATOM 53 CB ASP A 75 20.397 -1.468 -0.435 1.00 0.92 C ATOM 54 CG ASP A 75 21.908 -1.543 -0.569 1.00 1.37 C ATOM 55 OD1 ASP A 75 22.610 -0.679 0.002 1.00 2.01 O ATOM 56 OD2 ASP A 75 22.408 -2.475 -1.233 1.00 1.86 O ATOM 0 H ASP A 75 20.808 0.975 -0.474 1.00 0.79 H new ATOM 0 HA ASP A 75 20.024 -0.851 -2.477 1.00 0.78 H new ATOM 0 HB2 ASP A 75 20.144 -1.120 0.567 1.00 0.92 H new ATOM 0 HB3 ASP A 75 19.979 -2.469 -0.540 1.00 0.92 H new ATOM 61 N GLN A 76 17.644 0.322 -0.637 1.00 0.59 N ATOM 62 CA GLN A 76 16.219 0.304 -0.323 1.00 0.77 C ATOM 63 C GLN A 76 15.403 1.106 -1.333 1.00 0.69 C ATOM 64 O GLN A 76 14.254 1.432 -1.073 1.00 0.94 O ATOM 65 CB GLN A 76 16.004 0.862 1.080 1.00 1.07 C ATOM 66 CG GLN A 76 17.008 0.323 2.086 1.00 1.21 C ATOM 67 CD GLN A 76 16.920 -1.179 2.238 1.00 1.75 C ATOM 68 OE1 GLN A 76 17.920 -1.851 2.456 1.00 2.30 O ATOM 69 NE2 GLN A 76 15.718 -1.711 2.156 1.00 2.36 N ATOM 0 H GLN A 76 18.141 1.131 -0.264 1.00 0.59 H new ATOM 0 HA GLN A 76 15.875 -0.729 -0.372 1.00 0.77 H new ATOM 0 HB2 GLN A 76 16.075 1.949 1.049 1.00 1.07 H new ATOM 0 HB3 GLN A 76 14.995 0.618 1.413 1.00 1.07 H new ATOM 0 HG2 GLN A 76 18.016 0.596 1.772 1.00 1.21 H new ATOM 0 HG3 GLN A 76 16.838 0.794 3.054 1.00 1.21 H new ATOM 0 HE21 GLN A 76 14.909 -1.117 1.973 1.00 2.36 H new ATOM 0 HE22 GLN A 76 15.596 -2.717 2.276 1.00 2.36 H new ATOM 78 N SER A 77 16.009 1.450 -2.452 1.00 0.51 N ATOM 79 CA SER A 77 15.444 2.442 -3.363 1.00 0.56 C ATOM 80 C SER A 77 14.169 1.988 -4.098 1.00 0.43 C ATOM 81 O SER A 77 13.255 2.790 -4.288 1.00 0.54 O ATOM 82 CB SER A 77 16.513 2.847 -4.386 1.00 0.80 C ATOM 83 OG SER A 77 16.089 3.937 -5.186 1.00 1.52 O ATOM 0 H SER A 77 16.899 1.058 -2.759 1.00 0.51 H new ATOM 0 HA SER A 77 15.140 3.286 -2.744 1.00 0.56 H new ATOM 0 HB2 SER A 77 17.432 3.114 -3.865 1.00 0.80 H new ATOM 0 HB3 SER A 77 16.745 1.995 -5.025 1.00 0.80 H new ATOM 0 HG SER A 77 16.795 4.168 -5.825 1.00 1.52 H new ATOM 89 N ASP A 78 14.078 0.721 -4.491 1.00 0.35 N ATOM 90 CA ASP A 78 13.114 0.345 -5.533 1.00 0.38 C ATOM 91 C ASP A 78 12.101 -0.726 -5.131 1.00 0.33 C ATOM 92 O ASP A 78 11.791 -1.610 -5.931 1.00 0.42 O ATOM 93 CB ASP A 78 13.837 -0.076 -6.815 1.00 0.51 C ATOM 94 CG ASP A 78 14.199 1.111 -7.682 1.00 0.94 C ATOM 95 OD1 ASP A 78 15.349 1.586 -7.609 1.00 1.66 O ATOM 96 OD2 ASP A 78 13.326 1.579 -8.446 1.00 1.66 O ATOM 0 H ASP A 78 14.639 -0.046 -4.120 1.00 0.35 H new ATOM 0 HA ASP A 78 12.529 1.249 -5.703 1.00 0.38 H new ATOM 0 HB2 ASP A 78 14.743 -0.625 -6.556 1.00 0.51 H new ATOM 0 HB3 ASP A 78 13.202 -0.758 -7.381 1.00 0.51 H new ATOM 101 N LEU A 79 11.595 -0.671 -3.912 1.00 0.26 N ATOM 102 CA LEU A 79 10.449 -1.509 -3.550 1.00 0.26 C ATOM 103 C LEU A 79 9.175 -0.901 -4.132 1.00 0.30 C ATOM 104 O LEU A 79 8.636 0.066 -3.596 1.00 0.51 O ATOM 105 CB LEU A 79 10.309 -1.656 -2.027 1.00 0.28 C ATOM 106 CG LEU A 79 11.157 -2.752 -1.365 1.00 0.28 C ATOM 107 CD1 LEU A 79 10.828 -4.117 -1.945 1.00 0.29 C ATOM 108 CD2 LEU A 79 12.641 -2.456 -1.500 1.00 0.30 C ATOM 0 H LEU A 79 11.945 -0.071 -3.165 1.00 0.26 H new ATOM 0 HA LEU A 79 10.612 -2.504 -3.963 1.00 0.26 H new ATOM 0 HB2 LEU A 79 10.565 -0.702 -1.567 1.00 0.28 H new ATOM 0 HB3 LEU A 79 9.261 -1.850 -1.798 1.00 0.28 H new ATOM 0 HG LEU A 79 10.912 -2.764 -0.303 1.00 0.28 H new ATOM 0 HD11 LEU A 79 11.442 -4.876 -1.460 1.00 0.29 H new ATOM 0 HD12 LEU A 79 9.774 -4.340 -1.776 1.00 0.29 H new ATOM 0 HD13 LEU A 79 11.032 -4.116 -3.016 1.00 0.29 H new ATOM 0 HD21 LEU A 79 13.215 -3.249 -1.022 1.00 0.30 H new ATOM 0 HD22 LEU A 79 12.907 -2.402 -2.556 1.00 0.30 H new ATOM 0 HD23 LEU A 79 12.867 -1.504 -1.019 1.00 0.30 H new ATOM 120 N HIS A 80 8.699 -1.454 -5.239 1.00 0.21 N ATOM 121 CA HIS A 80 7.556 -0.871 -5.937 1.00 0.25 C ATOM 122 C HIS A 80 6.319 -1.742 -5.814 1.00 0.22 C ATOM 123 O HIS A 80 6.381 -2.958 -5.998 1.00 0.23 O ATOM 124 CB HIS A 80 7.866 -0.651 -7.418 1.00 0.33 C ATOM 125 CG HIS A 80 8.904 0.393 -7.677 1.00 1.03 C ATOM 126 ND1 HIS A 80 8.653 1.747 -7.598 1.00 1.94 N ATOM 127 CD2 HIS A 80 10.207 0.275 -8.019 1.00 1.86 C ATOM 128 CE1 HIS A 80 9.757 2.413 -7.881 1.00 2.58 C ATOM 129 NE2 HIS A 80 10.713 1.543 -8.139 1.00 2.50 N ATOM 0 H HIS A 80 9.080 -2.296 -5.671 1.00 0.21 H new ATOM 0 HA HIS A 80 7.359 0.090 -5.462 1.00 0.25 H new ATOM 0 HB2 HIS A 80 8.198 -1.594 -7.852 1.00 0.33 H new ATOM 0 HB3 HIS A 80 6.947 -0.370 -7.932 1.00 0.33 H new ATOM 0 HD2 HIS A 80 10.748 -0.647 -8.170 1.00 1.86 H new ATOM 0 HE1 HIS A 80 9.860 3.488 -7.898 1.00 2.58 H new ATOM 0 HE2 HIS A 80 11.674 1.776 -8.388 1.00 2.50 H new ATOM 138 N ILE A 81 5.195 -1.101 -5.528 1.00 0.23 N ATOM 139 CA ILE A 81 3.914 -1.778 -5.430 1.00 0.23 C ATOM 140 C ILE A 81 3.487 -2.260 -6.810 1.00 0.26 C ATOM 141 O ILE A 81 2.993 -1.482 -7.626 1.00 0.36 O ATOM 142 CB ILE A 81 2.824 -0.846 -4.859 1.00 0.24 C ATOM 143 CG1 ILE A 81 3.255 -0.279 -3.500 1.00 0.23 C ATOM 144 CG2 ILE A 81 1.506 -1.599 -4.728 1.00 0.28 C ATOM 145 CD1 ILE A 81 2.298 0.753 -2.941 1.00 0.27 C ATOM 0 H ILE A 81 5.147 -0.096 -5.358 1.00 0.23 H new ATOM 0 HA ILE A 81 4.031 -2.624 -4.752 1.00 0.23 H new ATOM 0 HB ILE A 81 2.684 -0.013 -5.548 1.00 0.24 H new ATOM 0 HG12 ILE A 81 3.349 -1.098 -2.787 1.00 0.23 H new ATOM 0 HG13 ILE A 81 4.243 0.171 -3.600 1.00 0.23 H new ATOM 0 HG21 ILE A 81 0.744 -0.932 -4.324 1.00 0.28 H new ATOM 0 HG22 ILE A 81 1.192 -1.957 -5.709 1.00 0.28 H new ATOM 0 HG23 ILE A 81 1.637 -2.448 -4.057 1.00 0.28 H new ATOM 0 HD11 ILE A 81 2.668 1.109 -1.979 1.00 0.27 H new ATOM 0 HD12 ILE A 81 2.222 1.592 -3.633 1.00 0.27 H new ATOM 0 HD13 ILE A 81 1.314 0.303 -2.808 1.00 0.27 H new ATOM 157 N SER A 82 3.699 -3.537 -7.066 1.00 0.25 N ATOM 158 CA SER A 82 3.416 -4.109 -8.369 1.00 0.29 C ATOM 159 C SER A 82 1.998 -4.660 -8.413 1.00 0.33 C ATOM 160 O SER A 82 1.354 -4.668 -9.463 1.00 0.43 O ATOM 161 CB SER A 82 4.435 -5.209 -8.674 1.00 0.32 C ATOM 162 OG SER A 82 5.755 -4.723 -8.493 1.00 1.10 O ATOM 0 H SER A 82 4.068 -4.201 -6.385 1.00 0.25 H new ATOM 0 HA SER A 82 3.496 -3.331 -9.128 1.00 0.29 H new ATOM 0 HB2 SER A 82 4.263 -6.065 -8.021 1.00 0.32 H new ATOM 0 HB3 SER A 82 4.307 -5.559 -9.698 1.00 0.32 H new ATOM 0 HG SER A 82 6.363 -5.194 -9.100 1.00 1.10 H new ATOM 168 N ASP A 83 1.509 -5.098 -7.260 1.00 0.33 N ATOM 169 CA ASP A 83 0.178 -5.679 -7.162 1.00 0.38 C ATOM 170 C ASP A 83 -0.457 -5.287 -5.842 1.00 0.30 C ATOM 171 O ASP A 83 0.225 -4.790 -4.945 1.00 0.27 O ATOM 172 CB ASP A 83 0.228 -7.209 -7.280 1.00 0.46 C ATOM 173 CG ASP A 83 0.715 -7.683 -8.634 1.00 1.27 C ATOM 174 OD1 ASP A 83 1.907 -8.024 -8.757 1.00 2.07 O ATOM 175 OD2 ASP A 83 -0.101 -7.725 -9.582 1.00 1.90 O ATOM 0 H ASP A 83 2.017 -5.061 -6.377 1.00 0.33 H new ATOM 0 HA ASP A 83 -0.422 -5.294 -7.987 1.00 0.38 H new ATOM 0 HB2 ASP A 83 0.883 -7.606 -6.505 1.00 0.46 H new ATOM 0 HB3 ASP A 83 -0.767 -7.615 -7.095 1.00 0.46 H new ATOM 180 N GLN A 84 -1.754 -5.504 -5.724 1.00 0.31 N ATOM 181 CA GLN A 84 -2.483 -5.140 -4.524 1.00 0.35 C ATOM 182 C GLN A 84 -3.769 -5.950 -4.427 1.00 0.34 C ATOM 183 O GLN A 84 -3.966 -6.883 -5.204 1.00 0.39 O ATOM 184 CB GLN A 84 -2.777 -3.627 -4.498 1.00 0.49 C ATOM 185 CG GLN A 84 -3.773 -3.134 -5.550 1.00 0.64 C ATOM 186 CD GLN A 84 -3.359 -3.439 -6.980 1.00 1.32 C ATOM 187 OE1 GLN A 84 -3.742 -4.465 -7.544 1.00 2.14 O ATOM 188 NE2 GLN A 84 -2.557 -2.566 -7.567 1.00 1.98 N ATOM 0 H GLN A 84 -2.327 -5.934 -6.450 1.00 0.31 H new ATOM 0 HA GLN A 84 -1.864 -5.371 -3.657 1.00 0.35 H new ATOM 0 HB2 GLN A 84 -3.158 -3.365 -3.511 1.00 0.49 H new ATOM 0 HB3 GLN A 84 -1.838 -3.089 -4.631 1.00 0.49 H new ATOM 0 HG2 GLN A 84 -4.744 -3.590 -5.358 1.00 0.64 H new ATOM 0 HG3 GLN A 84 -3.899 -2.057 -5.440 1.00 0.64 H new ATOM 0 HE21 GLN A 84 -2.262 -1.728 -7.066 1.00 1.98 H new ATOM 0 HE22 GLN A 84 -2.234 -2.731 -8.520 1.00 1.98 H new ATOM 197 N THR A 85 -4.608 -5.609 -3.455 1.00 0.34 N ATOM 198 CA THR A 85 -5.892 -6.269 -3.232 1.00 0.39 C ATOM 199 C THR A 85 -6.621 -6.607 -4.539 1.00 0.50 C ATOM 200 O THR A 85 -6.782 -5.754 -5.418 1.00 0.54 O ATOM 201 CB THR A 85 -6.793 -5.366 -2.380 1.00 0.32 C ATOM 202 OG1 THR A 85 -6.090 -4.959 -1.197 1.00 0.43 O ATOM 203 CG2 THR A 85 -8.080 -6.076 -1.994 1.00 0.42 C ATOM 0 H THR A 85 -4.415 -4.859 -2.792 1.00 0.34 H new ATOM 0 HA THR A 85 -5.682 -7.207 -2.718 1.00 0.39 H new ATOM 0 HB THR A 85 -7.054 -4.490 -2.973 1.00 0.32 H new ATOM 0 HG1 THR A 85 -5.879 -4.004 -1.254 1.00 0.43 H new ATOM 0 HG21 THR A 85 -8.696 -5.409 -1.391 1.00 0.42 H new ATOM 0 HG22 THR A 85 -8.625 -6.358 -2.895 1.00 0.42 H new ATOM 0 HG23 THR A 85 -7.843 -6.971 -1.419 1.00 0.42 H new ATOM 211 N ASP A 86 -7.066 -7.857 -4.651 1.00 0.69 N ATOM 212 CA ASP A 86 -7.766 -8.321 -5.846 1.00 0.89 C ATOM 213 C ASP A 86 -9.220 -7.859 -5.834 1.00 0.83 C ATOM 214 O ASP A 86 -10.147 -8.644 -5.636 1.00 1.12 O ATOM 215 CB ASP A 86 -7.693 -9.849 -5.963 1.00 1.20 C ATOM 216 CG ASP A 86 -8.364 -10.368 -7.223 1.00 1.67 C ATOM 217 OD1 ASP A 86 -9.398 -11.064 -7.113 1.00 2.32 O ATOM 218 OD2 ASP A 86 -7.870 -10.079 -8.334 1.00 2.23 O ATOM 0 H ASP A 86 -6.954 -8.567 -3.927 1.00 0.69 H new ATOM 0 HA ASP A 86 -7.272 -7.886 -6.715 1.00 0.89 H new ATOM 0 HB2 ASP A 86 -6.649 -10.161 -5.956 1.00 1.20 H new ATOM 0 HB3 ASP A 86 -8.166 -10.300 -5.091 1.00 1.20 H new ATOM 223 N THR A 87 -9.400 -6.564 -5.996 1.00 0.72 N ATOM 224 CA THR A 87 -10.717 -5.976 -6.141 1.00 0.74 C ATOM 225 C THR A 87 -10.761 -5.112 -7.394 1.00 0.81 C ATOM 226 O THR A 87 -11.736 -5.125 -8.145 1.00 1.42 O ATOM 227 CB THR A 87 -11.088 -5.134 -4.908 1.00 1.14 C ATOM 228 OG1 THR A 87 -9.947 -4.376 -4.490 1.00 1.36 O ATOM 229 CG2 THR A 87 -11.569 -6.013 -3.761 1.00 1.87 C ATOM 0 H THR A 87 -8.637 -5.888 -6.031 1.00 0.72 H new ATOM 0 HA THR A 87 -11.444 -6.783 -6.230 1.00 0.74 H new ATOM 0 HB THR A 87 -11.902 -4.463 -5.183 1.00 1.14 H new ATOM 0 HG1 THR A 87 -9.900 -4.369 -3.511 1.00 1.36 H new ATOM 0 HG21 THR A 87 -11.823 -5.388 -2.905 1.00 1.87 H new ATOM 0 HG22 THR A 87 -12.450 -6.572 -4.076 1.00 1.87 H new ATOM 0 HG23 THR A 87 -10.779 -6.709 -3.480 1.00 1.87 H new ATOM 237 N LYS A 88 -9.670 -4.364 -7.598 1.00 1.18 N ATOM 238 CA LYS A 88 -9.415 -3.625 -8.839 1.00 1.58 C ATOM 239 C LYS A 88 -10.491 -2.577 -9.121 1.00 1.51 C ATOM 240 O LYS A 88 -10.620 -2.107 -10.252 1.00 1.95 O ATOM 241 CB LYS A 88 -9.311 -4.595 -10.025 1.00 1.89 C ATOM 242 CG LYS A 88 -8.282 -5.709 -9.848 1.00 2.02 C ATOM 243 CD LYS A 88 -6.856 -5.177 -9.790 1.00 2.39 C ATOM 244 CE LYS A 88 -5.847 -6.315 -9.710 1.00 2.73 C ATOM 245 NZ LYS A 88 -4.443 -5.831 -9.766 1.00 3.20 N ATOM 0 H LYS A 88 -8.934 -4.254 -6.901 1.00 1.18 H new ATOM 0 HA LYS A 88 -8.469 -3.100 -8.710 1.00 1.58 H new ATOM 0 HB2 LYS A 88 -10.289 -5.046 -10.196 1.00 1.89 H new ATOM 0 HB3 LYS A 88 -9.061 -4.027 -10.921 1.00 1.89 H new ATOM 0 HG2 LYS A 88 -8.499 -6.259 -8.932 1.00 2.02 H new ATOM 0 HG3 LYS A 88 -8.370 -6.416 -10.673 1.00 2.02 H new ATOM 0 HD2 LYS A 88 -6.655 -4.571 -10.673 1.00 2.39 H new ATOM 0 HD3 LYS A 88 -6.743 -4.526 -8.923 1.00 2.39 H new ATOM 0 HE2 LYS A 88 -6.001 -6.869 -8.784 1.00 2.73 H new ATOM 0 HE3 LYS A 88 -6.022 -7.011 -10.531 1.00 2.73 H new ATOM 0 HZ1 LYS A 88 -3.817 -6.613 -10.047 1.00 3.20 H new ATOM 0 HZ2 LYS A 88 -4.369 -5.061 -10.461 1.00 3.20 H new ATOM 0 HZ3 LYS A 88 -4.159 -5.480 -8.829 1.00 3.20 H new ATOM 259 N GLY A 89 -11.242 -2.205 -8.093 1.00 1.22 N ATOM 260 CA GLY A 89 -12.310 -1.239 -8.259 1.00 1.14 C ATOM 261 C GLY A 89 -13.333 -1.329 -7.144 1.00 0.96 C ATOM 262 O GLY A 89 -12.967 -1.432 -5.971 1.00 1.01 O ATOM 0 H GLY A 89 -11.130 -2.557 -7.142 1.00 1.22 H new ATOM 0 HA2 GLY A 89 -11.889 -0.234 -8.285 1.00 1.14 H new ATOM 0 HA3 GLY A 89 -12.802 -1.404 -9.217 1.00 1.14 H new ATOM 266 N THR A 90 -14.612 -1.308 -7.502 1.00 0.97 N ATOM 267 CA THR A 90 -15.681 -1.369 -6.517 1.00 0.88 C ATOM 268 C THR A 90 -16.225 -2.788 -6.386 1.00 0.82 C ATOM 269 O THR A 90 -16.887 -3.300 -7.290 1.00 1.04 O ATOM 270 CB THR A 90 -16.837 -0.411 -6.875 1.00 1.06 C ATOM 271 OG1 THR A 90 -16.337 0.927 -7.013 1.00 1.25 O ATOM 272 CG2 THR A 90 -17.921 -0.441 -5.804 1.00 1.02 C ATOM 0 H THR A 90 -14.932 -1.249 -8.469 1.00 0.97 H new ATOM 0 HA THR A 90 -15.252 -1.059 -5.564 1.00 0.88 H new ATOM 0 HB THR A 90 -17.272 -0.740 -7.819 1.00 1.06 H new ATOM 0 HG1 THR A 90 -16.776 1.363 -7.773 1.00 1.25 H new ATOM 0 HG21 THR A 90 -18.724 0.242 -6.080 1.00 1.02 H new ATOM 0 HG22 THR A 90 -18.319 -1.452 -5.717 1.00 1.02 H new ATOM 0 HG23 THR A 90 -17.496 -0.135 -4.848 1.00 1.02 H new ATOM 280 N VAL A 91 -15.922 -3.422 -5.266 1.00 0.65 N ATOM 281 CA VAL A 91 -16.418 -4.755 -4.966 1.00 0.77 C ATOM 282 C VAL A 91 -17.040 -4.745 -3.580 1.00 0.55 C ATOM 283 O VAL A 91 -16.585 -4.002 -2.708 1.00 0.46 O ATOM 284 CB VAL A 91 -15.277 -5.799 -5.010 1.00 1.02 C ATOM 285 CG1 VAL A 91 -15.796 -7.198 -4.715 1.00 1.43 C ATOM 286 CG2 VAL A 91 -14.570 -5.769 -6.355 1.00 1.51 C ATOM 0 H VAL A 91 -15.325 -3.027 -4.539 1.00 0.65 H new ATOM 0 HA VAL A 91 -17.159 -5.031 -5.716 1.00 0.77 H new