USER MOD reduce.3.24.130724 H: found=0, std=0, add=955, rem=0, adj=32 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 77 SER OG : rot 180:sc= 0.974 USER MOD Set 1.2: A 166 LYS NZ :NH3+ 161:sc= 2.02 (180deg=0.216) USER MOD Set 2.1: A 153 LYS NZ :NH3+ -161:sc= 1.09 (180deg=0.595) USER MOD Set 2.2: A 155 MET CE :methyl -110:sc= -0.616 (180deg=-3.49!) USER MOD Set 3.1: A 141 GLN : amide:sc= 0.829 X(o=1.5,f=1.3) USER MOD Set 3.2: A 147 TYR OH : rot -109:sc= 0.714 USER MOD Set 4.1: A 76 GLN : amide:sc= -1.24 K(o=-1.4,f=-0.18) USER MOD Set 4.2: A 111 SER OG : rot 70:sc= -0.184 USER MOD Set 5.1: A 85 THR OG1 : rot 137:sc= 1.01 USER MOD Set 5.2: A 183 MET CE :methyl -175:sc= -1.51 (180deg=-1.97) USER MOD Set 6.1: A 84 GLN : amide:sc= 1.48 K(o=2.6,f=-2.2!) USER MOD Set 6.2: A 180 SER OG : rot 2:sc= 1.1 USER MOD Set 7.1: A 80 HIS : no HD1:sc= 0.898 K(o=2,f=-4.9!) USER MOD Set 7.2: A 82 SER OG : rot -23:sc= 1.09 USER MOD Single : A 87 THR OG1 : rot -160:sc= 0.12 USER MOD Single : A 88 LYS NZ :NH3+ -162:sc= -0.0441 (180deg=-0.296) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 CYS SG : rot -63:sc= 0.0921 USER MOD Single : A 93 SER OG : rot 180:sc= 0.0214 USER MOD Single : A 103 ASN : amide:sc= -0.764 K(o=-0.76,f=-5.3!) USER MOD Single : A 104 THR OG1 : rot 60:sc= 1.3 USER MOD Single : A 107 LYS NZ :NH3+ 158:sc= 1.21 (180deg=0.398) USER MOD Single : A 109 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0394) USER MOD Single : A 110 LYS NZ :NH3+ 169:sc= -0.0259 (180deg=-0.155) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 HIS : no HD1:sc= -6! C(o=-5.9!,f=-12!) USER MOD Single : A 119 LYS NZ :NH3+ 157:sc= 1.86 (180deg=1.38) USER MOD Single : A 122 ASN : amide:sc= -2.83! C(o=-2.8!,f=-6.9!) USER MOD Single : A 125 LYS NZ :NH3+ 168:sc=-0.00754 (180deg=-0.181) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 ASN : amide:sc= -2.77! C(o=-2.8!,f=-6.8!) USER MOD Single : A 135 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0259) USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 140 ASN : amide:sc= -1.17 X(o=-1.2,f=-1.3) USER MOD Single : A 145 SER OG : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 THR OG1 : rot 108:sc= 1.57 USER MOD Single : A 152 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 156 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 160 TYR OH : rot 26:sc= 1.22 USER MOD Single : A 163 LYS NZ :NH3+ 167:sc= -0.405 (180deg=-0.75) USER MOD Single : A 165 TYR OH : rot -39:sc= 0.113 USER MOD Single : A 170 TYR OH : rot 180:sc= 0 USER MOD Single : A 173 ASN : amide:sc= -0.209 K(o=-0.21,f=-1.1) USER MOD Single : A 175 SER OG : rot 180:sc= 0 USER MOD Single : A 176 THR OG1 : rot 80:sc= 0.472 USER MOD Single : A 187 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 188 CYS SG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 73 24.879 3.579 -5.479 1.00 3.12 N ATOM 2 CA ARG A 73 25.099 2.706 -4.299 1.00 2.69 C ATOM 3 C ARG A 73 23.909 2.789 -3.356 1.00 2.08 C ATOM 4 O ARG A 73 23.988 3.388 -2.279 1.00 2.31 O ATOM 5 CB ARG A 73 26.380 3.101 -3.560 1.00 3.05 C ATOM 6 CG ARG A 73 27.638 2.972 -4.400 1.00 3.69 C ATOM 7 CD ARG A 73 28.883 3.277 -3.586 1.00 4.24 C ATOM 8 NE ARG A 73 30.092 3.262 -4.407 1.00 4.97 N ATOM 9 CZ ARG A 73 31.304 3.581 -3.953 1.00 5.85 C ATOM 10 NH1 ARG A 73 31.472 3.938 -2.687 1.00 6.18 N ATOM 11 NH2 ARG A 73 32.349 3.551 -4.771 1.00 6.67 N ATOM 0 HA ARG A 73 25.206 1.680 -4.650 1.00 2.69 H new ATOM 0 HB2 ARG A 73 26.287 4.132 -3.218 1.00 3.05 H new ATOM 0 HB3 ARG A 73 26.482 2.478 -2.672 1.00 3.05 H new ATOM 0 HG2 ARG A 73 27.705 1.962 -4.805 1.00 3.69 H new ATOM 0 HG3 ARG A 73 27.581 3.653 -5.249 1.00 3.69 H new ATOM 0 HD2 ARG A 73 28.777 4.254 -3.114 1.00 4.24 H new ATOM 0 HD3 ARG A 73 28.980 2.545 -2.784 1.00 4.24 H new ATOM 0 HE ARG A 73 30.003 2.991 -5.386 1.00 4.97 H new ATOM 0 HH11 ARG A 73