ATOM 0 HB VAL A 91 -14.558 -5.535 -4.234 1.00 1.02 H new ATOM 0 HG11 VAL A 91 -14.970 -7.908 -4.754 1.00 1.43 H new ATOM 0 HG12 VAL A 91 -16.245 -7.218 -3.722 1.00 1.43 H new ATOM 0 HG13 VAL A 91 -16.545 -7.472 -5.458 1.00 1.43 H new ATOM 0 HG21 VAL A 91 -13.772 -6.511 -6.363 1.00 1.51 H new ATOM 0 HG22 VAL A 91 -15.284 -5.996 -7.147 1.00 1.51 H new ATOM 0 HG23 VAL A 91 -14.146 -4.779 -6.521 1.00 1.51 H new ATOM 296 N CYS A 92 -18.072 -5.542 -3.356 1.00 0.79 N ATOM 297 CA CYS A 92 -18.615 -5.636 -2.021 1.00 0.64 C ATOM 298 C CYS A 92 -17.980 -6.815 -1.308 1.00 0.62 C ATOM 299 O CYS A 92 -18.159 -7.972 -1.699 1.00 1.20 O ATOM 300 CB CYS A 92 -20.136 -5.796 -2.079 1.00 1.10 C ATOM 301 SG CYS A 92 -20.700 -7.175 -3.103 1.00 1.91 S ATOM 0 H CYS A 92 -18.536 -6.115 -4.061 1.00 0.79 H new ATOM 0 HA CYS A 92 -18.392 -4.722 -1.470 1.00 0.64 H new ATOM 0 HB2 CYS A 92 -20.514 -5.932 -1.066 1.00 1.10 H new ATOM 0 HB3 CYS A 92 -20.573 -4.873 -2.461 1.00 1.10 H new ATOM 0 HG CYS A 92 -19.872 -8.170 -2.985 1.00 1.91 H new ATOM 307 N SER A 93 -17.226 -6.517 -0.266 1.00 0.69 N ATOM 308 CA SER A 93 -16.524 -7.542 0.481 1.00 1.02 C ATOM 309 C SER A 93 -16.207 -7.079 1.895 1.00 0.58 C ATOM 310 O SER A 93 -15.819 -5.929 2.098 1.00 0.73 O ATOM 311 CB SER A 93 -15.219 -7.917 -0.229 1.00 1.83 C ATOM 312 OG SER A 93 -15.459 -8.401 -1.542 1.00 2.58 O ATOM 0 H SER A 93 -17.084 -5.569 0.083 1.00 0.69 H new ATOM 0 HA SER A 93 -17.178 -8.412 0.537 1.00 1.02 H new ATOM 0 HB2 SER A 93 -14.566 -7.046 -0.276 1.00 1.83 H new ATOM 0 HB3 SER A 93 -14.695 -8.678 0.350 1.00 1.83 H new ATOM 0 HG SER A 93 -14.606 -8.629 -1.967 1.00 2.58 H new ATOM 318 N PRO A 94 -16.392 -7.944 2.891 1.00 0.78 N ATOM 319 CA PRO A 94 -15.673 -7.828 4.143 1.00 0.67 C ATOM 320 C PRO A 94 -14.341 -8.551 3.990 1.00 0.53 C ATOM 321 O PRO A 94 -14.296 -9.782 3.986 1.00 0.59 O ATOM 322 CB PRO A 94 -16.572 -8.551 5.156 1.00 0.93 C ATOM 323 CG PRO A 94 -17.704 -9.150 4.367 1.00 1.39 C ATOM 324 CD PRO A 94 -17.330 -9.062 2.910 1.00 1.43 C ATOM 0 HA PRO A 94 -15.465 -6.802 4.448 1.00 0.67 H new ATOM 0 HB2 PRO A 94 -16.016 -9.324 5.686 1.00 0.93 H new ATOM 0 HB3 PRO A 94 -16.947 -7.856 5.908 1.00 0.93 H new ATOM 0 HG2 PRO A 94 -17.870 -10.187 4.659 1.00 1.39 H new ATOM 0 HG3 PRO A 94 -18.633 -8.612 4.559 1.00 1.39 H new ATOM 0 HD2 PRO A 94 -16.870 -9.983 2.553 1.00 1.43 H new ATOM 0 HD3 PRO A 94 -18.199 -8.874 2.279 1.00 1.43 H new ATOM 332 N PHE A 95 -13.260 -7.803 3.864 1.00 0.43 N ATOM 333 CA PHE A 95 -12.016 -8.389 3.395 1.00 0.40 C ATOM 334 C PHE A 95 -10.812 -7.590 3.877 1.00 0.33 C ATOM 335 O PHE A 95 -10.913 -6.386 4.132 1.00 0.32 O ATOM 336 CB PHE A 95 -12.065 -8.433 1.858 1.00 0.46 C ATOM 337 CG PHE A 95 -10.993 -9.262 1.198 1.00 0.50 C ATOM 338 CD1 PHE A 95 -10.104 -8.684 0.305 1.00 1.26 C ATOM 339 CD2 PHE A 95 -10.885 -10.620 1.459 1.00 1.35 C ATOM 340 CE1 PHE A 95 -9.130 -9.444 -0.314 1.00 1.33 C ATOM 341 CE2 PHE A 95 -9.910 -11.380 0.844 1.00 1.36 C ATOM 342 CZ PHE A 95 -9.031 -10.792 -0.041 1.00 0.68 C ATOM 0 H PHE A 95 -13.216 -6.806 4.075 1.00 0.43 H new ATOM 0 HA PHE A 95 -11.907 -9.396 3.798 1.00 0.40 H new ATOM 0 HB2 PHE A 95 -13.038 -8.820 1.554 1.00 0.46 H new ATOM 0 HB3 PHE A 95 -11.995 -7.413 1.480 1.00 0.46 H new ATOM 0 HD1 PHE A 95 -10.173 -7.628 0.091 1.00 1.26 H new ATOM 0 HD2 PHE A 95 -11.570 -11.088 2.150 1.00 1.35 H new ATOM 0 HE1 PHE A 95 -8.447 -8.982 -1.011 1.00 1.33 H new ATOM 0 HE2 PHE A 95 -9.836 -12.436 1.056 1.00 1.36 H new ATOM 0 HZ PHE A 95 -8.266 -11.386 -0.519 1.00 0.68 H new ATOM 352 N ALA A 96 -9.690 -8.278 4.033 1.00 0.37 N ATOM 353 CA ALA A 96 -8.437 -7.642 4.395 1.00 0.38 C ATOM 354 C ALA A 96 -7.706 -7.203 3.137 1.00 0.35 C ATOM 355 O ALA A 96 -7.799 -7.852 2.098 1.00 0.51 O ATOM 356 CB ALA A 96 -7.575 -8.591 5.212 1.00 0.49 C ATOM 0 H ALA A 96 -9.625 -9.289 3.912 1.00 0.37 H new ATOM 0 HA ALA A 96 -8.646 -6.765 5.007 1.00 0.38 H new ATOM 0 HB1 ALA A 96 -6.639 -8.098 5.475 1.00 0.49 H new ATOM 0 HB2 ALA A 96 -8.105 -8.872 6.122 1.00 0.49 H new ATOM 0 HB3 ALA A 96 -7.362 -9.485 4.626 1.00 0.49 H new ATOM 362 N LEU A 97 -6.982 -6.111 3.234 1.00 0.24 N ATOM 363 CA LEU A 97 -6.352 -5.516 2.071 1.00 0.22 C ATOM 364 C LEU A 97 -4.861 -5.803 2.069 1.00 0.22 C ATOM 365 O LEU A 97 -4.238 -5.904 3.127 1.00 0.24 O ATOM 366 CB LEU A 97 -6.611 -4.010 2.057 1.00 0.23 C ATOM 367 CG LEU A 97 -8.090 -3.616 2.060 1.00 0.46 C ATOM 368 CD1 LEU A 97 -8.242 -2.111 2.114 1.00 1.40 C ATOM 369 CD2 LEU A 97 -8.794 -4.176 0.836 1.00 1.07 C ATOM 0 H LEU A 97 -6.813 -5.613 4.108 1.00 0.24 H new ATOM 0 HA LEU A 97 -6.782 -5.955 1.171 1.00 0.22 H new ATOM 0 HB2 LEU A 97 -6.128 -3.564 2.927 1.00 0.23 H new ATOM 0 HB3 LEU A 97 -6.137 -3.582 1.174 1.00 0.23 H new ATOM 0 HG LEU A 97 -8.554 -4.041 2.950 1.00 0.46 H new ATOM 0 HD11 LEU A 97 -9.301 -1.852 2.115 1.00 1.40 H new ATOM 0 HD12 LEU A 97 -7.774 -1.730 3.022 1.00 1.40 H new ATOM 0 HD13 LEU A 97 -7.761 -1.665 1.244 1.00 1.40 H new ATOM 0 HD21 LEU A 97 -9.844 -3.885 0.856 1.00 1.07 H new ATOM 0 HD22 LEU A 97 -8.325 -3.782 -0.066 1.00 1.07 H new ATOM 0 HD23 LEU A 97 -8.718 -5.263 0.838 1.00 1.07 H new ATOM 381 N PHE A 98 -4.289 -5.932 0.883 1.00 0.23 N ATOM 382 CA PHE A 98 -2.880 -6.246 0.761 1.00 0.23 C ATOM 383 C PHE A 98 -2.247 -5.501 -0.403 1.00 0.22 C ATOM 384 O PHE A 98 -2.934 -5.046 -1.317 1.00 0.25 O ATOM 385 CB PHE A 98 -2.677 -7.761 0.605 1.00 0.24 C ATOM 386 CG PHE A 98 -3.473 -8.388 -0.507 1.00 0.26 C ATOM 387 CD1 PHE A 98 -2.950 -8.494 -1.788 1.00 1.26 C ATOM 388 CD2 PHE A 98 -4.745 -8.886 -0.265 1.00 1.18 C ATOM 389 CE1 PHE A 98 -3.681 -9.081 -2.803 1.00 1.31 C ATOM 390 CE2 PHE A 98 -5.479 -9.472 -1.277 1.00 1.17 C ATOM 391 CZ PHE A 98 -4.947 -9.570 -2.546 1.00 0.40 C ATOM 0 H PHE A 98 -4.779 -5.824 -0.005 1.00 0.23 H new ATOM 0 HA PHE A 98 -2.385 -5.920 1.676 1.00 0.23 H new ATOM 0 HB2 PHE A 98 -1.619 -7.957 0.432 1.00 0.24 H new ATOM 0 HB3 PHE A 98 -2.942 -8.248 1.543 1.00 0.24 H new ATOM 0 HD1 PHE A 98 -1.960 -8.113 -1.994 1.00 1.26 H new ATOM 0 HD2 PHE A 98 -5.166 -8.814 0.727 1.00 1.18 H new ATOM 0 HE1 PHE A 98 -3.263 -9.157 -3.796 1.00 1.31 H new ATOM 0 HE2 PHE A 98 -6.469 -9.853 -1.075 1.00 1.17 H new ATOM 0 HZ PHE A 98 -5.520 -10.029 -3.338 1.00 0.40 H new ATOM 401 N ALA A 99 -0.937 -5.363 -0.337 1.00 0.20 N ATOM 402 CA ALA A 99 -0.163 -4.764 -1.406 1.00 0.19 C ATOM 403 C ALA A 99 1.153 -5.504 -1.554 1.00 0.17 C ATOM 404 O ALA A 99 1.763 -5.904 -0.563 1.00 0.19 O ATOM 405 CB ALA A 99 0.080 -3.287 -1.144 1.00 0.21 C ATOM 0 H ALA A 99 -0.378 -5.664 0.462 1.00 0.20 H new ATOM 0 HA ALA A 99 -0.727 -4.845 -2.335 1.00 0.19 H new ATOM 0 HB1 ALA A 99 0.663 -2.863 -1.962 1.00 0.21 H new ATOM 0 HB2 ALA A 99 -0.876 -2.768 -1.073 1.00 0.21 H new ATOM 0 HB3 ALA A 99 0.628 -3.169 -0.209 1.00 0.21 H new ATOM 411 N VAL A 100 1.572 -5.708 -2.784 1.00 0.17 N ATOM 412 CA VAL A 100 2.791 -6.440 -3.059 1.00 0.18 C ATOM 413 C VAL A 100 3.846 -5.522 -3.663 1.00 0.19 C ATOM 414 O VAL A 100 3.637 -4.933 -4.725 1.00 0.22 O ATOM 415 CB VAL A 100 2.527 -7.615 -4.017 1.00 0.23 C ATOM 416 CG1 VAL A 100 3.796 -8.415 -4.247 1.00 0.26 C ATOM 417 CG2 VAL A 100 1.419 -8.510 -3.479 1.00 0.25 C ATOM 0 H VAL A 100 1.083 -5.375 -3.615 1.00 0.17 H new ATOM 0 HA VAL A 100 3.158 -6.834 -2.111 1.00 0.18 H new ATOM 0 HB VAL A 100 2.202 -7.207 -4.974 1.00 0.23 H new ATOM 0 HG11 VAL A 100 3.587 -9.241 -4.927 1.00 0.26 H new ATOM 0 HG12 VAL A 100 4.559 -7.770 -4.683 1.00 0.26 H new ATOM 0 HG13 VAL A 100 4.155 -8.810 -3.296 1.00 0.26 H new ATOM 0 HG21 VAL A 100 1.249 -9.334 -4.172 1.00 0.25 H new ATOM 0 HG22 VAL A 100 1.712 -8.907 -2.507 1.00 0.25 H new ATOM 0 HG23 VAL A 100 0.502 -7.930 -3.373 1.00 0.25 H new ATOM 427 N LEU A 101 4.973 -5.409 -2.982 1.00 0.19 N ATOM 428 CA LEU A 101 6.067 -4.577 -3.443 1.00 0.19 C ATOM 429 C LEU A 101 7.212 -5.445 -3.932 1.00 0.21 C ATOM 430 O LEU A 101 7.751 -6.266 -3.190 1.00 0.23 O ATOM 431 CB LEU A 101 6.570 -3.633 -2.345 1.00 0.19 C ATOM 432 CG LEU A 101 5.606 -2.512 -1.940 1.00 0.22 C ATOM 433 CD1 LEU A 101 4.536 -3.027 -0.990 1.00 0.30 C ATOM 434 CD2 LEU A 101 6.372 -1.352 -1.320 1.00 0.21 C ATOM 0 H LEU A 101 5.154 -5.888 -2.100 1.00 0.19 H new ATOM 0 HA LEU A 101 5.689 -3.967 -4.263 1.00 0.19 H new ATOM 0 HB2 LEU A 101 6.802 -4.226 -1.460 1.00 0.19 H new ATOM 0 HB3 LEU A 101 7.504 -3.181 -2.679 1.00 0.19 H new ATOM 0 HG LEU A 101 5.105 -2.152 -2.838 1.00 0.22 H new ATOM 0 HD11 LEU A 101 3.866 -2.211 -0.719 1.00 0.30 H new ATOM 0 HD12 LEU A 101 3.966 -3.817 -1.478 1.00 0.30 H new ATOM 0 HD13 LEU A 101 5.008 -3.423 -0.091 1.00 0.30 H new ATOM 0 HD21 LEU A 101 5.674 -0.564 -1.038 1.00 0.21 H new ATOM 0 HD22 LEU A 101 6.904 -1.699 -0.435 1.00 0.21 H new ATOM 0 HD23 LEU A 101 7.088 -0.961 -2.043 1.00 0.21 H new ATOM 446 N GLU A 102 7.574 -5.261 -5.182 1.00 0.24 N ATOM 447 CA GLU A 102 8.644 -6.023 -5.789 1.00 0.29 C ATOM 448 C GLU A 102 9.950 -5.247 -5.708 1.00 0.28 C ATOM 449 O GLU A 102 9.974 -4.039 -5.946 1.00 0.26 O ATOM 450 CB GLU A 102 8.304 -6.324 -7.250 1.00 0.34 C ATOM 451 CG GLU A 102 9.390 -7.088 -7.984 1.00 0.41 C ATOM 452 CD GLU A 102 9.030 -7.386 -9.419 1.00 0.53 C ATOM 453 OE1 GLU A 102 9.265 -6.524 -10.290 1.00 1.32 O ATOM 454 OE2 GLU A 102 8.530 -8.492 -9.691 1.00 0.95 O ATOM 0 H GLU A 102 7.137 -4.582 -5.805 1.00 0.24 H new ATOM 0 HA GLU A 102 8.759 -6.963 -5.249 1.00 0.29 H new ATOM 0 HB2 GLU A 102 7.379 -6.899 -7.287 1.00 0.34 H new ATOM 0 HB3 GLU A 102 8.117 -5.385 -7.771 1.00 0.34 H new ATOM 0 HG2 GLU A 102 10.314 -6.510 -7.959 1.00 0.41 H new ATOM 0 HG3 GLU A 102 9.585 -8.024 -7.461 1.00 0.41 H new ATOM 461 N ASN A 103 11.026 -5.932 -5.349 1.00 0.38 N ATOM 462 CA ASN A 103 12.341 -5.318 -5.383 1.00 0.44 C ATOM 463 C ASN A 103 12.975 -5.551 -6.744 1.00 0.37 C ATOM 464 O ASN A 103 13.386 -6.661 -7.079 1.00 0.51 O ATOM 465 CB ASN A 103 13.259 -5.823 -4.252 1.00 0.68 C ATOM 466 CG ASN A 103 13.326 -7.333 -4.120 1.00 0.87 C ATOM 467 OD1 ASN A 103 14.130 -8.000 -4.770 1.00 1.76 O ATOM 468 ND2 ASN A 103 12.503 -7.882 -3.242 1.00 1.64 N ATOM 0 H ASN A 103 11.014 -6.902 -5.034 1.00 0.38 H new ATOM 0 HA ASN A 103 12.214 -4.248 -5.219 1.00 0.44 H new ATOM 0 HB2 ASN A 103 14.266 -5.441 -4.421 1.00 0.68 H new ATOM 0 HB3 ASN A 103 12.914 -5.404 -3.307 1.00 0.68 H new ATOM 0 HD21 ASN A 103 12.522 -8.890 -3.086 1.00 1.64 H new ATOM 0 HD22 ASN A 103 11.849 -7.298 -2.721 1.00 1.64 H new ATOM 475 N THR A 104 13.020 -4.501 -7.541 1.00 0.34 N ATOM 476 CA THR A 104 13.567 -4.579 -8.884 1.00 0.38 C ATOM 477 C THR A 104 15.089 -4.445 -8.874 1.00 0.50 C ATOM 478 O THR A 104 15.672 -3.738 -9.697 1.00 0.70 O ATOM 479 CB THR A 104 12.946 -3.490 -9.778 1.00 0.55 C ATOM 480 OG1 THR A 104 12.980 -2.226 -9.102 1.00 0.77 O ATOM 481 CG2 THR A 104 11.510 -3.841 -10.126 1.00 0.73 C ATOM 0 H THR A 104 12.681 -3.575 -7.279 1.00 0.34 H new ATOM 0 HA THR A 104 13.317 -5.560 -9.289 1.00 0.38 H new ATOM 0 HB THR A 104 13.526 -3.426 -10.699 1.00 0.55 H new ATOM 0 HG1 THR A 104 12.585 -1.537 -9.676 1.00 0.77 H new ATOM 0 HG21 THR A 104 11.088 -3.060 -10.758 1.00 0.73 H new ATOM 0 HG22 THR A 104 11.487 -4.792 -10.659 1.00 0.73 H new ATOM 0 HG23 THR A 104 10.924 -3.924 -9.211 1.00 0.73 H new ATOM 489 N GLY A 105 15.725 -5.139 -7.938 1.00 0.52 N ATOM 490 CA GLY A 105 17.169 -5.082 -7.813 1.00 0.72 C ATOM 491 C GLY A 105 17.586 -4.531 -6.470 1.00 0.66 C ATOM 492 O GLY A 105 18.553 -4.993 -5.860 1.00 0.80 O ATOM 0 H GLY A 105 15.263 -5.744 -7.259 1.00 0.52 H new ATOM 0 HA2 GLY A 105 17.586 -6.080 -7.944 1.00 0.72 H new ATOM 0 HA3 GLY A 105 17.580 -4.458 -8.607 1.00 0.72 H new ATOM 496 N GLU A 106 16.836 -3.550 -6.006 1.00 0.60 N ATOM 497 CA GLU A 106 17.087 -2.926 -4.721 1.00 0.56 C ATOM 498 C GLU A 106 16.303 -3.673 -3.644 1.00 0.65 C ATOM 499 O GLU A 106 15.175 -3.306 -3.313 1.00 1.05 O ATOM 500 CB GLU A 106 16.672 -1.452 -4.769 1.00 0.68 C ATOM 501 CG GLU A 106 17.213 -0.692 -5.979 1.00 1.25 C ATOM 502 CD GLU A 106 18.707 -0.442 -5.923 1.00 1.91 C ATOM 503 OE1 GLU A 106 19.487 -1.406 -6.058 1.00 2.54 O ATOM 504 OE2 GLU A 106 19.112 0.732 -5.781 1.00 2.47 O ATOM 0 H GLU A 106 16.037 -3.164 -6.508 1.00 0.60 H new ATOM 0 HA GLU A 106 18.150 -2.973 -4.485 1.00 0.56 H new ATOM 0 HB2 GLU A 106 15.584 -1.392 -4.772 1.00 0.68 H new ATOM 0 HB3 GLU A 106 17.016 -0.959 -3.860 1.00 0.68 H new ATOM 0 HG2 GLU A 106 16.981 -1.254 -6.884 1.00 1.25 H new ATOM 0 HG3 GLU A 106 16.696 0.264 -6.057 1.00 1.25 H new ATOM 511 N LYS A 107 16.898 -4.741 -3.131 1.00 0.61 N ATOM 512 CA LYS A 107 16.237 -5.622 -2.176 1.00 0.69 C ATOM 513 C LYS A 107 16.210 -5.024 -0.770 1.00 0.66 C ATOM 514 O LYS A 107 17.059 -4.209 -0.406 1.00 0.76 O ATOM 515 CB LYS A 107 16.940 -6.981 -2.153 1.00 0.86 C ATOM 516 CG LYS A 107 16.873 -7.716 -3.479 1.00 1.37 C ATOM 517 CD LYS A 107 17.524 -9.084 -3.402 1.00 1.80 C ATOM 518 CE LYS A 107 17.480 -9.798 -4.745 1.00 2.66 C ATOM 519 NZ LYS A 107 16.089 -10.115 -5.172 1.00 3.32 N ATOM 0 H LYS A 107 17.851 -5.021 -3.364 1.00 0.61 H new ATOM 0 HA LYS A 107 15.203 -5.746 -2.499 1.00 0.69 H new ATOM 0 HB2 LYS A 107 17.985 -6.837 -1.878 1.00 0.86 H new ATOM 0 HB3 LYS A 107 16.490 -7.602 -1.379 1.00 0.86 H new ATOM 0 HG2 LYS A 107 15.831 -7.826 -3.781 1.00 1.37 H new ATOM 0 HG3 LYS A 107 17.366 -7.122 -4.248 1.00 1.37 H new ATOM 0 HD2 LYS A 107 18.560 -8.978 -3.079 1.00 1.80 H new ATOM 0 HD3 LYS A 107 17.016 -9.688 -2.650 1.00 1.80 H new ATOM 0 HE2 LYS A 107 17.956 -9.174 -5.501 1.00 2.66 H new ATOM 0 HE3 LYS A 107 18.058 -10.720 -4.683 1.00 2.66 H new ATOM 0 HZ1 LYS A 107 16.032 -10.096 -6.210 1.00 3.32 H new ATOM 0 HZ2 LYS A 107 15.827 -11.061 -4.828 1.00 3.32 H new ATOM 0 HZ3 LYS A 107 15.435 -9.410 -4.776 1.00 3.32 H new ATOM 533 N LEU A 108 15.227 -5.454 0.014 1.00 0.59 N ATOM 534 CA LEU A 108 15.055 -4.981 1.381 1.00 0.57 C ATOM 535 C LEU A 108 16.120 -5.623 2.273 1.00 0.63 C ATOM 536 O LEU A 108 15.964 -6.761 2.723 1.00 0.74 O ATOM 537 CB LEU A 108 13.644 -5.342 1.877 1.00 0.60 C ATOM 538 CG LEU A 108 13.052 -4.473 3.000 1.00 0.58 C ATOM 539 CD1 LEU A 108 13.929 -4.476 4.243 1.00 0.61 C ATOM 540 CD2 LEU A 108 12.827 -3.055 2.509 1.00 0.56 C ATOM 0 H LEU A 108 14.530 -6.138 -0.280 1.00 0.59 H new ATOM 0 HA LEU A 108 15.169 -3.898 1.418 1.00 0.57 H new ATOM 0 HB2 LEU A 108 12.965 -5.302 1.025 1.00 0.60 H new ATOM 0 HB3 LEU A 108 13.661 -6.376 2.223 1.00 0.60 H new ATOM 0 HG LEU A 108 12.092 -4.907 3.279 1.00 0.58 H new ATOM 0 HD11 LEU A 108 13.474 -3.850 5.011 1.00 0.61 H new ATOM 0 HD12 LEU A 108 14.027 -5.495 4.617 1.00 0.61 H new ATOM 0 HD13 LEU A 108 14.915 -4.085 3.993 1.00 0.61 H new ATOM 0 HD21 LEU A 108 12.408 -2.453 3.315 1.00 0.56 H new ATOM 0 HD22 LEU A 108 13.777 -2.625 2.191 1.00 0.56 H new ATOM 0 HD23 LEU A 108 12.134 -3.067 1.667 1.00 0.56 H new ATOM 552 N LYS A 109 17.199 -4.893 2.519 1.00 0.62 N ATOM 553 CA LYS A 109 18.328 -5.441 3.255 1.00 0.73 C ATOM 554 C LYS A 109 18.596 -4.682 4.556 1.00 0.75 C ATOM 555 O LYS A 109 18.801 -5.289 5.604 1.00 1.15 O ATOM 556 CB LYS A 109 19.570 -5.401 2.361 1.00 0.92 C ATOM 557 CG LYS A 109 20.817 -5.994 2.990 1.00 1.17 C ATOM 558 CD LYS A 109 21.999 -5.887 2.043 1.00 1.66 C ATOM 559 CE LYS A 109 23.264 -6.477 2.641 1.00 2.07 C ATOM 560 NZ LYS A 109 24.411 -6.382 1.700 1.00 2.72 N ATOM 0 H LYS A 109 17.316 -3.924 2.221 1.00 0.62 H new ATOM 0 HA LYS A 109 18.087 -6.468 3.529 1.00 0.73 H new ATOM 0 HB2 LYS A 109 19.354 -5.937 1.437 1.00 0.92 H new ATOM 0 HB3 LYS A 109 19.773 -4.365 2.089 1.00 0.92 H new ATOM 0 HG2 LYS A 109 21.043 -5.475 3.921 1.00 1.17 H new ATOM 0 HG3 LYS A 109 20.641 -7.040 3.243 1.00 1.17 H new ATOM 0 HD2 LYS A 109 21.764 -6.402 1.111 1.00 1.66 H new ATOM 0 HD3 LYS A 109 22.170 -4.840 1.794 1.00 1.66 H new ATOM 0 HE2 LYS A 109 23.508 -5.955 3.566 1.00 2.07 H new ATOM 0 HE3 LYS A 109 23.091 -7.521 2.901 1.00 2.07 H new ATOM 0 HZ1 LYS A 109 25.257 -6.794 2.142 1.00 2.72 H new ATOM 0 HZ2 LYS A 109 24.188 -6.902 0.827 1.00 2.72 H new ATOM 0 HZ3 LYS A 109 24.591 -5.383 1.472 1.00 2.72 H new ATOM 574 N LYS A 110 18.585 -3.361 4.488 1.00 0.62 N ATOM 575 CA LYS A 110 19.026 -2.533 5.604 1.00 0.73 C ATOM 576 C LYS A 110 17.858 -1.875 6.333 1.00 0.77 C ATOM 577 O LYS A 110 17.687 -2.052 7.539 1.00 1.53 O ATOM 578 CB LYS A 110 19.992 -1.457 5.098 1.00 0.93 C ATOM 579 CG LYS A 110 21.229 -2.026 4.418 1.00 1.14 C ATOM 580 CD LYS A 110 22.070 -0.937 3.779 1.00 1.46 C ATOM 581 CE LYS A 110 23.341 -1.511 3.174 1.00 1.80 C ATOM 582 NZ LYS A 110 24.082 -0.503 2.373 1.00 1.59 N ATOM 0 H LYS A 110 18.275 -2.836 3.670 1.00 0.62 H new ATOM 0 HA LYS A 110 19.530 -3.185 6.317 1.00 0.73 H new ATOM 0 HB2 LYS A 110 19.467 -0.809 4.397 1.00 0.93 H new ATOM 0 HB3 LYS A 110 20.302 -0.834 5.937 1.00 0.93 H new ATOM 0 HG2 LYS A 110 21.829 -2.567 5.149 1.00 1.14 H new ATOM 0 HG3 LYS A 110 20.927 -2.746 3.657 1.00 1.14 H new ATOM 0 HD2 LYS A 110 21.491 -0.433 3.005 1.00 1.46 H new ATOM 0 HD3 LYS A 110 22.326 -0.186 4.526 1.00 1.46 H new ATOM 0 HE2 LYS A 110 23.984 -1.885 3.970 1.00 1.80 H new ATOM 0 HE3 LYS A 110 23.089 -2.362 2.542 1.00 1.80 H new ATOM 0 HZ1 LYS A 110 25.075 -0.796 2.279 1.00 1.59 H new ATOM 0 HZ2 LYS A 110 23.653 -0.426 1.429 1.00 1.59 H new ATOM 0 HZ3 LYS A 110 24.037 0.420 2.850 1.00 1.59 H new ATOM 596 N SER A 111 17.054 -1.119 5.605 1.00 0.51 N ATOM 597 CA SER A 111 15.996 -0.329 6.218 1.00 0.52 C ATOM 598 C SER A 111 14.624 -0.790 5.740 1.00 0.48 C ATOM 599 O SER A 111 14.468 -1.227 4.602 1.00 0.86 O ATOM 600 CB SER A 111 16.214 1.147 5.892 1.00 0.72 C ATOM 601 OG SER A 111 17.546 1.534 6.190 1.00 1.55 O ATOM 0 H SER A 111 17.112 -1.034 4.590 1.00 0.51 H new ATOM 0 HA SER A 111 16.031 -0.467 7.299 1.00 0.52 H new ATOM 0 HB2 SER A 111 16.005 1.327 4.837 1.00 0.72 H new ATOM 0 HB3 SER A 111 15.516 1.758 6.464 1.00 0.72 H new ATOM 0 HG SER A 111 17.668 2.482 5.973 1.00 1.55 H new ATOM 607 N LYS A 112 13.634 -0.679 6.609 1.00 0.39 N ATOM 608 CA LYS A 112 12.305 -1.201 6.326 1.00 0.32 C ATOM 609 C LYS A 112 11.388 -0.103 5.796 1.00 0.28 C ATOM 610 O LYS A 112 11.333 0.997 6.350 1.00 0.33 O ATOM 611 CB LYS A 112 11.700 -1.819 7.591 1.00 0.45 C ATOM 612 CG LYS A 112 12.646 -2.771 8.307 1.00 0.55 C ATOM 613 CD LYS A 112 11.975 -3.450 9.487 1.00 0.69 C ATOM 614 CE LYS A 112 12.955 -4.309 10.274 1.00 0.84 C ATOM 615 NZ LYS A 112 13.581 -5.363 9.434 1.00 1.53 N ATOM 0 H LYS A 112 13.725 -0.230 7.521 1.00 0.39 H new ATOM 0 HA LYS A 112 12.399 -1.970 5.560 1.00 0.32 H new ATOM 0 HB2 LYS A 112 11.412 -1.021 8.275 1.00 0.45 H new ATOM 0 HB3 LYS A 112 10.789 -2.355 7.325 1.00 0.45 H new ATOM 0 HG2 LYS A 112 13.001 -3.527 7.606 1.00 0.55 H new ATOM 0 HG3 LYS A 112 13.521 -2.222 8.653 1.00 0.55 H new ATOM 0 HD2 LYS A 112 11.544 -2.695 10.144 1.00 0.69 H new ATOM 0 HD3 LYS A 112 11.152 -4.070 9.131 1.00 0.69 H new ATOM 0 HE2 LYS A 112 13.734 -3.674 10.696 1.00 0.84 H new ATOM 0 HE3 LYS A 112 12.435 -4.775 11.111 1.00 0.84 H new ATOM 0 HZ1 LYS A 112 14.134 -6.005 10.037 1.00 1.53 H new ATOM 0 HZ2 LYS A 112 12.839 -5.902 8.943 1.00 1.53 H new ATOM 0 HZ3 LYS A 112 14.209 -4.921 8.733 1.00 1.53 H new ATOM 629 N TRP A 113 10.675 -0.411 4.719 1.00 0.24 N ATOM 630 CA TRP A 113 9.729 0.529 4.126 1.00 0.22 C ATOM 631 C TRP A 113 8.505 0.684 5.009 1.00 0.21 C ATOM 632 O TRP A 113 7.951 -0.303 5.495 1.00 0.25 O ATOM 633 CB TRP A 113 9.301 0.068 2.731 1.00 0.22 C ATOM 634 CG TRP A 113 10.301 0.369 1.659 1.00 0.23 C ATOM 635 CD1 TRP A 113 11.621 0.031 1.645 1.00 0.24 C ATOM 636 CD2 TRP A 113 10.050 1.060 0.429 1.00 0.24 C ATOM 637 NE1 TRP A 113 12.210 0.482 0.492 1.00 0.25 N ATOM 638 CE2 TRP A 113 11.267 1.114 -0.270 1.00 0.25 C ATOM 639 CE3 TRP A 113 8.918 1.643 -0.149 1.00 0.28 C ATOM 640 CZ2 TRP A 113 11.387 1.723 -1.516 1.00 0.29 C ATOM 641 CZ3 TRP A 113 9.040 2.246 -1.387 1.00 0.32 C ATOM 642 CH2 TRP A 113 10.267 2.281 -2.058 1.00 0.32 C ATOM 0 H TRP A 113 10.734 -1.308 4.236 1.00 0.24 H new ATOM 0 HA TRP A 113 10.230 1.493 4.038 1.00 0.22 H new ATOM 0 HB2 TRP A 113 9.120 -1.007 2.754 1.00 0.22 H new ATOM 0 HB3 TRP A 113 8.355 0.545 2.476 1.00 0.22 H new ATOM 0 HD1 TRP A 113 12.129 -0.513 2.428 1.00 0.24 H new ATOM 0 HE1 TRP A 113 13.192 0.365 0.243 1.00 0.25 H new ATOM 0 HE3 TRP A 113 7.967 1.623 0.362 1.00 0.28 H new ATOM 0 HZ2 TRP A 113 12.334 1.753 -2.035 1.00 0.29 H new ATOM 0 HZ3 TRP A 113 8.172 2.698 -1.844 1.00 0.32 H new ATOM 0 HH2 TRP A 113 10.328 2.759 -3.024 1.00 0.32 H new ATOM 653 N LYS A 114 8.094 1.923 5.215 1.00 0.20 N ATOM 654 CA LYS A 114 6.932 2.212 6.028 1.00 0.24 C ATOM 655 C LYS A 114 5.723 2.429 5.133 1.00 0.20 C ATOM 656 O LYS A 114 5.772 3.229 4.195 1.00 0.24 O ATOM 657 CB LYS A 114 7.177 3.457 6.874 1.00 0.37 C ATOM 658 CG LYS A 114 6.116 3.693 7.936 1.00 0.58 C ATOM 659 CD LYS A 114 6.254 2.719 9.094 1.00 1.04 C ATOM 660 CE LYS A 114 5.143 2.907 10.114 1.00 1.08 C ATOM 661 NZ LYS A 114 5.342 2.055 11.317 1.00 1.66 N ATOM 0 H LYS A 114 8.553 2.747 4.827 1.00 0.20 H new ATOM 0 HA LYS A 114 6.745 1.367 6.691 1.00 0.24 H new ATOM 0 HB2 LYS A 114 8.150 3.371 7.358 1.00 0.37 H new ATOM 0 HB3 LYS A 114 7.223 4.327 6.219 1.00 0.37 H new ATOM 0 HG2 LYS A 114 6.195 4.714 8.308 1.00 0.58 H new ATOM 0 HG3 LYS A 114 5.126 3.591 7.491 1.00 0.58 H new ATOM 0 HD2 LYS A 114 6.233 1.697 8.716 1.00 1.04 H new ATOM 0 HD3 LYS A 114 7.221 2.861 9.577 1.00 1.04 H new ATOM 0 HE2 LYS A 114 5.100 3.954 10.414 1.00 1.08 H new ATOM 0 HE3 LYS A 114 4.184 2.667 9.654 1.00 1.08 H new ATOM 0 HZ1 LYS A 114 4.563 2.213 11.987 1.00 1.66 H new ATOM 0 HZ2 LYS A 114 5.358 1.054 11.035 1.00 1.66 H new ATOM 0 HZ3 LYS A 114 6.245 2.301 11.771 1.00 1.66 H new ATOM 675 N TRP A 115 4.649 1.715 5.412 1.00 0.17 N ATOM 676 CA TRP A 115 3.435 1.849 4.630 1.00 0.15 C ATOM 677 C TRP A 115 2.280 2.263 5.517 1.00 0.16 C ATOM 678 O TRP A 115 2.272 1.974 6.715 1.00 0.18 O ATOM 679 CB TRP A 115 3.097 0.536 3.920 1.00 0.15 C ATOM 680 CG TRP A 115 2.841 -0.609 4.853 1.00 0.16 C ATOM 681 CD1 TRP A 115 3.759 -1.495 5.321 1.00 0.19 C ATOM 682 CD2 TRP A 115 1.584 -1.001 5.421 1.00 0.17 C ATOM 683 NE1 TRP A 115 3.159 -2.407 6.147 1.00 0.22 N ATOM 684 CE2 TRP A 115 1.825 -2.128 6.225 1.00 0.20 C ATOM 685 CE3 TRP A 115 0.282 -0.507 5.331 1.00 0.18 C ATOM 686 CZ2 TRP A 115 0.816 -2.770 6.933 1.00 0.23 C ATOM 687 CZ3 TRP A 115 -0.721 -1.146 6.034 1.00 0.20 C ATOM 688 CH2 TRP A 115 -0.448 -2.268 6.826 1.00 0.22 C ATOM 0 H TRP A 115 4.592 1.038 6.173 1.00 0.17 H new ATOM 0 HA TRP A 115 3.602 2.620 3.877 1.00 0.15 H new ATOM 0 HB2 TRP A 115 2.216 0.688 3.296 1.00 0.15 H new ATOM 0 HB3 TRP A 115 3.918 0.273 3.254 1.00 0.15 H new ATOM 0 HD1 TRP A 115 4.811 -1.482 5.076 1.00 0.19 H new ATOM 0 HE1 TRP A 115 3.633 -3.172 6.627 1.00 0.22 H new ATOM 0 HE3 TRP A 115 0.063 0.358 4.723 1.00 0.18 H new ATOM 0 HZ2 TRP A 115 1.025 -3.635 7.545 1.00 0.23 H new ATOM 0 HZ3 TRP A 115 -1.733 -0.774 5.972 1.00 0.20 H new ATOM 0 HH2 TRP A 115 -1.254 -2.746 7.363 1.00 0.22 H new ATOM 699 N GLU A 116 1.316 2.947 4.928 1.00 0.17 N ATOM 700 CA GLU A 116 0.095 3.306 5.622 1.00 0.20 C ATOM 701 C GLU A 116 -1.104 3.018 4.734 1.00 0.19 C ATOM 702 O GLU A 116 -1.084 3.321 3.541 1.00 0.25 O ATOM 703 CB GLU A 116 0.084 4.789 5.985 1.00 0.32 C ATOM 704 CG GLU A 116 1.309 5.275 6.729 1.00 0.50 C ATOM 705 CD GLU A 116 1.237 6.761 6.987 1.00 0.64 C ATOM 706 OE1 GLU A 116 0.835 7.505 6.064 1.00 1.40 O ATOM 707 OE2 GLU A 116 1.571 7.193 8.109 1.00 1.22 O ATOM 0 H GLU A 116 1.358 3.267 3.960 1.00 0.17 H new ATOM 0 HA GLU A 116 0.044 2.714 6.536 1.00 0.20 H new ATOM 0 HB2 GLU A 116 -0.021 5.371 5.069 1.00 0.32 H new ATOM 0 HB3 GLU A 116 -0.797 4.992 6.594 1.00 0.32 H new ATOM 0 HG2 GLU A 116 1.398 4.743 7.676 1.00 0.50 H new ATOM 0 HG3 GLU A 116 2.204 5.047 6.150 1.00 0.50 H new ATOM 714 N LEU A 117 -2.141 2.441 5.309 1.00 0.17 N ATOM 715 CA LEU A 117 -3.384 2.250 4.592 1.00 0.16 C ATOM 716 C LEU A 117 -4.267 3.461 4.813 1.00 0.15 C ATOM 717 O LEU A 117 -4.618 3.784 5.948 1.00 0.19 O ATOM 718 CB LEU A 117 -4.117 0.995 5.053 1.00 0.19 C ATOM 719 CG LEU A 117 -5.423 0.721 4.306 1.00 0.21 C ATOM 720 CD1 LEU A 117 -5.149 0.197 2.906 1.00 0.22 C ATOM 721 CD2 LEU A 117 -6.287 -0.249 5.080 1.00 0.25 C ATOM 0 H LEU A 117 -2.147 2.097 6.269 1.00 0.17 H new ATOM 0 HA LEU A 117 -3.154 2.129 3.533 1.00 0.16 H new ATOM 0 HB2 LEU A 117 -3.456 0.137 4.932 1.00 0.19 H new ATOM 0 HB3 LEU A 117 -4.333 1.084 6.118 1.00 0.19 H new ATOM 0 HG LEU A 117 -5.963 1.663 4.214 1.00 0.21 H new ATOM 0 HD11 LEU A 117 -6.094 0.010 2.396 1.00 0.22 H new ATOM 0 HD12 LEU A 117 -4.575 0.936 2.347 1.00 0.22 H new ATOM 0 HD13 LEU A 117 -4.581 -0.731 2.970 1.00 0.22 H new ATOM 0 HD21 LEU A 117 -7.211 -0.431 4.532 1.00 0.25 H new ATOM 0 HD22 LEU A 117 -5.751 -1.189 5.210 1.00 0.25 H new ATOM 0 HD23 LEU A 117 -6.522 0.173 6.057 1.00 0.25 H new ATOM 733 N HIS A 118 -4.611 4.131 3.736 1.00 0.13 N ATOM 734 CA HIS A 118 -5.396 5.344 3.826 1.00 0.14 C ATOM 735 C HIS A 118 -6.816 5.093 3.372 1.00 0.18 C ATOM 736 O HIS A 118 -7.055 4.320 2.446 1.00 0.21 O ATOM 737 CB HIS A 118 -4.773 6.461 2.982 1.00 0.18 C ATOM 738 CG HIS A 118 -3.477 6.992 3.525 1.00 0.20 C ATOM 739 ND1 HIS A 118 -3.127 8.323 3.461 1.00 0.50 N ATOM 740 CD2 HIS A 118 -2.443 6.365 4.137 1.00 0.24 C ATOM 741 CE1 HIS A 118 -1.937 8.489 4.011 1.00 0.45 C ATOM 742 NE2 HIS A 118 -1.498 7.320 4.431 1.00 0.22 N ATOM 0 H HIS A 118 -4.360 3.857 2.786 1.00 0.13 H new ATOM 0 HA HIS A 118 -5.407 5.658 4.870 1.00 0.14 H new ATOM 0 HB2 HIS A 118 -4.605 6.087 1.972 1.00 0.18 H new ATOM 0 HB3 HIS A 118 -5.485 7.282 2.904 1.00 0.18 H new ATOM 0 HD2 HIS A 118 -2.374 5.309 4.354 1.00 0.24 H new ATOM 0 HE1 HIS A 118 -1.411 9.428 4.101 1.00 0.45 H new ATOM 0 HE2 HIS A 118 -0.606 7.151 4.896 1.00 0.22 H new ATOM 751 N LYS A 119 -7.752 5.728 4.049 1.00 0.22 N ATOM 752 CA LYS A 119 -9.139 5.703 3.636 1.00 0.29 C ATOM 753 C LYS A 119 -9.429 6.948 2.811 1.00 0.27 C ATOM 754 O LYS A 119 -9.623 8.039 3.351 1.00 0.43 O ATOM 755 CB LYS A 119 -10.058 5.623 4.855 1.00 0.43 C ATOM 756 CG LYS A 119 -11.514 5.387 4.504 1.00 0.70 C ATOM 757 CD LYS A 119 -12.335 5.098 5.745 1.00 0.84 C ATOM 758 CE LYS A 119 -13.790 4.833 5.405 1.00 1.04 C ATOM 759 NZ LYS A 119 -14.583 4.504 6.616 1.00 1.69 N ATOM 0 H LYS A 119 -7.574 6.271 4.894 1.00 0.22 H new ATOM 0 HA LYS A 119 -9.327 4.819 3.026 1.00 0.29 H new ATOM 0 HB2 LYS A 119 -9.715 4.819 5.506 1.00 0.43 H new ATOM 0 HB3 LYS A 119 -9.976 6.550 5.423 1.00 0.43 H new ATOM 0 HG2 LYS A 119 -11.915 6.263 3.995 1.00 0.70 H new ATOM 0 HG3 LYS A 119 -11.593 4.551 3.809 1.00 0.70 H new ATOM 0 HD2 LYS A 119 -11.919 4.234 6.264 1.00 0.84 H new ATOM 0 HD3 LYS A 119 -12.269 5.943 6.430 1.00 0.84 H new ATOM 0 HE2 LYS A 119 -14.216 5.710 4.918 1.00 1.04 H new ATOM 0 HE3 LYS A 119 -13.854 4.010 4.693 1.00 1.04 H new ATOM 0 HZ1 LYS A 119 -15.572 4.329 6.346 1.00 1.69 H new ATOM 0 HZ2 LYS A 119 -14.191 3.653 7.067 1.00 1.69 H new ATOM 0 HZ3 LYS A 119 -14.542 5.300 7.284 1.00 1.69 H new ATOM 773 N LEU A 120 -9.431 6.780 1.502 1.00 0.23 N ATOM 774 CA LEU A 120 -9.544 7.904 0.589 1.00 0.26 C ATOM 775 C LEU A 120 -11.004 8.235 0.335 1.00 0.34 C ATOM 776 O LEU A 120 -11.860 7.354 0.299 1.00 0.37 O ATOM 777 CB LEU A 120 -8.821 7.610 -0.738 1.00 0.24 C ATOM 778 CG LEU A 120 -7.293 7.473 -0.652 1.00 0.20 C ATOM 779 CD1 LEU A 120 -6.691 8.597 0.173 1.00 0.25 C ATOM 780 CD2 LEU A 120 -6.896 6.122 -0.090 1.00 0.21 C ATOM 0 H LEU A 120 -9.355 5.872 1.044 1.00 0.23 H new ATOM 0 HA LEU A 120 -9.066 8.767 1.052 1.00 0.26 H new ATOM 0 HB2 LEU A 120 -9.227 6.688 -1.154 1.00 0.24 H new ATOM 0 HB3 LEU A 120 -9.056 8.408 -1.442 1.00 0.24 H new ATOM 0 HG LEU A 120 -6.896 7.546 -1.665 1.00 0.20 H new ATOM 0 HD11 LEU A 120 -5.609 8.476 0.218 1.00 0.25 H new ATOM 0 HD12 LEU A 120 -6.930 9.555 -0.288 1.00 0.25 H new ATOM 0 HD13 LEU A 120 -7.101 8.568 1.182 1.00 0.25 H new ATOM 0 HD21 LEU A 120 -5.809 6.054 -0.041 1.00 0.21 H new ATOM 0 HD22 LEU A 120 -7.313 6.008 0.911 1.00 0.21 H new ATOM 0 HD23 LEU A 120 -7.280 5.332 -0.735 1.00 0.21 H new ATOM 792 N GLU A 121 -11.280 9.517 0.171 1.00 0.46 N ATOM 793 CA GLU A 121 -12.641 9.992 -0.024 1.00 0.57 C ATOM 794 C GLU A 121 -13.017 9.968 -1.500 1.00 0.58 C ATOM 795 O GLU A 121 -14.169 10.210 -1.863 1.00 0.69 O ATOM 796 CB GLU A 121 -12.775 11.408 0.532 1.00 0.70 C ATOM 797 CG GLU A 121 -12.452 11.507 2.015 1.00 0.80 C ATOM 798 CD GLU A 121 -13.455 10.775 2.882 1.00 1.63 C ATOM 799 OE1 GLU A 121 -13.219 9.594 3.212 1.00 2.36 O ATOM 800 OE2 GLU A 121 -14.484 11.385 3.247 1.00 2.22 O ATOM 0 H GLU A 121 -10.574 10.254 0.169 1.00 0.46 H new ATOM 0 HA GLU A 121 -13.322 9.329 0.510 1.00 0.57 H new ATOM 0 HB2 GLU A 121 -12.112 12.072 -0.022 1.00 0.70 H new ATOM 0 HB3 GLU A 121 -13.792 11.761 0.365 1.00 0.70 H new ATOM 0 HG2 GLU A 121 -11.457 11.099 2.194 1.00 0.80 H new ATOM 0 HG3 GLU A 121 -12.423 12.557 2.307 1.00 0.80 H new ATOM 807 N ASN A 122 -12.039 9.675 -2.344 1.00 0.53 N ATOM 808 CA ASN A 122 -12.254 9.612 -3.781 1.00 0.60 C ATOM 809 C ASN A 122 -11.200 8.708 -4.409 1.00 0.62 C ATOM 810 O ASN A 122 -10.050 8.700 -3.974 1.00 1.22 O ATOM 811 CB ASN A 122 -12.180 11.016 -4.390 1.00 0.73 C ATOM 812 CG ASN A 122 -12.698 11.066 -5.814 1.00 1.03 C ATOM 813 OD1 ASN A 122 -11.967 10.793 -6.762 1.00 1.16 O ATOM 814 ND2 ASN A 122 -13.962 11.432 -5.973 1.00 1.87 N ATOM 0 H ASN A 122 -11.081 9.476 -2.055 1.00 0.53 H new ATOM 0 HA ASN A 122 -13.245 9.203 -3.980 1.00 0.60 H new ATOM 0 HB2 ASN A 122 -12.757 11.705 -3.774 1.00 0.73 H new ATOM 0 HB3 ASN A 122 -11.146 11.361 -4.372 1.00 0.73 H new ATOM 0 HD21 ASN A 122 -14.361 11.495 -6.910 1.00 1.87 H new ATOM 0 HD22 ASN A 122 -14.536 11.650 -5.159 1.00 1.87 H new ATOM 821 N ALA A 123 -11.596 7.940 -5.414 1.00 0.67 N ATOM 822 CA ALA A 123 -10.688 6.994 -6.055 1.00 0.66 C ATOM 823 C ALA A 123 -10.489 7.330 -7.527 1.00 0.71 C ATOM 824 O ALA A 123 -10.153 6.464 -8.338 1.00 0.90 O ATOM 825 CB ALA A 123 -11.218 5.577 -5.908 1.00 0.69 C ATOM 0 H ALA A 123 -12.538 7.952 -5.804 1.00 0.67 H new ATOM 0 HA ALA A 123 -9.720 7.067 -5.559 1.00 0.66 H new ATOM 0 HB1 ALA A 123 -10.532 4.880 -6.390 1.00 0.69 H new ATOM 0 HB2 ALA A 123 -11.304 5.328 -4.850 1.00 0.69 H new ATOM 0 HB3 ALA A 123 -12.199 5.505 -6.378 1.00 0.69 H new ATOM 831 N ARG A 124 -10.712 8.588 -7.866 1.00 0.72 N ATOM 832 CA ARG A 124 -10.584 9.051 -9.242 1.00 0.83 C ATOM 833 C ARG A 124 -9.704 10.292 -9.312 1.00 0.75 C ATOM 834 O ARG A 124 -9.503 10.869 -10.380 1.00 0.86 O ATOM 835 CB ARG A 124 -11.969 9.356 -9.813 1.00 1.08 C ATOM 836 CG ARG A 124 -12.833 8.122 -10.010 1.00 1.37 C ATOM 837 CD ARG A 124 -14.301 8.486 -10.139 1.00 1.63 C ATOM 838 NE ARG A 124 -14.880 8.878 -8.854 1.00 2.28 N ATOM 839 CZ ARG A 124 -15.989 9.603 -8.721 1.00 2.84 C ATOM 840 NH1 ARG A 124 -16.618 10.063 -9.795 1.00 2.76 N ATOM 841 NH2 ARG A 124 -16.462 9.877 -7.512 1.00 3.84 N ATOM 0 H ARG A 124 -10.985 9.314 -7.203 1.00 0.72 H new ATOM 0 HA ARG A 124 -10.115 8.265 -9.834 1.00 0.83 H new ATOM 0 HB2 ARG A 124 -12.484 10.046 -9.145 1.00 1.08 H new ATOM 0 HB3 ARG A 124 -11.854 9.865 -10.770 1.00 1.08 H new ATOM 0 HG2 ARG A 124 -12.509 7.589 -10.904 1.00 1.37 H new ATOM 0 HG3 ARG A 124 -12.698 7.444 -9.168 1.00 1.37 H new ATOM 0 HD2 ARG A 124 -14.411 9.303 -10.852 1.00 1.63 H new ATOM 0 HD3 ARG A 124 -14.852 7.636 -10.541 1.00 1.63 H new ATOM 0 HE ARG A 124 -14.403 8.576 -8.004 1.00 2.28 H new ATOM 0 HH11 ARG A 124 -16.252 9.862 -10.726 1.00 2.76 H new ATOM 0 HH12 ARG A 124 -17.467 10.618 -9.690 1.00 2.76 H new ATOM 0 HH21 ARG A 124 -15.976 9.532 -6.684 1.00 3.84 H new ATOM 0 HH22 ARG A 124 -17.311 10.432 -7.411 1.00 3.84 H new ATOM 855 N LYS A 125 -9.188 10.694 -8.164 1.00 0.75 N ATOM 856 CA LYS A 125 -8.358 11.885 -8.054 1.00 0.68 C ATOM 857 C LYS A 125 -7.079 11.542 -7.301 1.00 0.55 C ATOM 858 O LYS A 125 -7.020 10.501 -6.644 1.00 0.53 O ATOM 859 CB LYS A 125 -9.117 13.001 -7.317 1.00 0.79 C ATOM 860 CG LYS A 125 -10.449 13.392 -7.950 1.00 0.93 C ATOM 861 CD LYS A 125 -10.296 13.824 -9.404 1.00 1.64 C ATOM 862 CE LYS A 125 -9.474 15.096 -9.544 1.00 1.90 C ATOM 863 NZ LYS A 125 -10.113 16.262 -8.880 1.00 2.26 N ATOM 0 H LYS A 125 -9.331 10.205 -7.280 1.00 0.75 H new ATOM 0 HA LYS A 125 -8.108 12.239 -9.054 1.00 0.68 H new ATOM 0 HB2 LYS A 125 -9.298 12.682 -6.291 1.00 0.79 H new ATOM 0 HB3 LYS A 125 -8.480 13.884 -7.269 1.00 0.79 H new ATOM 0 HG2 LYS A 125 -11.136 12.548 -7.895 1.00 0.93 H new ATOM 0 HG3 LYS A 125 -10.896 14.205 -7.377 1.00 0.93 H new ATOM 0 HD2 LYS A 125 -9.821 13.023 -9.971 1.00 1.64 H new ATOM 0 HD3 LYS A 125 -11.283 13.982 -9.840 1.00 1.64 H new ATOM 0 HE2 LYS A 125 -8.485 14.935 -9.115 1.00 1.90 H new ATOM 0 HE3 LYS A 125 -9.331 15.318 -10.602 1.00 1.90 H new ATOM 0 HZ1 LYS A 125 -9.618 17.134 -9.158 1.00 2.26 H new ATOM 0 HZ2 LYS A 125 -11.110 16.323 -9.169 1.00 2.26 H new ATOM 0 HZ3 LYS A 125 -10.058 16.147 -7.848 1.00 2.26 H new ATOM 877 N PRO A 126 -6.030 12.385 -7.408 1.00 0.51 N ATOM 878 CA PRO A 126 -4.784 12.204 -6.658 1.00 0.45 C ATOM 879 C PRO A 126 -5.051 11.925 -5.184 1.00 0.39 C ATOM 880 O PRO A 126 -5.719 12.711 -4.499 1.00 0.47 O ATOM 881 CB PRO A 126 -4.050 13.545 -6.824 1.00 0.51 C ATOM 882 CG PRO A 126 -5.028 14.460 -7.483 1.00 0.59 C ATOM 883 CD PRO A 126 -5.957 13.575 -8.262 1.00 0.60 C ATOM 0 HA PRO A 126 -4.209 11.352 -7.022 1.00 0.45 H new ATOM 0 HB2 PRO A 126 -3.733 13.940 -5.859 1.00 0.51 H new ATOM 0 HB3 PRO A 126 -3.152 13.428 -7.431 1.00 0.51 H new ATOM 0 HG2 PRO A 126 -5.574 15.046 -6.744 1.00 0.59 H new ATOM 0 HG3 PRO A 126 -4.521 15.168 -8.139 1.00 0.59 H new ATOM 0 HD2 PRO A 126 -6.935 14.035 -8.405 1.00 0.60 H new ATOM 0 HD3 PRO A 126 -5.565 13.343 -9.252 1.00 0.60 H new ATOM 891 N LEU A 127 -4.529 10.808 -4.706 1.00 0.32 N ATOM 892 CA LEU A 127 -4.820 10.339 -3.364 1.00 0.26 C ATOM 893 C LEU A 127 -4.089 11.177 -2.329 1.00 0.29 C ATOM 894 O LEU A 127 -2.992 11.681 -2.575 1.00 0.37 O ATOM 895 CB LEU A 127 -4.456 8.863 -3.226 1.00 0.24 C ATOM 896 CG LEU A 127 -5.082 7.939 -4.279 1.00 0.26 C ATOM 897 CD1 LEU A 127 -4.778 6.488 -3.961 1.00 0.26 C ATOM 898 CD2 LEU A 127 -6.587 8.160 -4.378 1.00 0.27 C ATOM 0 H LEU A 127 -3.897 10.206 -5.233 1.00 0.32 H new ATOM 0 HA LEU A 127 -5.890 10.446 -3.186 1.00 0.26 H new ATOM 0 HB2 LEU A 127 -3.372 8.765 -3.278 1.00 0.24 H new ATOM 0 HB3 LEU A 127 -4.760 8.520 -2.237 1.00 0.24 H new ATOM 0 HG LEU A 127 -4.641 8.183 -5.246 1.00 0.26 H new ATOM 0 HD11 LEU A 127 -5.230 5.847 -4.718 1.00 0.26 H new ATOM 0 HD12 LEU A 127 -3.699 6.336 -3.954 1.00 0.26 H new ATOM 0 HD13 LEU A 127 -5.187 6.237 -2.982 1.00 0.26 H new ATOM 0 HD21 LEU A 127 -7.004 7.492 -5.132 1.00 0.27 H new ATOM 0 HD22 LEU A 127 -7.050 7.952 -3.413 1.00 0.27 H new ATOM 0 HD23 LEU A 127 -6.785 9.194 -4.660 1.00 0.27 H new ATOM 910 N LYS A 128 -4.705 11.315 -1.169 1.00 0.29 N ATOM 911 CA LYS A 128 -4.250 12.268 -0.174 1.00 0.36 C ATOM 912 C LYS A 128 -4.011 11.621 1.185 1.00 0.26 C ATOM 913 O LYS A 128 -4.573 10.573 1.514 1.00 0.23 O ATOM 914 CB LYS A 128 -5.290 13.378 -0.047 1.00 0.51 C ATOM 915 CG LYS A 128 -5.510 14.132 -1.346 1.00 1.10 C ATOM 916 CD LYS A 128 -6.664 15.112 -1.243 1.00 1.37 C ATOM 917 CE LYS A 128 -6.881 15.846 -2.557 1.00 1.80 C ATOM 918 NZ LYS A 128 -7.201 14.916 -3.674 1.00 2.27 N ATOM 0 H LYS A 128 -5.526 10.776 -0.892 1.00 0.29 H new ATOM 0 HA LYS A 128 -3.293 12.672 -0.504 1.00 0.36 H new ATOM 0 HB2 LYS A 128 -6.236 12.947 0.282 1.00 0.51 H new ATOM 0 HB3 LYS A 128 -4.973 14.079 0.725 1.00 0.51 H new ATOM 0 HG2 LYS A 128 -4.600 14.670 -1.612 1.00 1.10 H new ATOM 0 HG3 LYS A 128 -5.707 13.422 -2.149 1.00 1.10 H new ATOM 0 HD2 LYS A 128 -7.574 14.579 -0.967 1.00 1.37 H new ATOM 0 HD3 LYS A 128 -6.463 15.832 -0.450 1.00 1.37 H new ATOM 0 HE2 LYS A 128 -7.693 16.564 -2.440 1.00 1.80 H new ATOM 0 HE3 LYS A 128 -5.985 16.415 -2.806 1.00 1.80 H new ATOM 0 HZ1 LYS A 128 -7.489 15.464 -4.510 1.00 2.27 H new ATOM 0 HZ2 LYS A 128 -6.361 14.349 -3.905 1.00 2.27 H new ATOM 0 HZ3 LYS A 128 -7.977 14.285 -3.389 1.00 2.27 H new ATOM 932 N ASP A 129 -3.151 12.258 1.958 1.00 0.32 N ATOM 933 CA ASP A 129 -2.874 11.851 3.326 1.00 0.39 C ATOM 934 C ASP A 129 -3.885 12.485 4.273 1.00 0.45 C ATOM 935 O ASP A 129 -4.585 13.429 3.902 1.00 0.51 O ATOM 936 CB ASP A 129 -1.452 12.258 3.740 1.00 0.59 C ATOM 937 CG ASP A 129 -1.275 13.762 3.853 1.00 1.00 C ATOM 938 OD1 ASP A 129 -1.049 14.418 2.818 1.00 1.56 O ATOM 939 OD2 ASP A 129 -1.351 14.295 4.980 1.00 1.88 O ATOM 0 H ASP A 129 -2.622 13.076 1.655 1.00 0.32 H new ATOM 0 HA ASP A 129 -2.955 10.765 3.382 1.00 0.39 H new ATOM 0 HB2 ASP A 129 -1.212 11.796 4.698 1.00 0.59 H new ATOM 0 HB3 ASP A 129 -0.742 11.868 3.011 1.00 0.59 H new ATOM 944 N GLY A 130 -3.962 11.967 5.489 1.00 0.51 N ATOM 945 CA GLY A 130 -4.867 12.528 6.475 1.00 0.62 C ATOM 946 C GLY A 130 -5.823 11.504 7.046 1.00 0.60 C ATOM 947 O GLY A 130 -6.341 11.680 8.150 1.00 0.75 O ATOM 0 H GLY A 130 -3.415 11.169 5.813 1.00 0.51 H new ATOM 0 HA2 GLY A 130 -4.286 12.967 7.286 1.00 0.62 H new ATOM 0 HA3 GLY A 130 -5.438 13.336 6.018 1.00 0.62 H new ATOM 951 N ASN A 131 -6.066 10.435 6.304 1.00 0.47 N ATOM 952 CA ASN A 131 -6.865 9.330 6.808 1.00 0.46 C ATOM 953 C ASN A 131 -6.031 8.065 6.832 1.00 0.40 C ATOM 954 O ASN A 131 -5.747 7.488 5.786 1.00 0.46 O ATOM 955 CB ASN A 131 -8.107 9.102 5.945 1.00 0.51 C ATOM 956 CG ASN A 131 -9.118 10.226 6.047 1.00 1.32 C ATOM 957 OD1 ASN A 131 -9.224 10.889 7.077 1.00 2.28 O ATOM 958 ND2 ASN A 131 -9.882 10.435 4.986 1.00 1.45 N ATOM 0 H ASN A 131 -5.722 10.309 5.352 1.00 0.47 H new ATOM 0 HA ASN A 131 -7.190 9.582 7.817 1.00 0.46 H new ATOM 0 HB2 ASN A 131 -7.803 8.989 4.904 1.00 0.51 H new ATOM 0 HB3 ASN A 131 -8.582 8.167 6.242 1.00 0.51 H new ATOM 0 HD21 ASN A 131 -10.590 11.169 5.004 1.00 1.45 H new ATOM 0 HD22 ASN A 131 -9.762 9.862 4.150 1.00 1.45 H new ATOM 965 N VAL A 132 -5.631 7.640 8.015 1.00 0.36 N ATOM 966 CA VAL A 132 -4.847 6.427 8.153 1.00 0.31 C ATOM 967 C VAL A 132 -5.598 5.404 8.991 1.00 0.28 C ATOM 968 O VAL A 132 -6.174 5.724 10.033 1.00 0.35 O ATOM 969 CB VAL A 132 -3.456 6.701 8.771 1.00 0.35 C ATOM 970 CG1 VAL A 132 -3.581 7.261 10.177 1.00 0.73 C ATOM 971 CG2 VAL A 132 -2.607 5.437 8.771 1.00 0.71 C ATOM 0 H VAL A 132 -5.836 8.116 8.894 1.00 0.36 H new ATOM 0 HA VAL A 132 -4.689 6.028 7.151 1.00 0.31 H new ATOM 0 HB VAL A 132 -2.959 7.450 8.154 1.00 0.35 H new ATOM 0 HG11 VAL A 132 -2.587 7.444 10.586 1.00 0.73 H new ATOM 0 HG12 VAL A 132 -4.139 8.197 10.148 1.00 0.73 H new ATOM 0 HG13 VAL A 132 -4.107 6.545 10.808 1.00 0.73 H new ATOM 0 HG21 VAL A 132 -1.633 5.653 9.210 1.00 0.71 H new ATOM 0 HG22 VAL A 132 -3.105 4.664 9.356 1.00 0.71 H new ATOM 0 HG23 VAL A 132 -2.474 5.088 7.747 1.00 0.71 H new ATOM 981 N ILE A 133 -5.619 4.179 8.507 1.00 0.23 N ATOM 982 CA ILE A 133 -6.304 3.102 9.190 1.00 0.26 C ATOM 983 C ILE A 133 -5.293 2.131 9.783 1.00 0.28 C ATOM 984 O ILE A 133 -5.396 1.737 10.943 1.00 0.38 O ATOM 985 CB ILE A 133 -7.233 2.345 8.225 1.00 0.31 C ATOM 986 CG1 ILE A 133 -8.127 3.325 7.456 1.00 0.34 C ATOM 987 CG2 ILE A 133 -8.079 1.336 8.986 1.00 0.38 C ATOM 988 CD1 ILE A 133 -9.083 4.111 8.331 1.00 0.35 C ATOM 0 H ILE A 133 -5.165 3.904 7.636 1.00 0.23 H new ATOM 0 HA ILE A 133 -6.905 3.537 9.989 1.00 0.26 H new ATOM 0 HB ILE A 133 -6.617 1.807 7.505 1.00 0.31 H new ATOM 0 HG12 ILE A 133 -7.494 4.024 6.909 1.00 0.34 H new ATOM 0 HG13 ILE A 133 -8.703 2.770 6.715 1.00 0.34 H new ATOM 0 HG21 ILE A 133 -8.731 0.809 8.289 1.00 0.38 H new ATOM 0 HG22 ILE A 133 -7.428 0.620 9.487 1.00 0.38 H new ATOM 0 HG23 ILE A 133 -8.685 1.856 9.728 1.00 0.38 H new ATOM 0 HD11 ILE A 133 -9.678 4.780 7.710 1.00 0.35 H new ATOM 0 HD12 ILE A 133 -9.743 3.422 8.858 1.00 0.35 H new ATOM 0 HD13 ILE A 133 -8.516 4.696 9.055 1.00 0.35 H new ATOM 1000 N GLU A 134 -4.304 1.773 8.976 1.00 0.25 N ATOM 1001 CA GLU A 134 -3.268 0.832 9.374 1.00 0.30 C ATOM 1002 C GLU A 134 -1.921 1.316 8.868 1.00 0.23 C ATOM 1003 O GLU A 134 -1.864 2.094 7.917 1.00 0.21 O ATOM 1004 CB GLU A 134 -3.559 -0.560 8.804 1.00 0.43 C ATOM 1005 CG GLU A 134 -4.715 -1.279 9.477 1.00 0.63 C ATOM 1006 CD GLU A 134 -4.392 -1.683 10.898 1.00 0.74 C ATOM 1007 OE1 GLU A 134 -3.736 -2.730 11.081 1.00 1.50 O ATOM 1008 OE2 GLU A 134 -4.784 -0.960 11.837 1.00 1.42 O ATOM 0 H GLU A 134 -4.198 2.128 8.026 1.00 0.25 H new ATOM 0 HA GLU A 134 -3.252 0.769 10.462 1.00 0.30 H new ATOM 0 HB2 GLU A 134 -3.774 -0.467 7.740 1.00 0.43 H new ATOM 0 HB3 GLU A 134 -2.662 -1.173 8.895 1.00 0.43 H new ATOM 0 HG2 GLU A 134 -5.592 -0.632 9.476 1.00 0.63 H new ATOM 0 HG3 GLU A 134 -4.973 -2.167 8.899 1.00 0.63 H new ATOM 1015 N LYS A 135 -0.848 0.868 9.497 1.00 0.28 N ATOM 1016 CA LYS A 135 0.495 1.228 9.065 1.00 0.25 C ATOM 1017 C LYS A 135 1.532 0.306 9.683 1.00 0.27 C ATOM 1018 O LYS A 135 1.391 -0.133 10.824 1.00 0.34 O ATOM 1019 CB LYS A 135 0.813 2.691 9.402 1.00 0.32 C ATOM 1020 CG LYS A 135 0.456 3.104 10.820 1.00 0.56 C ATOM 1021 CD LYS A 135 0.915 4.524 11.103 1.00 0.62 C ATOM 1022 CE LYS A 135 0.466 5.008 12.474 1.00 0.74 C ATOM 1023 NZ LYS A 135 -1.013 5.124 12.571 1.00 1.53 N ATOM 0 H LYS A 135 -0.879 0.253 10.310 1.00 0.28 H new ATOM 0 HA LYS A 135 0.533 1.112 7.982 1.00 0.25 H new ATOM 0 HB2 LYS A 135 1.878 2.864 9.244 1.00 0.32 H new ATOM 0 HB3 LYS A 135 0.279 3.336 8.704 1.00 0.32 H new ATOM 0 HG2 LYS A 135 -0.622 3.031 10.964 1.00 0.56 H new ATOM 0 HG3 LYS A 135 0.920 2.419 11.530 1.00 0.56 H new ATOM 0 HD2 LYS A 135 2.002 4.572 11.040 1.00 0.62 H new ATOM 0 HD3 LYS A 135 0.521 5.191 10.336 1.00 0.62 H new ATOM 0 HE2 LYS A 135 0.826 4.318 13.237 1.00 0.74 H new ATOM 0 HE3 LYS A 135 0.919 5.977 12.682 1.00 0.74 H new ATOM 0 HZ1 LYS A 135 -1.264 5.658 13.428 1.00 1.53 H new ATOM 0 HZ2 LYS A 135 -1.378 5.622 11.734 1.00 1.53 H new ATOM 0 HZ3 LYS A 135 -1.433 4.174 12.620 1.00 1.53 H new ATOM 1037 N GLY A 136 2.577 0.020 8.925 1.00 0.30 N ATOM 1038 CA GLY A 136 3.612 -0.875 9.395 1.00 0.38 C ATOM 1039 C GLY A 136 4.803 -0.902 8.465 1.00 0.34 C ATOM 1040 O GLY A 136 5.138 0.113 7.852 1.00 0.29 O ATOM 0 H GLY A 136 2.728 0.394 7.988 1.00 0.30 H new ATOM 0 HA2 GLY A 136 3.935 -0.565 10.389 1.00 0.38 H new ATOM 0 HA3 GLY A 136 3.205 -1.881 9.492 1.00 0.38 H new ATOM 1044 N PHE A 137 5.421 -2.065 8.334 1.00 0.38 N ATOM 1045 CA PHE A 137 6.614 -2.207 7.515 1.00 0.32 C ATOM 1046 C PHE A 137 6.394 -3.232 6.403 1.00 0.33 C ATOM 1047 O PHE A 137 5.625 -4.182 6.559 1.00 0.46 O ATOM 1048 CB PHE A 137 7.809 -2.603 8.392 1.00 0.42 C ATOM 1049 CG PHE A 137 7.591 -3.851 9.209 1.00 1.07 C ATOM 1050 CD1 PHE A 137 7.821 -5.106 8.667 1.00 2.05 C ATOM 1051 CD2 PHE A 137 7.164 -3.766 10.526 1.00 1.81 C ATOM 1052 CE1 PHE A 137 7.627 -6.249 9.419 1.00 2.86 C ATOM 1053 CE2 PHE A 137 6.969 -4.906 11.281 1.00 2.60 C ATOM 1054 CZ PHE A 137 7.200 -6.149 10.728 1.00 2.93 C ATOM 0 H PHE A 137 5.115 -2.927 8.786 1.00 0.38 H new ATOM 0 HA PHE A 137 6.828 -1.247 7.045 1.00 0.32 H new ATOM 0 HB2 PHE A 137 8.681 -2.748 7.754 1.00 0.42 H new ATOM 0 HB3 PHE A 137 8.040 -1.778 9.065 1.00 0.42 H new ATOM 0 HD1 PHE A 137 8.156 -5.192 7.644 1.00 2.05 H new ATOM 0 HD2 PHE A 137 6.982 -2.797 10.966 1.00 1.81 H new ATOM 0 HE1 PHE A 137 7.809 -7.220 8.983 1.00 2.86 H new ATOM 0 HE2 PHE A 137 6.635 -4.825 12.305 1.00 2.60 H new ATOM 0 HZ PHE A 137 7.047 -7.041 11.317 1.00 2.93 H new ATOM 1064 N VAL A 138 7.065 -3.022 5.278 1.00 0.27 N ATOM 1065 CA VAL A 138 6.902 -3.875 4.100 1.00 0.41 C ATOM 1066 C VAL A 138 7.796 -5.116 4.177 1.00 0.70 C ATOM 1067 O VAL A 138 7.760 -5.974 3.296 1.00 1.41 O ATOM 1068 CB VAL A 138 7.184 -3.094 2.788 1.00 0.53 C ATOM 1069 CG1 VAL A 138 6.880 -3.940 1.561 1.00 0.76 C ATOM 1070 CG2 VAL A 138 6.368 -1.809 2.741 1.00 0.48 C ATOM 0 H VAL A 138 7.734 -2.262 5.153 1.00 0.27 H new ATOM 0 HA VAL A 138 5.862 -4.202 4.088 1.00 0.41 H new ATOM 0 HB VAL A 138 8.245 -2.845 2.779 1.00 0.53 H new ATOM 0 HG11 VAL A 138 7.088 -3.363 0.660 1.00 0.76 H new ATOM 0 HG12 VAL A 138 7.504 -4.834 1.572 1.00 0.76 H new ATOM 0 HG13 VAL A 138 5.830 -4.231 1.571 1.00 0.76 H new ATOM 0 HG21 VAL A 138 6.580 -1.277 1.814 1.00 0.48 H new ATOM 0 HG22 VAL A 138 5.306 -2.051 2.786 1.00 0.48 H new ATOM 0 HG23 VAL A 138 6.633 -1.179 3.590 1.00 0.48 H new ATOM 1080 N SER A 139 8.603 -5.205 5.226 1.00 0.32 N ATOM 1081 CA SER A 139 9.519 -6.330 5.402 1.00 0.51 C ATOM 1082 C SER A 139 8.779 -7.643 5.690 1.00 0.39 C ATOM 1083 O SER A 139 8.896 -8.219 6.771 1.00 1.13 O ATOM 1084 CB SER A 139 10.503 -6.025 6.525 1.00 1.03 C ATOM 1085 OG SER A 139 11.195 -4.816 6.272 1.00 1.68 O ATOM 0 H SER A 139 8.644 -4.510 5.972 1.00 0.32 H new ATOM 0 HA SER A 139 10.059 -6.463 4.465 1.00 0.51 H new ATOM 0 HB2 SER A 139 9.969 -5.952 7.473 1.00 1.03 H new ATOM 0 HB3 SER A 139 11.216 -6.844 6.623 1.00 1.03 H new ATOM 0 HG SER A 139 11.281 -4.684 5.305 1.00 1.68 H new ATOM 1091 N ASN A 140 8.010 -8.095 4.714 1.00 0.51 N ATOM 1092 CA ASN A 140 7.371 -9.399 4.751 1.00 0.34 C ATOM 1093 C ASN A 140 7.662 -10.114 3.442 1.00 0.27 C ATOM 1094 O ASN A 140 6.975 -9.910 2.440 1.00 0.37 O ATOM 1095 CB ASN A 140 5.860 -9.268 4.957 1.00 0.37 C ATOM 1096 CG ASN A 140 5.157 -10.615 4.989 1.00 0.38 C ATOM 1097 OD1 ASN A 140 5.730 -11.622 5.411 1.00 0.94 O ATOM 1098 ND2 ASN A 140 3.911 -10.646 4.541 1.00 0.88 N ATOM 0 H ASN A 140 7.810 -7.563 3.867 1.00 0.51 H new ATOM 0 HA ASN A 140 7.768 -9.971 5.590 1.00 0.34 H new ATOM 0 HB2 ASN A 140 5.669 -8.740 5.891 1.00 0.37 H new ATOM 0 HB3 ASN A 140 5.439 -8.661 4.156 1.00 0.37 H new ATOM 0 HD21 ASN A 140 3.392 -11.524 4.537 1.00 0.88 H new ATOM 0 HD22 ASN A 140 3.470 -9.792 4.200 1.00 0.88 H new ATOM 1105 N GLN A 141 8.697 -10.932 3.453 1.00 0.35 N ATOM 1106 CA GLN A 141 9.190 -11.554 2.240 1.00 0.32 C ATOM 1107 C GLN A 141 8.398 -12.807 1.898 1.00 0.30 C ATOM 1108 O GLN A 141 8.550 -13.850 2.536 1.00 0.36 O ATOM 1109 CB GLN A 141 10.680 -11.869 2.393 1.00 0.39 C ATOM 1110 CG GLN A 141 11.276 -12.667 1.247 1.00 0.39 C ATOM 1111 CD GLN A 141 12.728 -12.317 1.000 1.00 0.52 C ATOM 1112 OE1 GLN A 141 13.632 -12.882 1.613 1.00 0.69 O ATOM 1113 NE2 GLN A 141 12.962 -11.389 0.086 1.00 0.63 N ATOM 0 H GLN A 141 9.215 -11.182 4.295 1.00 0.35 H new ATOM 0 HA GLN A 141 9.059 -10.856 1.413 1.00 0.32 H new ATOM 0 HB2 GLN A 141 11.228 -10.932 2.490 1.00 0.39 H new ATOM 0 HB3 GLN A 141 10.828 -12.423 3.320 1.00 0.39 H new ATOM 0 HG2 GLN A 141 11.193 -13.732 1.466 1.00 0.39 H new ATOM 0 HG3 GLN A 141 10.700 -12.482 0.340 1.00 0.39 H new ATOM 0 HE21 GLN A 141 12.183 -10.944 -0.400 1.00 0.63 H new ATOM 0 HE22 GLN A 141 13.921 -11.119 -0.132 1.00 0.63 H new ATOM 1122 N ILE A 142 7.524 -12.683 0.910 1.00 0.25 N ATOM 1123 CA ILE A 142 6.815 -13.833 0.372 1.00 0.27 C ATOM 1124 C ILE A 142 7.643 -14.470 -0.735 1.00 0.30 C ATOM 1125 O ILE A 142 7.481 -15.645 -1.060 1.00 0.37 O ATOM 1126 CB ILE A 142 5.413 -13.462 -0.169 1.00 0.27 C ATOM 1127 CG1 ILE A 142 5.503 -12.410 -1.282 1.00 0.24 C ATOM 1128 CG2 ILE A 142 4.532 -12.958 0.967 1.00 0.29 C ATOM 1129 CD1 ILE A 142 4.195 -12.185 -2.009 1.00 0.26 C ATOM 0 H ILE A 142 7.289 -11.796 0.465 1.00 0.25 H new ATOM 0 HA ILE A 142 6.670 -14.540 1.189 1.00 0.27 H new ATOM 0 HB ILE A 142 4.967 -14.360 -0.596 1.00 0.27 H new ATOM 0 HG12 ILE A 142 5.837 -11.466 -0.852 1.00 0.24 H new ATOM 0 HG13 ILE A 142 6.261 -12.719 -2.002 1.00 0.24 H new ATOM 0 HG21 ILE A 142 3.548 -12.699 0.577 1.00 0.29 H new ATOM 0 HG22 ILE A 142 4.430 -13.738 1.722 1.00 0.29 H new ATOM 0 HG23 ILE A 142 4.987 -12.076 1.417 1.00 0.29 H new ATOM 0 HD11 ILE A 142 4.334 -11.429 -2.782 1.00 0.26 H new ATOM 0 HD12 ILE A 142 3.869 -13.118 -2.469 1.00 0.26 H new ATOM 0 HD13 ILE A 142 3.439 -11.846 -1.301 1.00 0.26 H new ATOM 1141 N GLY A 143 8.542 -13.674 -1.297 1.00 0.28 N ATOM 1142 CA GLY A 143 9.464 -14.158 -2.295 1.00 0.34 C ATOM 1143 C GLY A 143 10.741 -13.350 -2.274 1.00 0.40 C ATOM 1144 O GLY A 143 10.749 -12.225 -1.774 1.00 0.53 O ATOM 0 H GLY A 143 8.646 -12.685 -1.072 1.00 0.28 H new ATOM 0 HA2 GLY A 143 9.689 -15.209 -2.112 1.00 0.34 H new ATOM 0 HA3 GLY A 143 9.005 -14.098 -3.282 1.00 0.34 H new ATOM 1148 N ASP A 144 11.812 -13.908 -2.819 1.00 0.48 N ATOM 1149 CA ASP A 144 13.122 -13.259 -2.788 1.00 0.56 C ATOM 1150 C ASP A 144 13.065 -11.859 -3.391 1.00 0.48 C ATOM 1151 O ASP A 144 13.742 -10.939 -2.926 1.00 0.56 O ATOM 1152 CB ASP A 144 14.155 -14.104 -3.534 1.00 0.70 C ATOM 1153 CG ASP A 144 15.498 -13.412 -3.623 1.00 1.63 C ATOM 1154 OD1 ASP A 144 16.228 -13.389 -2.611 1.00 2.49 O ATOM 1155 OD2 ASP A 144 15.831 -12.886 -4.706 1.00 2.30 O ATOM 0 H ASP A 144 11.803 -14.812 -3.291 1.00 0.48 H new ATOM 0 HA ASP A 144 13.420 -13.168 -1.743 1.00 0.56 H new ATOM 0 HB2 ASP A 144 14.274 -15.062 -3.027 1.00 0.70 H new ATOM 0 HB3 ASP A 144 13.790 -14.318 -4.539 1.00 0.70 H new ATOM 1160 N SER A 145 12.243 -11.693 -4.410 1.00 0.38 N ATOM 1161 CA SER A 145 12.106 -10.406 -5.060 1.00 0.35 C ATOM 1162 C SER A 145 10.696 -9.855 -4.896 1.00 0.31 C ATOM 1163 O SER A 145 10.276 -8.972 -5.640 1.00 0.36 O ATOM 1164 CB SER A 145 12.464 -10.522 -6.538 1.00 0.38 C ATOM 1165 OG SER A 145 13.776 -11.039 -6.697 1.00 1.08 O ATOM 0 H SER A 145 11.662 -12.433 -4.804 1.00 0.38 H new ATOM 0 HA SER A 145 12.796 -9.709 -4.583 1.00 0.35 H new ATOM 0 HB2 SER A 145 11.748 -11.172 -7.041 1.00 0.38 H new ATOM 0 HB3 SER A 145 12.393 -9.543 -7.012 1.00 0.38 H new ATOM 0 HG SER A 145 13.987 -11.108 -7.652 1.00 1.08 H new ATOM 1171 N LEU A 146 9.977 -10.344 -3.894 1.00 0.27 N ATOM 1172 CA LEU A 146 8.592 -9.960 -3.715 1.00 0.22 C ATOM 1173 C LEU A 146 8.240 -9.830 -2.234 1.00 0.21 C ATOM 1174 O LEU A 146 8.385 -10.777 -1.460 1.00 0.23 O ATOM 1175 CB LEU A 146 7.691 -10.994 -4.382 1.00 0.23 C ATOM 1176 CG LEU A 146 6.372 -10.454 -4.921 1.00 0.23 C ATOM 1177 CD1 LEU A 146 6.622 -9.495 -6.075 1.00 0.26 C ATOM 1178 CD2 LEU A 146 5.471 -11.594 -5.358 1.00 0.27 C ATOM 0 H LEU A 146 10.331 -11.002 -3.200 1.00 0.27 H new ATOM 0 HA LEU A 146 8.439 -8.986 -4.179 1.00 0.22 H new ATOM 0 HB2 LEU A 146 8.240 -11.454 -5.204 1.00 0.23 H new ATOM 0 HB3 LEU A 146 7.475 -11.783 -3.662 1.00 0.23 H new ATOM 0 HG LEU A 146 5.870 -9.907 -4.123 1.00 0.23 H new ATOM 0 HD11 LEU A 146 5.670 -9.119 -6.448 1.00 0.26 H new ATOM 0 HD12 LEU A 146 7.232 -8.660 -5.729 1.00 0.26 H new ATOM 0 HD13 LEU A 146 7.144 -10.018 -6.876 1.00 0.26 H new ATOM 0 HD21 LEU A 146 4.533 -11.191 -5.740 1.00 0.27 H new ATOM 0 HD22 LEU A 146 5.965 -12.168 -6.142 1.00 0.27 H new ATOM 0 HD23 LEU A 146 5.266 -12.243 -4.507 1.00 0.27 H new ATOM 1190 N TYR A 147 7.787 -8.649 -1.848 1.00 0.18 N ATOM 1191 CA TYR A 147 7.360 -8.394 -0.480 1.00 0.18 C ATOM 1192 C TYR A 147 5.880 -8.071 -0.470 1.00 0.16 C ATOM 1193 O TYR A 147 5.362 -7.515 -1.431 1.00 0.19 O ATOM 1194 CB TYR A 147 8.160 -7.241 0.136 1.00 0.19 C ATOM 1195 CG TYR A 147 9.582 -7.607 0.505 1.00 0.23 C ATOM 1196 CD1 TYR A 147 9.962 -7.747 1.835 1.00 1.21 C ATOM 1197 CD2 TYR A 147 10.544 -7.818 -0.474 1.00 1.10 C ATOM 1198 CE1 TYR A 147 11.258 -8.084 2.176 1.00 1.24 C ATOM 1199 CE2 TYR A 147 11.840 -8.156 -0.140 1.00 1.10 C ATOM 1200 CZ TYR A 147 12.191 -8.289 1.184 1.00 0.36 C ATOM 1201 OH TYR A 147 13.482 -8.626 1.515 1.00 0.43 O ATOM 0 H TYR A 147 7.705 -7.844 -2.469 1.00 0.18 H new ATOM 0 HA TYR A 147 7.542 -9.286 0.120 1.00 0.18 H new ATOM 0 HB2 TYR A 147 8.181 -6.410 -0.569 1.00 0.19 H new ATOM 0 HB3 TYR A 147 7.643 -6.890 1.029 1.00 0.19 H new ATOM 0 HD1 TYR A 147 9.232 -7.590 2.615 1.00 1.21 H new ATOM 0 HD2 TYR A 147 10.274 -7.716 -1.515 1.00 1.10 H new ATOM 0 HE1 TYR A 147 11.538 -8.186 3.214 1.00 1.24 H new ATOM 0 HE2 TYR A 147 12.576 -8.315 -0.915 1.00 1.10 H new ATOM 0 HH TYR A 147 14.011 -8.735 0.698 1.00 0.43 H new ATOM 1211 N LYS A 148 5.194 -8.419 0.601 1.00 0.17 N ATOM 1212 CA LYS A 148 3.752 -8.252 0.643 1.00 0.18 C ATOM 1213 C LYS A 148 3.287 -7.742 1.998 1.00 0.19 C ATOM 1214 O LYS A 148 3.697 -8.247 3.041 1.00 0.28 O ATOM 1215 CB LYS A 148 3.074 -9.579 0.315 1.00 0.26 C ATOM 1216 CG LYS A 148 1.558 -9.519 0.277 1.00 0.34 C ATOM 1217 CD LYS A 148 0.978 -10.865 -0.116 1.00 0.50 C ATOM 1218 CE LYS A 148 -0.538 -10.872 -0.044 1.00 0.62 C ATOM 1219 NZ LYS A 148 -1.093 -12.191 -0.436 1.00 0.84 N ATOM 0 H LYS A 148 5.605 -8.815 1.446 1.00 0.17 H new ATOM 0 HA LYS A 148 3.473 -7.506 -0.101 1.00 0.18 H new ATOM 0 HB2 LYS A 148 3.435 -9.928 -0.652 1.00 0.26 H new ATOM 0 HB3 LYS A 148 3.377 -10.320 1.055 1.00 0.26 H new ATOM 0 HG2 LYS A 148 1.176 -9.224 1.254 1.00 0.34 H new ATOM 0 HG3 LYS A 148 1.237 -8.757 -0.434 1.00 0.34 H new ATOM 0 HD2 LYS A 148 1.294 -11.115 -1.129 1.00 0.50 H new ATOM 0 HD3 LYS A 148 1.376 -11.638 0.542 1.00 0.50 H new ATOM 0 HE2 LYS A 148 -0.857 -10.628 0.969 1.00 0.62 H new ATOM 0 HE3 LYS A 148 -0.938 -10.098 -0.699 1.00 0.62 H new ATOM 0 HZ1 LYS A 148 -2.131 -12.163 -0.376 1.00 0.84 H new ATOM 0 HZ2 LYS A 148 -0.808 -12.411 -1.412 1.00 0.84 H new ATOM 0 HZ3 LYS A 148 -0.729 -12.925 0.205 1.00 0.84 H new ATOM 1233 N ILE A 149 2.420 -6.747 1.968 1.00 0.15 N ATOM 1234 CA ILE A 149 1.880 -6.153 3.175 1.00 0.18 C ATOM 1235 C ILE A 149 0.380 -6.380 3.252 1.00 0.22 C ATOM 1236 O ILE A 149 -0.325 -6.243 2.255 1.00 0.35 O ATOM 1237 CB ILE A 149 2.184 -4.642 3.248 1.00 0.18 C ATOM 1238 CG1 ILE A 149 1.787 -3.933 1.944 1.00 0.19 C ATOM 1239 CG2 ILE A 149 3.655 -4.431 3.544 1.00 0.19 C ATOM 1240 CD1 ILE A 149 2.075 -2.447 1.938 1.00 0.20 C ATOM 0 H ILE A 149 2.071 -6.328 1.106 1.00 0.15 H new ATOM 0 HA ILE A 149 2.363 -6.638 4.023 1.00 0.18 H new ATOM 0 HB ILE A 149 1.592 -4.207 4.053 1.00 0.18 H new ATOM 0 HG12 ILE A 149 2.317 -4.399 1.113 1.00 0.19 H new ATOM 0 HG13 ILE A 149 0.722 -4.087 1.769 1.00 0.19 H new ATOM 0 HG21 ILE A 149 3.866 -3.363 3.595 1.00 0.19 H new ATOM 0 HG22 ILE A 149 3.905 -4.896 4.498 1.00 0.19 H new ATOM 0 HG23 ILE A 149 4.254 -4.882 2.753 1.00 0.19 H new ATOM 0 HD11 ILE A 149 1.766 -2.020 0.984 1.00 0.20 H new ATOM 0 HD12 ILE A 149 1.523 -1.966 2.746 1.00 0.20 H new ATOM 0 HD13 ILE A 149 3.143 -2.283 2.080 1.00 0.20 H new ATOM 1252 N GLU A 150 -0.097 -6.744 4.431 1.00 0.24 N ATOM 1253 CA GLU A 150 -1.508 -7.030 4.630 1.00 0.27 C ATOM 1254 C GLU A 150 -2.046 -6.267 5.829 1.00 0.24 C ATOM 1255 O GLU A 150 -1.326 -6.022 6.801 1.00 0.31 O ATOM 1256 CB GLU A 150 -1.733 -8.528 4.842 1.00 0.40 C ATOM 1257 CG GLU A 150 -1.301 -9.397 3.672 1.00 1.08 C ATOM 1258 CD GLU A 150 -1.651 -10.856 3.871 1.00 1.55 C ATOM 1259 OE1 GLU A 150 -2.779 -11.257 3.520 1.00 2.03 O ATOM 1260 OE2 GLU A 150 -0.796 -11.614 4.374 1.00 2.30 O ATOM 0 H GLU A 150 0.476 -6.849 5.269 1.00 0.24 H new ATOM 0 HA GLU A 150 -2.040 -6.712 3.734 1.00 0.27 H new ATOM 0 HB2 GLU A 150 -1.190 -8.843 5.733 1.00 0.40 H new ATOM 0 HB3 GLU A 150 -2.792 -8.701 5.036 1.00 0.40 H new ATOM 0 HG2 GLU A 150 -1.775 -9.034 2.760 1.00 1.08 H new ATOM 0 HG3 GLU A 150 -0.224 -9.301 3.531 1.00 1.08 H new ATOM 1267 N THR A 151 -3.311 -5.888 5.747 1.00 0.21 N ATOM 1268 CA THR A 151 -3.984 -5.225 6.844 1.00 0.23 C ATOM 1269 C THR A 151 -4.307 -6.226 7.946 1.00 0.24 C ATOM 1270 O THR A 151 -4.758 -7.340 7.673 1.00 0.27 O ATOM 1271 CB THR A 151 -5.281 -4.559 6.358 1.00 0.25 C ATOM 1272 OG1 THR A 151 -6.134 -5.538 5.756 1.00 0.25 O ATOM 1273 CG2 THR A 151 -4.977 -3.464 5.351 1.00 0.29 C ATOM 0 H THR A 151 -3.894 -6.032 4.923 1.00 0.21 H new ATOM 0 HA THR A 151 -3.318 -4.457 7.239 1.00 0.23 H new ATOM 0 HB THR A 151 -5.783 -4.115 7.218 1.00 0.25 H new ATOM 0 HG1 THR A 151 -6.929 -5.666 6.314 1.00 0.25 H new ATOM 0 HG21 THR A 151 -5.909 -3.005 5.020 1.00 0.29 H new ATOM 0 HG22 THR A 151 -4.345 -2.707 5.816 1.00 0.29 H new ATOM 0 HG23 THR A 151 -4.458 -3.892 4.493 1.00 0.29 H new ATOM 1281 N LYS A 152 -4.075 -5.818 9.187 1.00 0.31 N ATOM 1282 CA LYS A 152 -4.253 -6.693 10.342 1.00 0.38 C ATOM 1283 C LYS A 152 -5.729 -7.020 10.574 1.00 0.39 C ATOM 1284 O LYS A 152 -6.063 -7.993 11.251 1.00 0.51 O ATOM 1285 CB LYS A 152 -3.655 -6.023 11.582 1.00 0.48 C ATOM 1286 CG LYS A 152 -3.649 -6.893 12.829 1.00 0.80 C ATOM 1287 CD LYS A 152 -2.974 -6.177 13.982 1.00 1.02 C ATOM 1288 CE LYS A 152 -2.898 -7.045 15.227 1.00 1.99 C ATOM 1289 NZ LYS A 152 -2.196 -6.348 16.338 1.00 2.42 N ATOM 0 H LYS A 152 -3.760 -4.877 9.422 1.00 0.31 H new ATOM 0 HA LYS A 152 -3.736 -7.633 10.147 1.00 0.38 H new ATOM 0 HB2 LYS A 152 -2.631 -5.723 11.359 1.00 0.48 H new ATOM 0 HB3 LYS A 152 -4.215 -5.112 11.793 1.00 0.48 H new ATOM 0 HG2 LYS A 152 -4.672 -7.150 13.104 1.00 0.80 H new ATOM 0 HG3 LYS A 152 -3.130 -7.829 12.622 1.00 0.80 H new ATOM 0 HD2 LYS A 152 -1.968 -5.881 13.685 1.00 1.02 H new ATOM 0 HD3 LYS A 152 -3.521 -5.263 14.211 1.00 1.02 H new ATOM 0 HE2 LYS A 152 -3.905 -7.315 15.545 1.00 1.99 H new ATOM 0 HE3 LYS A 152 -2.378 -7.974 14.993 1.00 1.99 H new ATOM 0 HZ1 LYS A 152 -2.162 -6.969 17.171 1.00 2.42 H new ATOM 0 HZ2 LYS A 152 -1.227 -6.112 16.043 1.00 2.42 H new ATOM 0 HZ3 LYS A 152 -2.707 -5.475 16.578 1.00 2.42 H new ATOM 1303 N LYS A 153 -6.608 -6.213 10.005 1.00 0.37 N ATOM 1304 CA LYS A 153 -8.038 -6.409 10.169 1.00 0.43 C ATOM 1305 C LYS A 153 -8.771 -6.123 8.865 1.00 0.40 C ATOM 1306 O LYS A 153 -8.296 -5.344 8.037 1.00 0.40 O ATOM 1307 CB LYS A 153 -8.571 -5.504 11.286 1.00 0.51 C ATOM 1308 CG LYS A 153 -8.440 -4.013 11.004 1.00 0.57 C ATOM 1309 CD LYS A 153 -8.931 -3.188 12.181 1.00 0.66 C ATOM 1310 CE LYS A 153 -8.867 -1.697 11.892 1.00 0.69 C ATOM 1311 NZ LYS A 153 -9.307 -0.889 13.060 1.00 1.29 N ATOM 0 H LYS A 153 -6.355 -5.414 9.424 1.00 0.37 H new ATOM 0 HA LYS A 153 -8.215 -7.449 10.443 1.00 0.43 H new ATOM 0 HB2 LYS A 153 -9.622 -5.738 11.456 1.00 0.51 H new ATOM 0 HB3 LYS A 153 -8.039 -5.735 12.209 1.00 0.51 H new ATOM 0 HG2 LYS A 153 -7.398 -3.770 10.795 1.00 0.57 H new ATOM 0 HG3 LYS A 153 -9.012 -3.757 10.112 1.00 0.57 H new ATOM 0 HD2 LYS A 153 -9.957 -3.468 12.418 1.00 0.66 H new ATOM 0 HD3 LYS A 153 -8.327 -3.414 13.060 1.00 0.66 H new ATOM 0 HE2 LYS A 153 -7.847 -1.422 11.623 1.00 0.69 H new ATOM 0 HE3 LYS A 153 -9.496 -1.466 11.032 1.00 0.69 H new ATOM 0 HZ1 LYS A 153 -9.249 0.122 12.824 1.00 1.29 H new ATOM 0 HZ2 LYS A 153 -10.289 -1.133 13.301 1.00 1.29 H new ATOM 0 HZ3 LYS A 153 -8.691 -1.090 13.873 1.00 1.29 H new ATOM 1325 N LYS A 154 -9.915 -6.774 8.683 1.00 0.43 N ATOM 1326 CA LYS A 154 -10.765 -6.525 7.527 1.00 0.44 C ATOM 1327 C LYS A 154 -11.348 -5.123 7.621 1.00 0.53 C ATOM 1328 O LYS A 154 -11.676 -4.652 8.713 1.00 0.67 O ATOM 1329 CB LYS A 154 -11.891 -7.560 7.452 1.00 0.44 C ATOM 1330 CG LYS A 154 -11.398 -8.989 7.275 1.00 0.47 C ATOM 1331 CD LYS A 154 -12.555 -9.969 7.187 1.00 0.54 C ATOM 1332 CE LYS A 154 -12.062 -11.394 6.998 1.00 0.66 C ATOM 1333 NZ LYS A 154 -13.184 -12.365 6.909 1.00 1.41 N ATOM 0 H LYS A 154 -10.275 -7.480 9.325 1.00 0.43 H new ATOM 0 HA LYS A 154 -10.164 -6.609 6.621 1.00 0.44 H new ATOM 0 HB2 LYS A 154 -12.488 -7.501 8.362 1.00 0.44 H new ATOM 0 HB3 LYS A 154 -12.550 -7.307 6.622 1.00 0.44 H new ATOM 0 HG2 LYS A 154 -10.792 -9.057 6.371 1.00 0.47 H new ATOM 0 HG3 LYS A 154 -10.754 -9.259 8.112 1.00 0.47 H new ATOM 0 HD2 LYS A 154 -13.156 -9.908 8.095 1.00 0.54 H new ATOM 0 HD3 LYS A 154 -13.204 -9.694 6.356 1.00 0.54 H new ATOM 0 HE2 LYS A 154 -11.460 -11.452 6.091 1.00 0.66 H new ATOM 0 HE3 LYS A 154 -11.412 -11.666 7.830 1.00 0.66 H new ATOM 0 HZ1 LYS A 154 -12.804 -13.324 6.780 1.00 1.41 H new ATOM 0 HZ2 LYS A 154 -13.744 -12.329 7.784 1.00 1.41 H new ATOM 0 HZ3 LYS A 154 -13.790 -12.122 6.100 1.00 1.41 H new ATOM 1347 N MET A 155 -11.476 -4.462 6.486 1.00 0.61 N ATOM 1348 CA MET A 155 -11.860 -3.061 6.474 1.00 0.76 C ATOM 1349 C MET A 155 -13.351 -2.875 6.261 1.00 0.62 C ATOM 1350 O MET A 155 -14.007 -3.668 5.583 1.00 0.57 O ATOM 1351 CB MET A 155 -11.068 -2.316 5.403 1.00 1.01 C ATOM 1352 CG MET A 155 -9.589 -2.258 5.720 1.00 1.22 C ATOM 1353 SD MET A 155 -9.274 -1.487 7.315 1.00 0.95 S ATOM 1354 CE MET A 155 -7.633 -2.100 7.659 1.00 0.80 C ATOM 0 H MET A 155 -11.321 -4.869 5.564 1.00 0.61 H new ATOM 0 HA MET A 155 -11.626 -2.645 7.454 1.00 0.76 H new ATOM 0 HB2 MET A 155 -11.212 -2.806 4.440 1.00 1.01 H new ATOM 0 HB3 MET A 155 -11.457 -1.302 5.306 1.00 1.01 H new ATOM 0 HG2 MET A 155 -9.177 -3.267 5.717 1.00 1.22 H new ATOM 0 HG3 MET A 155 -9.072 -1.701 4.939 1.00 1.22 H new ATOM 0 HE1 MET A 155 -7.642 -2.660 8.594 1.00 0.80 H new ATOM 0 HE2 MET A 155 -7.311 -2.753 6.848 1.00 0.80 H new ATOM 0 HE3 MET A 155 -6.942 -1.261 7.745 1.00 0.80 H new ATOM 1364 N LYS A 156 -13.870 -1.820 6.875 1.00 0.65 N ATOM 1365 CA LYS A 156 -15.268 -1.437 6.743 1.00 0.59 C ATOM 1366 C LYS A 156 -15.489 -0.762 5.390 1.00 0.44 C ATOM 1367 O LYS A 156 -14.523 -0.343 4.756 1.00 0.42 O ATOM 1368 CB LYS A 156 -15.641 -0.488 7.889 1.00 0.72 C ATOM 1369 CG LYS A 156 -15.488 -1.108 9.268 1.00 1.28 C ATOM 1370 CD LYS A 156 -15.882 -0.129 10.361 1.00 1.79 C ATOM 1371 CE LYS A 156 -15.710 -0.730 11.746 1.00 2.54 C ATOM 1372 NZ LYS A 156 -14.293 -1.082 12.036 1.00 3.40 N ATOM 0 H LYS A 156 -13.330 -1.203 7.482 1.00 0.65 H new ATOM 0 HA LYS A 156 -15.903 -2.321 6.796 1.00 0.59 H new ATOM 0 HB2 LYS A 156 -15.016 0.403 7.829 1.00 0.72 H new ATOM 0 HB3 LYS A 156 -16.673 -0.163 7.759 1.00 0.72 H new ATOM 0 HG2 LYS A 156 -16.107 -2.002 9.338 1.00 1.28 H new ATOM 0 HG3 LYS A 156 -14.455 -1.423 9.415 1.00 1.28 H new ATOM 0 HD2 LYS A 156 -15.275 0.772 10.278 1.00 1.79 H new ATOM 0 HD3 LYS A 156 -16.920 0.172 10.222 1.00 1.79 H new ATOM 0 HE2 LYS A 156 -16.067 -0.022 12.494 1.00 2.54 H new ATOM 0 HE3 LYS A 156 -16.329 -1.623 11.832 1.00 2.54 H new ATOM 0 HZ1 LYS A 156 -14.188 -1.295 13.049 1.00 3.40 H new ATOM 0 HZ2 LYS A 156 -14.021 -1.916 11.477 1.00 3.40 H new ATOM 0 HZ3 LYS A 156 -13.678 -0.282 11.785 1.00 3.40 H new ATOM 1386 N PRO A 157 -16.749 -0.655 4.924 1.00 0.46 N ATOM 1387 CA PRO A 157 -17.072 -0.047 3.627 1.00 0.41 C ATOM 1388 C PRO A 157 -16.413 1.318 3.415 1.00 0.37 C ATOM 1389 O PRO A 157 -16.534 2.219 4.249 1.00 0.46 O ATOM 1390 CB PRO A 157 -18.602 0.096 3.651 1.00 0.52 C ATOM 1391 CG PRO A 157 -19.016 -0.218 5.051 1.00 0.63 C ATOM 1392 CD PRO A 157 -17.961 -1.131 5.600 1.00 0.63 C ATOM 0 HA PRO A 157 -16.700 -0.662 2.808 1.00 0.41 H new ATOM 0 HB2 PRO A 157 -18.905 1.105 3.370 1.00 0.52 H new ATOM 0 HB3 PRO A 157 -19.070 -0.587 2.942 1.00 0.52 H new ATOM 0 HG2 PRO A 157 -19.094 0.691 5.648 1.00 0.63 H new ATOM 0 HG3 PRO A 157 -19.995 -0.697 5.070 1.00 0.63 H new ATOM 0 HD2 PRO A 157 -17.879 -1.052 6.684 1.00 0.63 H new ATOM 0 HD3 PRO A 157 -18.170 -2.176 5.372 1.00 0.63 H new ATOM 1400 N GLY A 158 -15.714 1.457 2.295 1.00 0.32 N ATOM 1401 CA GLY A 158 -15.062 2.711 1.973 1.00 0.33 C ATOM 1402 C GLY A 158 -13.998 2.544 0.907 1.00 0.27 C ATOM 1403 O GLY A 158 -13.882 1.477 0.302 1.00 0.27 O ATOM 0 H GLY A 158 -15.587 0.720 1.602 1.00 0.32 H new ATOM 0 HA2 GLY A 158 -15.807 3.429 1.631 1.00 0.33 H new ATOM 0 HA3 GLY A 158 -14.610 3.126 2.874 1.00 0.33 H new ATOM 1407 N ILE A 159 -13.216 3.593 0.681 1.00 0.29 N ATOM 1408 CA ILE A 159 -12.153 3.559 -0.316 1.00 0.26 C ATOM 1409 C ILE A 159 -10.805 3.504 0.385 1.00 0.21 C ATOM 1410 O ILE A 159 -10.565 4.263 1.320 1.00 0.24 O ATOM 1411 CB ILE A 159 -12.187 4.802 -1.230 1.00 0.30 C ATOM 1412 CG1 ILE A 159 -13.606 5.045 -1.757 1.00 0.40 C ATOM 1413 CG2 ILE A 159 -11.202 4.639 -2.381 1.00 0.29 C ATOM 1414 CD1 ILE A 159 -13.729 6.265 -2.643 1.00 0.44 C ATOM 0 H ILE A 159 -13.299 4.481 1.177 1.00 0.29 H new ATOM 0 HA ILE A 159 -12.304 2.674 -0.933 1.00 0.26 H new ATOM 0 HB ILE A 159 -11.890 5.672 -0.645 1.00 0.30 H new ATOM 0 HG12 ILE A 159 -13.931 4.168 -2.316 1.00 0.40 H new ATOM 0 HG13 ILE A 159 -14.284 5.153 -0.911 1.00 0.40 H new ATOM 0 HG21 ILE A 159 -11.237 5.523 -3.018 1.00 0.29 H new ATOM 0 HG22 ILE A 159 -10.194 4.518 -1.983 1.00 0.29 H new ATOM 0 HG23 ILE A 159 -11.469 3.759 -2.967 1.00 0.29 H new ATOM 0 HD11 ILE A 159 -14.761 6.370 -2.976 1.00 0.44 H new ATOM 0 HD12 ILE A 159 -13.436 7.153 -2.082 1.00 0.44 H new ATOM 0 HD13 ILE A 159 -13.078 6.152 -3.510 1.00 0.44 H new ATOM 1426 N TYR A 160 -9.933 2.606 -0.042 1.00 0.18 N ATOM 1427 CA TYR A 160 -8.648 2.443 0.621 1.00 0.17 C ATOM 1428 C TYR A 160 -7.517 2.314 -0.388 1.00 0.16 C ATOM 1429 O TYR A 160 -7.723 1.867 -1.516 1.00 0.19 O ATOM 1430 CB TYR A 160 -8.668 1.210 1.529 1.00 0.21 C ATOM 1431 CG TYR A 160 -9.734 1.252 2.605 1.00 0.23 C ATOM 1432 CD1 TYR A 160 -11.023 0.800 2.349 1.00 1.20 C ATOM 1433 CD2 TYR A 160 -9.457 1.745 3.876 1.00 1.24 C ATOM 1434 CE1 TYR A 160 -12.001 0.842 3.321 1.00 1.23 C ATOM 1435 CE2 TYR A 160 -10.434 1.785 4.852 1.00 1.24 C ATOM 1436 CZ TYR A 160 -11.701 1.336 4.569 1.00 0.35 C ATOM 1437 OH TYR A 160 -12.675 1.377 5.538 1.00 0.43 O ATOM 0 H TYR A 160 -10.088 1.984 -0.836 1.00 0.18 H new ATOM 0 HA TYR A 160 -8.473 3.334 1.224 1.00 0.17 H new ATOM 0 HB2 TYR A 160 -8.821 0.322 0.915 1.00 0.21 H new ATOM 0 HB3 TYR A 160 -7.692 1.105 2.003 1.00 0.21 H new ATOM 0 HD1 TYR A 160 -11.263 0.409 1.371 1.00 1.20 H new ATOM 0 HD2 TYR A 160 -8.463 2.102 4.103 1.00 1.24 H new ATOM 0 HE1 TYR A 160 -12.998 0.488 3.103 1.00 1.23 H new ATOM 0 HE2 TYR A 160 -10.202 2.168 5.835 1.00 1.24 H new ATOM 0 HH TYR A 160 -13.475 0.910 5.218 1.00 0.43 H new ATOM 1447 N ALA A 161 -6.330 2.723 0.033 1.00 0.14 N ATOM 1448 CA ALA A 161 -5.125 2.589 -0.767 1.00 0.14 C ATOM 1449 C ALA A 161 -3.904 2.589 0.140 1.00 0.14 C ATOM 1450 O ALA A 161 -3.956 3.097 1.264 1.00 0.14 O ATOM 1451 CB ALA A 161 -5.025 3.714 -1.786 1.00 0.14 C ATOM 0 H ALA A 161 -6.176 3.159 0.942 1.00 0.14 H new ATOM 0 HA ALA A 161 -5.169 1.644 -1.309 1.00 0.14 H new ATOM 0 HB1 ALA A 161 -4.115 3.593 -2.374 1.00 0.14 H new ATOM 0 HB2 ALA A 161 -5.891 3.684 -2.448 1.00 0.14 H new ATOM 0 HB3 ALA A 161 -4.998 4.673 -1.268 1.00 0.14 H new ATOM 1457 N PHE A 162 -2.815 2.020 -0.342 1.00 0.14 N ATOM 1458 CA PHE A 162 -1.588 1.940 0.430 1.00 0.15 C ATOM 1459 C PHE A 162 -0.627 3.044 0.019 1.00 0.15 C ATOM 1460 O PHE A 162 -0.358 3.234 -1.166 1.00 0.15 O ATOM 1461 CB PHE A 162 -0.915 0.576 0.240 1.00 0.17 C ATOM 1462 CG PHE A 162 -1.681 -0.571 0.843 1.00 0.18 C ATOM 1463 CD1 PHE A 162 -2.630 -1.261 0.102 1.00 1.13 C ATOM 1464 CD2 PHE A 162 -1.446 -0.963 2.150 1.00 1.15 C ATOM 1465 CE1 PHE A 162 -3.326 -2.317 0.656 1.00 1.13 C ATOM 1466 CE2 PHE A 162 -2.141 -2.019 2.709 1.00 1.16 C ATOM 1467 CZ PHE A 162 -3.082 -2.696 1.960 1.00 0.24 C ATOM 0 H PHE A 162 -2.755 1.604 -1.271 1.00 0.14 H new ATOM 0 HA PHE A 162 -1.845 2.063 1.482 1.00 0.15 H new ATOM 0 HB2 PHE A 162 -0.784 0.392 -0.826 1.00 0.17 H new ATOM 0 HB3 PHE A 162 0.080 0.608 0.683 1.00 0.17 H new ATOM 0 HD1 PHE A 162 -2.826 -0.969 -0.919 1.00 1.13 H new ATOM 0 HD2 PHE A 162 -0.710 -0.437 2.740 1.00 1.15 H new ATOM 0 HE1 PHE A 162 -4.062 -2.846 0.068 1.00 1.13 H new ATOM 0 HE2 PHE A 162 -1.948 -2.314 3.730 1.00 1.16 H new ATOM 0 HZ PHE A 162 -3.627 -3.521 2.394 1.00 0.24 H new ATOM 1477 N LYS A 163 -0.129 3.776 1.002 1.00 0.16 N ATOM 1478 CA LYS A 163 0.849 4.823 0.755 1.00 0.18 C ATOM 1479 C LYS A 163 2.202 4.400 1.300 1.00 0.20 C ATOM 1480 O LYS A 163 2.441 4.468 2.506 1.00 0.23 O ATOM 1481 CB LYS A 163 0.425 6.145 1.413 1.00 0.23 C ATOM 1482 CG LYS A 163 1.377 7.307 1.118 1.00 0.31 C ATOM 1483 CD LYS A 163 0.954 8.579 1.847 1.00 0.45 C ATOM 1484 CE LYS A 163 1.893 9.747 1.561 1.00 0.74 C ATOM 1485 NZ LYS A 163 3.287 9.480 2.006 1.00 1.28 N ATOM 0 H LYS A 163 -0.387 3.664 1.982 1.00 0.16 H new ATOM 0 HA LYS A 163 0.914 4.979 -0.322 1.00 0.18 H new ATOM 0 HB2 LYS A 163 -0.575 6.409 1.069 1.00 0.23 H new ATOM 0 HB3 LYS A 163 0.363 6.001 2.492 1.00 0.23 H new ATOM 0 HG2 LYS A 163 2.389 7.034 1.418 1.00 0.31 H new ATOM 0 HG3 LYS A 163 1.402 7.494 0.044 1.00 0.31 H new ATOM 0 HD2 LYS A 163 -0.059 8.848 1.547 1.00 0.45 H new ATOM 0 HD3 LYS A 163 0.929 8.389 2.920 1.00 0.45 H new ATOM 0 HE2 LYS A 163 1.891 9.957 0.491 1.00 0.74 H new ATOM 0 HE3 LYS A 163 1.520 10.640 2.062 1.00 0.74 H new ATOM 0 HZ1 LYS A 163 3.628 10.279 2.577 1.00 1.28 H new ATOM 0 HZ2 LYS A 163 3.308 8.612 2.578 1.00 1.28 H new ATOM 0 HZ3 LYS A 163 3.900 9.362 1.174 1.00 1.28 H new ATOM 1499 N VAL A 164 3.071 3.938 0.420 1.00 0.22 N ATOM 1500 CA VAL A 164 4.429 3.613 0.812 1.00 0.26 C ATOM 1501 C VAL A 164 5.330 4.785 0.445 1.00 0.33 C ATOM 1502 O VAL A 164 5.168 5.387 -0.615 1.00 0.34 O ATOM 1503 CB VAL A 164 4.925 2.293 0.159 1.00 0.28 C ATOM 1504 CG1 VAL A 164 3.928 1.173 0.414 1.00 0.27 C ATOM 1505 CG2 VAL A 164 5.175 2.453 -1.334 1.00 0.29 C ATOM 0 H VAL A 164 2.862 3.780 -0.566 1.00 0.22 H new ATOM 0 HA VAL A 164 4.459 3.446 1.889 1.00 0.26 H new ATOM 0 HB VAL A 164 5.878 2.036 0.621 1.00 0.28 H new ATOM 0 HG11 VAL A 164 4.287 0.254 -0.049 1.00 0.27 H new ATOM 0 HG12 VAL A 164 3.819 1.020 1.488 1.00 0.27 H new ATOM 0 HG13 VAL A 164 2.962 1.441 -0.014 1.00 0.27 H new ATOM 0 HG21 VAL A 164 5.520 1.506 -1.749 1.00 0.29 H new ATOM 0 HG22 VAL A 164 4.250 2.750 -1.828 1.00 0.29 H new ATOM 0 HG23 VAL A 164 5.934 3.218 -1.496 1.00 0.29 H new ATOM 1515 N TYR A 165 6.234 5.160 1.334 1.00 0.45 N ATOM 1516 CA TYR A 165 7.053 6.343 1.104 1.00 0.57 C ATOM 1517 C TYR A 165 8.499 6.116 1.518 1.00 0.70 C ATOM 1518 O TYR A 165 9.082 6.925 2.245 1.00 1.67 O ATOM 1519 CB TYR A 165 6.461 7.558 1.834 1.00 0.62 C ATOM 1520 CG TYR A 165 6.097 7.301 3.283 1.00 0.63 C ATOM 1521 CD1 TYR A 165 7.029 7.478 4.299 1.00 1.30 C ATOM 1522 CD2 TYR A 165 4.818 6.885 3.634 1.00 1.38 C ATOM 1523 CE1 TYR A 165 6.700 7.244 5.618 1.00 1.31 C ATOM 1524 CE2 TYR A 165 4.483 6.651 4.953 1.00 1.45 C ATOM 1525 CZ TYR A 165 5.427 6.832 5.939 1.00 0.79 C ATOM 1526 OH TYR A 165 5.096 6.594 7.251 1.00 0.93 O ATOM 0 H TYR A 165 6.420 4.672 2.210 1.00 0.45 H new ATOM 0 HA TYR A 165 7.049 6.544 0.033 1.00 0.57 H new ATOM 0 HB2 TYR A 165 7.179 8.377 1.792 1.00 0.62 H new ATOM 0 HB3 TYR A 165 5.569 7.888 1.301 1.00 0.62 H new ATOM 0 HD1 TYR A 165 8.028 7.804 4.051 1.00 1.30 H new ATOM 0 HD2 TYR A 165 4.075 6.743 2.863 1.00 1.38 H new ATOM 0 HE1 TYR A 165 7.438 7.383 6.395 1.00 1.31 H new ATOM 0 HE2 TYR A 165 3.485 6.328 5.210 1.00 1.45 H new ATOM 0 HH TYR A 165 4.159 6.311 7.306 1.00 0.93 H new ATOM 1536 N LYS A 166 9.073 5.014 1.034 1.00 0.48 N ATOM 1537 CA LYS A 166 10.465 4.673 1.314 1.00 0.49 C ATOM 1538 C LYS A 166 10.626 4.245 2.786 1.00 0.46 C ATOM 1539 O LYS A 166 9.673 4.336 3.563 1.00 0.55 O ATOM 1540 CB LYS A 166 11.380 5.866 0.954 1.00 0.57 C ATOM 1541 CG LYS A 166 11.447 6.173 -0.542 1.00 0.71 C ATOM 1542 CD LYS A 166 12.184 5.080 -1.305 1.00 0.94 C ATOM 1543 CE LYS A 166 12.225 5.354 -2.805 1.00 1.35 C ATOM 1544 NZ LYS A 166 13.035 6.552 -3.146 1.00 1.53 N ATOM 0 H LYS A 166 8.590 4.339 0.442 1.00 0.48 H new ATOM 0 HA LYS A 166 10.764 3.826 0.697 1.00 0.49 H new ATOM 0 HB2 LYS A 166 11.027 6.753 1.480 1.00 0.57 H new ATOM 0 HB3 LYS A 166 12.387 5.660 1.317 1.00 0.57 H new ATOM 0 HG2 LYS A 166 10.437 6.277 -0.939 1.00 0.71 H new ATOM 0 HG3 LYS A 166 11.950 7.128 -0.696 1.00 0.71 H new ATOM 0 HD2 LYS A 166 13.202 4.996 -0.924 1.00 0.94 H new ATOM 0 HD3 LYS A 166 11.697 4.122 -1.125 1.00 0.94 H new ATOM 0 HE2 LYS A 166 12.636 4.484 -3.318 1.00 1.35 H new ATOM 0 HE3 LYS A 166 11.208 5.491 -3.173 1.00 1.35 H new ATOM 0 HZ1 LYS A 166 13.100 6.644 -4.180 1.00 1.53 H new ATOM 0 HZ2 LYS A 166 12.583 7.401 -2.750 1.00 1.53 H new ATOM 0 HZ3 LYS A 166 13.990 6.451 -2.747 1.00 1.53 H new ATOM 1558 N PRO A 167 11.804 3.719 3.182 1.00 0.44 N ATOM 1559 CA PRO A 167 12.064 3.309 4.573 1.00 0.47 C ATOM 1560 C PRO A 167 11.784 4.414 5.585 1.00 0.47 C ATOM 1561 O PRO A 167 11.964 5.600 5.299 1.00 0.50 O ATOM 1562 CB PRO A 167 13.552 2.964 4.560 1.00 0.58 C ATOM 1563 CG PRO A 167 13.806 2.532 3.164 1.00 0.60 C ATOM 1564 CD PRO A 167 12.971 3.443 2.318 1.00 0.49 C ATOM 0 HA PRO A 167 11.415 2.488 4.878 1.00 0.47 H new ATOM 0 HB2 PRO A 167 14.164 3.825 4.829 1.00 0.58 H new ATOM 0 HB3 PRO A 167 13.785 2.172 5.272 1.00 0.58 H new ATOM 0 HG2 PRO A 167 14.863 2.617 2.911 1.00 0.60 H new ATOM 0 HG3 PRO A 167 13.526 1.489 3.016 1.00 0.60 H new ATOM 0 HD2 PRO A 167 13.506 4.356 2.058 1.00 0.49 H new ATOM 0 HD3 PRO A 167 12.677 2.968 1.382 1.00 0.49 H new ATOM 1572 N ALA A 168 11.327 4.011 6.764 1.00 0.53 N ATOM 1573 CA ALA A 168 11.081 4.948 7.850 1.00 0.64 C ATOM 1574 C ALA A 168 12.377 5.652 8.234 1.00 0.71 C ATOM 1575 O ALA A 168 13.352 5.003 8.609 1.00 0.76 O ATOM 1576 CB ALA A 168 10.496 4.227 9.055 1.00 0.72 C ATOM 0 H ALA A 168 11.119 3.039 6.992 1.00 0.53 H new ATOM 0 HA ALA A 168 10.360 5.693 7.512 1.00 0.64 H new ATOM 0 HB1 ALA A 168 10.319 4.944 9.857 1.00 0.72 H new ATOM 0 HB2 ALA A 168 9.554 3.755 8.775 1.00 0.72 H new ATOM 0 HB3 ALA A 168 11.196 3.465 9.398 1.00 0.72 H new ATOM 1582 N GLY A 169 12.394 6.971 8.124 1.00 0.82 N ATOM 1583 CA GLY A 169 13.603 7.716 8.402 1.00 0.95 C ATOM 1584 C GLY A 169 14.186 8.337 7.151 1.00 0.96 C ATOM 1585 O GLY A 169 15.011 9.247 7.230 1.00 1.14 O ATOM 0 H GLY A 169 11.593 7.539 7.847 1.00 0.82 H new ATOM 0 HA2 GLY A 169 13.387 8.499 9.129 1.00 0.95 H new ATOM 0 HA3 GLY A 169 14.341 7.054 8.856 1.00 0.95 H new ATOM 1589 N TYR A 170 13.767 7.837 5.996 1.00 0.80 N ATOM 1590 CA TYR A 170 14.200 8.387 4.721 1.00 0.82 C ATOM 1591 C TYR A 170 13.400 9.656 4.422 1.00 0.86 C ATOM 1592 O TYR A 170 12.168 9.618 4.399 1.00 0.89 O ATOM 1593 CB TYR A 170 13.996 7.350 3.607 1.00 0.83 C ATOM 1594 CG TYR A 170 14.600 7.741 2.268 1.00 0.91 C ATOM 1595 CD1 TYR A 170 13.982 8.681 1.449 1.00 1.15 C ATOM 1596 CD2 TYR A 170 15.783 7.161 1.819 1.00 1.74 C ATOM 1597 CE1 TYR A 170 14.524 9.032 0.229 1.00 1.21 C ATOM 1598 CE2 TYR A 170 16.330 7.512 0.597 1.00 1.82 C ATOM 1599 CZ TYR A 170 15.695 8.445 -0.191 1.00 1.11 C ATOM 1600 OH TYR A 170 16.231 8.795 -1.407 1.00 1.24 O ATOM 0 H TYR A 170 13.125 7.048 5.917 1.00 0.80 H new ATOM 0 HA TYR A 170 15.260 8.636 4.770 1.00 0.82 H new ATOM 0 HB2 TYR A 170 14.431 6.402 3.925 1.00 0.83 H new ATOM 0 HB3 TYR A 170 12.927 7.182 3.475 1.00 0.83 H new ATOM 0 HD1 TYR A 170 13.062 9.144 1.774 1.00 1.15 H new ATOM 0 HD2 TYR A 170 16.282 6.426 2.433 1.00 1.74 H new ATOM 0 HE1 TYR A 170 14.031 9.764 -0.393 1.00 1.21 H new ATOM 0 HE2 TYR A 170 17.250 7.056 0.263 1.00 1.82 H new ATOM 0 HH TYR A 170 17.059 8.292 -1.556 1.00 1.24 H new ATOM 1610 N PRO A 171 14.085 10.794 4.207 1.00 0.97 N ATOM 1611 CA PRO A 171 13.426 12.089 3.977 1.00 1.10 C ATOM 1612 C PRO A 171 12.499 12.087 2.760 1.00 1.07 C ATOM 1613 O PRO A 171 12.831 11.530 1.711 1.00 1.05 O ATOM 1614 CB PRO A 171 14.592 13.063 3.755 1.00 1.25 C ATOM 1615 CG PRO A 171 15.769 12.204 3.435 1.00 1.31 C ATOM 1616 CD PRO A 171 15.554 10.919 4.180 1.00 1.07 C ATOM 0 HA PRO A 171 12.782 12.354 4.816 1.00 1.10 H new ATOM 0 HB2 PRO A 171 14.377 13.754 2.940 1.00 1.25 H new ATOM 0 HB3 PRO A 171 14.775 13.666 4.644 1.00 1.25 H new ATOM 0 HG2 PRO A 171 15.843 12.026 2.362 1.00 1.31 H new ATOM 0 HG3 PRO A 171 16.698 12.684 3.743 1.00 1.31 H new ATOM 0 HD2 PRO A 171 16.022 10.075 3.673 1.00 1.07 H new ATOM 0 HD3 PRO A 171 15.974 10.960 5.185 1.00 1.07 H new ATOM 1624 N ALA A 172 11.339 12.719 2.908 1.00 1.22 N ATOM 1625 CA ALA A 172 10.361 12.796 1.831 1.00 1.31 C ATOM 1626 C ALA A 172 10.743 13.890 0.841 1.00 1.40 C ATOM 1627 O ALA A 172 10.249 15.016 0.918 1.00 1.67 O ATOM 1628 CB ALA A 172 8.968 13.041 2.392 1.00 1.60 C ATOM 0 H ALA A 172 11.053 13.187 3.768 1.00 1.22 H new ATOM 0 HA ALA A 172 10.354 11.843 1.302 1.00 1.31 H new ATOM 0 HB1 ALA A 172 8.250 13.096 1.573 1.00 1.60 H new ATOM 0 HB2 ALA A 172 8.696 12.223 3.059 1.00 1.60 H new ATOM 0 HB3 ALA A 172 8.959 13.980 2.946 1.00 1.60 H new ATOM 1634 N ASN A 173 11.619 13.549 -0.091 1.00 1.38 N ATOM 1635 CA ASN A 173 12.173 14.524 -1.026 1.00 1.53 C ATOM 1636 C ASN A 173 11.232 14.770 -2.211 1.00 1.91 C ATOM 1637 O ASN A 173 11.557 14.462 -3.359 1.00 2.60 O ATOM 1638 CB ASN A 173 13.549 14.061 -1.518 1.00 1.89 C ATOM 1639 CG ASN A 173 14.258 15.110 -2.357 1.00 2.51 C ATOM 1640 OD1 ASN A 173 14.058 16.313 -2.177 1.00 2.97 O ATOM 1641 ND2 ASN A 173 15.099 14.662 -3.273 1.00 3.18 N ATOM 0 H ASN A 173 11.965 12.599 -0.223 1.00 1.38 H new ATOM 0 HA ASN A 173 12.285 15.470 -0.496 1.00 1.53 H new ATOM 0 HB2 ASN A 173 14.171 13.808 -0.659 1.00 1.89 H new ATOM 0 HB3 ASN A 173 13.432 13.150 -2.106 1.00 1.89 H new ATOM 0 HD21 ASN A 173 15.610 15.320 -3.862 1.00 3.18 H new ATOM 0 HD22 ASN A 173 15.237 13.658 -3.391 1.00 3.18 H new ATOM 1648 N GLY A 174 10.049 15.282 -1.908 1.00 2.02 N ATOM 1649 CA GLY A 174 9.145 15.786 -2.933 1.00 2.69 C ATOM 1650 C GLY A 174 8.329 14.716 -3.641 1.00 2.26 C ATOM 1651 O GLY A 174 7.209 14.984 -4.078 1.00 2.93 O ATOM 0 H GLY A 174 9.690 15.360 -0.956 1.00 2.02 H new ATOM 0 HA2 GLY A 174 8.462 16.502 -2.476 1.00 2.69 H new ATOM 0 HA3 GLY A 174 9.727 16.331 -3.676 1.00 2.69 H new ATOM 1655 N SER A 175 8.864 13.511 -3.753 1.00 1.44 N ATOM 1656 CA SER A 175 8.169 12.442 -4.456 1.00 1.23 C ATOM 1657 C SER A 175 8.712 11.072 -4.069 1.00 0.94 C ATOM 1658 O SER A 175 9.071 10.262 -4.926 1.00 1.36 O ATOM 1659 CB SER A 175 8.277 12.656 -5.968 1.00 1.79 C ATOM 1660 OG SER A 175 9.622 12.886 -6.359 1.00 2.26 O ATOM 0 H SER A 175 9.772 13.248 -3.369 1.00 1.44 H new ATOM 0 HA SER A 175 7.119 12.471 -4.165 1.00 1.23 H new ATOM 0 HB2 SER A 175 7.888 11.782 -6.490 1.00 1.79 H new ATOM 0 HB3 SER A 175 7.660 13.504 -6.263 1.00 1.79 H new ATOM 0 HG SER A 175 9.663 13.018 -7.329 1.00 2.26 H new ATOM 1666 N THR A 176 8.770 10.813 -2.773 1.00 0.64 N ATOM 1667 CA THR A 176 9.216 9.522 -2.273 1.00 0.90 C ATOM 1668 C THR A 176 8.033 8.596 -2.020 1.00 0.80 C ATOM 1669 O THR A 176 8.197 7.482 -1.527 1.00 1.05 O ATOM 1670 CB THR A 176 10.018 9.682 -0.970 1.00 1.30 C ATOM 1671 OG1 THR A 176 9.351 10.604 -0.101 1.00 1.49 O ATOM 1672 CG2 THR A 176 11.429 10.167 -1.257 1.00 1.76 C ATOM 0 H THR A 176 8.513 11.481 -2.046 1.00 0.64 H new ATOM 0 HA THR A 176 9.858 9.084 -3.037 1.00 0.90 H new ATOM 0 HB THR A 176 10.084 8.709 -0.484 1.00 1.30 H new ATOM 0 HG1 THR A 176 9.220 10.189 0.777 1.00 1.49 H new ATOM 0 HG21 THR A 176 11.975 10.272 -0.320 1.00 1.76 H new ATOM 0 HG22 THR A 176 11.939 9.445 -1.895 1.00 1.76 H new ATOM 0 HG23 THR A 176 11.386 11.132 -1.762 1.00 1.76 H new ATOM 1680 N PHE A 177 6.843 9.064 -2.367 1.00 0.52 N ATOM 1681 CA PHE A 177 5.625 8.316 -2.098 1.00 0.45 C ATOM 1682 C PHE A 177 5.211 7.487 -3.307 1.00 0.41 C ATOM 1683 O PHE A 177 5.517 7.836 -4.450 1.00 0.50 O ATOM 1684 CB PHE A 177 4.482 9.266 -1.700 1.00 0.49 C ATOM 1685 CG PHE A 177 4.149 10.302 -2.747 1.00 0.55 C ATOM 1686 CD1 PHE A 177 4.786 11.534 -2.752 1.00 1.37 C ATOM 1687 CD2 PHE A 177 3.193 10.047 -3.722 1.00 1.31 C ATOM 1688 CE1 PHE A 177 4.480 12.485 -3.705 1.00 1.46 C ATOM 1689 CE2 PHE A 177 2.885 10.995 -4.677 1.00 1.38 C ATOM 1690 CZ PHE A 177 3.528 12.216 -4.668 1.00 0.86 C ATOM 0 H PHE A 177 6.695 9.958 -2.835 1.00 0.52 H new ATOM 0 HA PHE A 177 5.829 7.639 -1.268 1.00 0.45 H new ATOM 0 HB2 PHE A 177 3.590 8.676 -1.491 1.00 0.49 H new ATOM 0 HB3 PHE A 177 4.752 9.774 -0.774 1.00 0.49 H new ATOM 0 HD1 PHE A 177 5.531 11.752 -2.001 1.00 1.37 H new ATOM 0 HD2 PHE A 177 2.684 9.095 -3.733 1.00 1.31 H new ATOM 0 HE1 PHE A 177 4.985 13.439 -3.697 1.00 1.46 H new ATOM 0 HE2 PHE A 177 2.141 10.781 -5.431 1.00 1.38 H new ATOM 0 HZ PHE A 177 3.287 12.960 -5.413 1.00 0.86 H new ATOM 1700 N GLU A 178 4.528 6.385 -3.043 1.00 0.34 N ATOM 1701 CA GLU A 178 3.947 5.567 -4.088 1.00 0.32 C ATOM 1702 C GLU A 178 2.624 4.991 -3.596 1.00 0.28 C ATOM 1703 O GLU A 178 2.577 4.313 -2.568 1.00 0.28 O ATOM 1704 CB GLU A 178 4.912 4.449 -4.489 1.00 0.37 C ATOM 1705 CG GLU A 178 4.446 3.641 -5.686 1.00 0.40 C ATOM 1706 CD GLU A 178 5.494 2.660 -6.171 1.00 1.20 C ATOM 1707 OE1 GLU A 178 5.304 1.447 -5.989 1.00 1.91 O ATOM 1708 OE2 GLU A 178 6.516 3.100 -6.740 1.00 1.96 O ATOM 0 H GLU A 178 4.363 6.035 -2.099 1.00 0.34 H new ATOM 0 HA GLU A 178 3.762 6.180 -4.970 1.00 0.32 H new ATOM 0 HB2 GLU A 178 5.886 4.885 -4.713 1.00 0.37 H new ATOM 0 HB3 GLU A 178 5.050 3.779 -3.641 1.00 0.37 H new ATOM 0 HG2 GLU A 178 3.539 3.097 -5.422 1.00 0.40 H new ATOM 0 HG3 GLU A 178 4.185 4.319 -6.498 1.00 0.40 H new ATOM 1715 N TRP A 179 1.550 5.304 -4.305 1.00 0.28 N ATOM 1716 CA TRP A 179 0.226 4.821 -3.938 1.00 0.26 C ATOM 1717 C TRP A 179 -0.106 3.537 -4.682 1.00 0.27 C ATOM 1718 O TRP A 179 0.356 3.320 -5.804 1.00 0.38 O ATOM 1719 CB TRP A 179 -0.845 5.863 -4.275 1.00 0.27 C ATOM 1720 CG TRP A 179 -0.831 7.087 -3.412 1.00 0.27 C ATOM 1721 CD1 TRP A 179 -0.232 8.282 -3.690 1.00 0.32 C ATOM 1722 CD2 TRP A 179 -1.471 7.247 -2.139 1.00 0.24 C ATOM 1723 NE1 TRP A 179 -0.471 9.175 -2.676 1.00 0.32 N ATOM 1724 CE2 TRP A 179 -1.223 8.564 -1.712 1.00 0.27 C ATOM 1725 CE3 TRP A 179 -2.233 6.405 -1.320 1.00 0.20 C ATOM 1726 CZ2 TRP A 179 -1.707 9.062 -0.507 1.00 0.27 C ATOM 1727 CZ3 TRP A 179 -2.711 6.901 -0.124 1.00 0.21 C ATOM 1728 CH2 TRP A 179 -2.449 8.220 0.272 1.00 0.24 C ATOM 0 H TRP A 179 1.569 5.891 -5.139 1.00 0.28 H new ATOM 0 HA TRP A 179 0.235 4.634 -2.864 1.00 0.26 H new ATOM 0 HB2 TRP A 179 -0.720 6.168 -5.314 1.00 0.27 H new ATOM 0 HB3 TRP A 179 -1.825 5.393 -4.197 1.00 0.27 H new ATOM 0 HD1 TRP A 179 0.345 8.493 -4.578 1.00 0.32 H new ATOM 0 HE1 TRP A 179 -0.141 10.140 -2.646 1.00 0.32 H new ATOM 0 HE3 TRP A 179 -2.442 5.388 -1.618 1.00 0.20 H new ATOM 0 HZ2 TRP A 179 -1.504 10.077 -0.199 1.00 0.27 H new ATOM 0 HZ3 TRP A 179 -3.298 6.261 0.519 1.00 0.21 H new ATOM 0 HH2 TRP A 179 -2.842 8.578 1.212 1.00 0.24 H new ATOM 1739 N SER A 180 -0.905 2.690 -4.056 1.00 0.23 N ATOM 1740 CA SER A 180 -1.464 1.539 -4.735 1.00 0.28 C ATOM 1741 C SER A 180 -2.756 1.956 -5.425 1.00 0.28 C ATOM 1742 O SER A 180 -3.235 3.075 -5.220 1.00 0.36 O ATOM 1743 CB SER A 180 -1.743 0.409 -3.739 1.00 0.33 C ATOM 1744 OG SER A 180 -2.708 0.804 -2.776 1.00 1.06 O ATOM 0 H SER A 180 -1.180 2.780 -3.078 1.00 0.23 H new ATOM 0 HA SER A 180 -0.750 1.173 -5.473 1.00 0.28 H new ATOM 0 HB2 SER A 180 -2.098 -0.472 -4.274 1.00 0.33 H new ATOM 0 HB3 SER A 180 -0.818 0.126 -3.237 1.00 0.33 H new ATOM 0 HG SER A 180 -3.318 0.058 -2.599 1.00 1.06 H new ATOM 1750 N GLU A 181 -3.306 1.081 -6.250 1.00 0.31 N ATOM 1751 CA GLU A 181 -4.627 1.313 -6.816 1.00 0.38 C ATOM 1752 C GLU A 181 -5.642 1.449 -5.689 1.00 0.34 C ATOM 1753 O GLU A 181 -5.630 0.655 -4.747 1.00 0.49 O ATOM 1754 CB GLU A 181 -5.036 0.166 -7.745 1.00 0.56 C ATOM 1755 CG GLU A 181 -4.190 0.060 -9.005 1.00 0.74 C ATOM 1756 CD GLU A 181 -4.310 1.284 -9.886 1.00 1.38 C ATOM 1757 OE1 GLU A 181 -3.473 2.204 -9.753 1.00 2.12 O ATOM 1758 OE2 GLU A 181 -5.238 1.331 -10.723 1.00 1.91 O ATOM 0 H GLU A 181 -2.864 0.210 -6.542 1.00 0.31 H new ATOM 0 HA GLU A 181 -4.598 2.232 -7.402 1.00 0.38 H new ATOM 0 HB2 GLU A 181 -4.971 -0.773 -7.196 1.00 0.56 H new ATOM 0 HB3 GLU A 181 -6.080 0.297 -8.030 1.00 0.56 H new ATOM 0 HG2 GLU A 181 -3.146 -0.083 -8.727 1.00 0.74 H new ATOM 0 HG3 GLU A 181 -4.493 -0.822 -9.570 1.00 0.74 H new ATOM 1765 N PRO A 182 -6.507 2.469 -5.745 1.00 0.29 N ATOM 1766 CA PRO A 182 -7.519 2.678 -4.723 1.00 0.26 C ATOM 1767 C PRO A 182 -8.697 1.732 -4.902 1.00 0.28 C ATOM 1768 O PRO A 182 -9.432 1.807 -5.892 1.00 0.32 O ATOM 1769 CB PRO A 182 -7.944 4.136 -4.920 1.00 0.29 C ATOM 1770 CG PRO A 182 -7.621 4.464 -6.342 1.00 0.35 C ATOM 1771 CD PRO A 182 -6.567 3.486 -6.809 1.00 0.39 C ATOM 0 HA PRO A 182 -7.143 2.481 -3.719 1.00 0.26 H new ATOM 0 HB2 PRO A 182 -9.008 4.264 -4.721 1.00 0.29 H new ATOM 0 HB3 PRO A 182 -7.410 4.795 -4.235 1.00 0.29 H new ATOM 0 HG2 PRO A 182 -8.513 4.391 -6.964 1.00 0.35 H new ATOM 0 HG3 PRO A 182 -7.257 5.488 -6.426 1.00 0.35 H new ATOM 0 HD2 PRO A 182 -6.835 3.042 -7.768 1.00 0.39 H new ATOM 0 HD3 PRO A 182 -5.603 3.976 -6.944 1.00 0.39 H new ATOM 1779 N MET A 183 -8.863 0.833 -3.949 1.00 0.28 N ATOM 1780 CA MET A 183 -9.946 -0.132 -3.993 1.00 0.30 C ATOM 1781 C MET A 183 -11.094 0.322 -3.115 1.00 0.26 C ATOM 1782 O MET A 183 -10.888 1.005 -2.111 1.00 0.25 O ATOM 1783 CB MET A 183 -9.475 -1.526 -3.559 1.00 0.34 C ATOM 1784 CG MET A 183 -8.685 -1.555 -2.258 1.00 0.29 C ATOM 1785 SD MET A 183 -6.945 -1.138 -2.501 1.00 0.31 S ATOM 1786 CE MET A 183 -6.349 -1.118 -0.816 1.00 0.27 C ATOM 0 H MET A 183 -8.258 0.751 -3.132 1.00 0.28 H new ATOM 0 HA MET A 183 -10.288 -0.197 -5.026 1.00 0.30 H new ATOM 0 HB2 MET A 183 -10.346 -2.172 -3.453 1.00 0.34 H new ATOM 0 HB3 MET A 183 -8.858 -1.949 -4.352 1.00 0.34 H new ATOM 0 HG2 MET A 183 -9.129 -0.854 -1.551 1.00 0.29 H new ATOM 0 HG3 MET A 183 -8.759 -2.547 -1.813 1.00 0.29 H new ATOM 0 HE1 MET A 183 -5.341 -0.704 -0.792 1.00 0.27 H new ATOM 0 HE2 MET A 183 -7.009 -0.503 -0.204 1.00 0.27 H new ATOM 0 HE3 MET A 183 -6.334 -2.135 -0.423 1.00 0.27 H new ATOM 1796 N ARG A 184 -12.302 -0.054 -3.496 1.00 0.28 N ATOM 1797 CA ARG A 184 -13.479 0.309 -2.734 1.00 0.29 C ATOM 1798 C ARG A 184 -14.154 -0.941 -2.209 1.00 0.31 C ATOM 1799 O ARG A 184 -14.614 -1.779 -2.987 1.00 0.39 O ATOM 1800 CB ARG A 184 -14.482 1.092 -3.584 1.00 0.35 C ATOM 1801 CG ARG A 184 -13.901 2.285 -4.319 1.00 1.17 C ATOM 1802 CD ARG A 184 -14.988 3.032 -5.078 1.00 1.16 C ATOM 1803 NE ARG A 184 -16.030 3.550 -4.187 1.00 1.88 N ATOM 1804 CZ ARG A 184 -17.338 3.506 -4.460 1.00 2.24 C ATOM 1805 NH1 ARG A 184 -17.778 2.916 -5.568 1.00 1.94 N ATOM 1806 NH2 ARG A 184 -18.207 4.038 -3.612 1.00 3.32 N ATOM 0 H ARG A 184 -12.492 -0.611 -4.329 1.00 0.28 H new ATOM 0 HA ARG A 184 -13.155 0.943 -1.909 1.00 0.29 H new ATOM 0 HB2 ARG A 184 -14.925 0.414 -4.314 1.00 0.35 H new ATOM 0 HB3 ARG A 184 -15.290 1.439 -2.940 1.00 0.35 H new ATOM 0 HG2 ARG A 184 -13.420 2.957 -3.608 1.00 1.17 H new ATOM 0 HG3 ARG A 184 -13.130 1.950 -5.013 1.00 1.17 H new ATOM 0 HD2 ARG A 184 -14.541 3.859 -5.630 1.00 1.16 H new ATOM 0 HD3 ARG A 184 -15.439 2.365 -5.813 1.00 1.16 H new ATOM 0 HE ARG A 184 -15.739 3.970 -3.304 1.00 1.88 H new ATOM 0 HH11 ARG A 184 -17.116 2.492 -6.218 1.00 1.94 H new ATOM 0 HH12 ARG A 184 -18.778 2.887 -5.768 1.00 1.94 H new ATOM 0 HH21 ARG A 184 -17.877 4.480 -2.754 1.00 3.32 H new ATOM 0 HH22 ARG A 184 -19.206 4.006 -3.818 1.00 3.32 H new ATOM 1820 N LEU A 185 -14.202 -1.071 -0.900 1.00 0.28 N ATOM 1821 CA LEU A 185 -14.924 -2.163 -0.282 1.00 0.32 C ATOM 1822 C LEU A 185 -16.318 -1.683 0.051 1.00 0.36 C ATOM 1823 O LEU A 185 -16.528 -1.015 1.056 1.00 0.51 O ATOM 1824 CB LEU A 185 -14.230 -2.657 0.989 1.00 0.36 C ATOM 1825 CG LEU A 185 -12.766 -3.070 0.832 1.00 0.46 C ATOM 1826 CD1 LEU A 185 -12.279 -3.736 2.106 1.00 0.75 C ATOM 1827 CD2 LEU A 185 -12.585 -3.996 -0.362 1.00 0.74 C ATOM 0 H LEU A 185 -13.750 -0.434 -0.244 1.00 0.28 H new ATOM 0 HA LEU A 185 -14.958 -3.000 -0.979 1.00 0.32 H new ATOM 0 HB2 LEU A 185 -14.287 -1.870 1.740 1.00 0.36 H new ATOM 0 HB3 LEU A 185 -14.788 -3.509 1.377 1.00 0.36 H new ATOM 0 HG LEU A 185 -12.170 -2.175 0.651 1.00 0.46 H new ATOM 0 HD11 LEU A 185 -11.235 -4.028 1.988 1.00 0.75 H new ATOM 0 HD12 LEU A 185 -12.369 -3.038 2.939 1.00 0.75 H new ATOM 0 HD13 LEU A 185 -12.883 -4.621 2.308 1.00 0.75 H new ATOM 0 HD21 LEU A 185 -11.535 -4.274 -0.451 1.00 0.74 H new ATOM 0 HD22 LEU A 185 -13.188 -4.893 -0.221 1.00 0.74 H new ATOM 0 HD23 LEU A 185 -12.903 -3.484 -1.271 1.00 0.74 H new ATOM 1839 N ALA A 186 -17.257 -1.987 -0.812 1.00 0.57 N ATOM 1840 CA ALA A 186 -18.615 -1.522 -0.633 1.00 0.77 C ATOM 1841 C ALA A 186 -19.486 -2.621 -0.042 1.00 1.02 C ATOM 1842 O ALA A 186 -19.065 -3.772 0.055 1.00 1.53 O ATOM 1843 CB ALA A 186 -19.172 -1.048 -1.966 1.00 1.00 C ATOM 0 H ALA A 186 -17.108 -2.555 -1.646 1.00 0.57 H new ATOM 0 HA ALA A 186 -18.615 -0.686 0.066 1.00 0.77 H new ATOM 0 HB1 ALA A 186 -20.195 -0.698 -1.829 1.00 1.00 H new ATOM 0 HB2 ALA A 186 -18.558 -0.233 -2.348 1.00 1.00 H new ATOM 0 HB3 ALA A 186 -19.163 -1.873 -2.678 1.00 1.00 H new ATOM 1849 N LYS A 187 -20.684 -2.256 0.382 1.00 0.89 N ATOM 1850 CA LYS A 187 -21.670 -3.224 0.838 1.00 1.11 C ATOM 1851 C LYS A 187 -23.024 -2.895 0.233 1.00 1.49 C ATOM 1852 O LYS A 187 -23.779 -2.089 0.775 1.00 1.61 O ATOM 1853 CB LYS A 187 -21.779 -3.249 2.369 1.00 1.11 C ATOM 1854 CG LYS A 187 -20.814 -4.209 3.052 1.00 1.17 C ATOM 1855 CD LYS A 187 -19.416 -3.630 3.174 1.00 1.45 C ATOM 1856 CE LYS A 187 -18.463 -4.613 3.835 1.00 1.82 C ATOM 1857 NZ LYS A 187 -18.943 -5.037 5.179 1.00 2.78 N ATOM 0 H LYS A 187 -21.000 -1.287 0.420 1.00 0.89 H new ATOM 0 HA LYS A 187 -21.345 -4.212 0.512 1.00 1.11 H new ATOM 0 HB2 LYS A 187 -21.603 -2.243 2.750 1.00 1.11 H new ATOM 0 HB3 LYS A 187 -22.798 -3.520 2.644 1.00 1.11 H new ATOM 0 HG2 LYS A 187 -21.191 -4.455 4.045 1.00 1.17 H new ATOM 0 HG3 LYS A 187 -20.771 -5.141 2.488 1.00 1.17 H new ATOM 0 HD2 LYS A 187 -19.042 -3.368 2.184 1.00 1.45 H new ATOM 0 HD3 LYS A 187 -19.452 -2.709 3.756 1.00 1.45 H new ATOM 0 HE2 LYS A 187 -18.347 -5.490 3.198 1.00 1.82 H new ATOM 0 HE3 LYS A 187 -17.478 -4.156 3.929 1.00 1.82 H new ATOM 0 HZ1 LYS A 187 -18.166 -5.494 5.697 1.00 2.78 H new ATOM 0 HZ2 LYS A 187 -19.270 -4.204 5.709 1.00 2.78 H new ATOM 0 HZ3 LYS A 187 -19.729 -5.709 5.071 1.00 2.78 H new ATOM 1871 N CYS A 188 -23.323 -3.503 -0.902 1.00 1.82 N ATOM 1872 CA CYS A 188 -24.575 -3.240 -1.583 1.00 2.29 C ATOM 1873 C CYS A 188 -25.585 -4.335 -1.272 1.00 2.51 C ATOM 1874 O CYS A 188 -25.365 -5.506 -1.590 1.00 2.68 O ATOM 1875 CB CYS A 188 -24.339 -3.157 -3.094 1.00 2.71 C ATOM 1876 SG CYS A 188 -22.972 -2.069 -3.561 1.00 3.14 S ATOM 0 H CYS A 188 -22.718 -4.179 -1.368 1.00 1.82 H new ATOM 0 HA CYS A 188 -24.973 -2.288 -1.232 1.00 2.29 H new ATOM 0 HB2 CYS A 188 -24.141 -4.158 -3.477 1.00 2.71 H new ATOM 0 HB3 CYS A 188 -25.251 -2.806 -3.576 1.00 2.71 H new ATOM 0 HG CYS A 188 -22.845 -2.063 -4.855 1.00 3.14 H new ATOM 1882 N ASP A 189 -26.687 -3.954 -0.648 1.00 2.70 N ATOM 1883 CA ASP A 189 -27.779 -4.882 -0.410 1.00 3.08 C ATOM 1884 C ASP A 189 -28.851 -4.674 -1.464 1.00 3.61 C ATOM 1885 O ASP A 189 -29.401 -3.582 -1.612 1.00 3.87 O ATOM 1886 CB ASP A 189 -28.355 -4.740 1.011 1.00 3.12 C ATOM 1887 CG ASP A 189 -28.714 -3.315 1.383 1.00 3.50 C ATOM 1888 OD1 ASP A 189 -29.876 -2.910 1.174 1.00 3.76 O ATOM 1889 OD2 ASP A 189 -27.835 -2.594 1.903 1.00 4.05 O ATOM 0 H ASP A 189 -26.849 -3.010 -0.298 1.00 2.70 H new ATOM 0 HA ASP A 189 -27.394 -5.899 -0.486 1.00 3.08 H new ATOM 0 HB2 ASP A 189 -29.245 -5.364 1.097 1.00 3.12 H new ATOM 0 HB3 ASP A 189 -27.628 -5.121 1.728 1.00 3.12 H new ATOM 1894 N GLU A 190 -29.112 -5.718 -2.227 1.00 3.97 N ATOM 1895 CA GLU A 190 -30.018 -5.631 -3.352 1.00 4.63 C ATOM 1896 C GLU A 190 -30.794 -6.931 -3.489 1.00 5.25 C ATOM 1897 O GLU A 190 -31.942 -6.994 -3.005 1.00 5.64 O ATOM 1898 CB GLU A 190 -29.220 -5.345 -4.627 1.00 4.83 C ATOM 1899 CG GLU A 190 -30.074 -4.961 -5.821 1.00 5.57 C ATOM 1900 CD GLU A 190 -29.246 -4.751 -7.069 1.00 5.94 C ATOM 1901 OE1 GLU A 190 -29.411 -5.524 -8.036 1.00 6.06 O ATOM 1902 OE2 GLU A 190 -28.415 -3.821 -7.087 1.00 6.43 O ATOM 1903 OXT GLU A 190 -30.239 -7.898 -4.049 1.00 5.62 O ATOM 0 H GLU A 190 -28.705 -6.642 -2.085 1.00 3.97 H new ATOM 0 HA GLU A 190 -30.727 -4.819 -3.190 1.00 4.63 H new ATOM 0 HB2 GLU A 190 -28.512 -4.541 -4.427 1.00 4.83 H new ATOM 0 HB3 GLU A 190 -28.635 -6.228 -4.882 1.00 4.83 H new ATOM 0 HG2 GLU A 190 -30.813 -5.741 -6.004 1.00 5.57 H new ATOM 0 HG3 GLU A 190 -30.624 -4.048 -5.594 1.00 5.57 H new TER 1910 GLU A 190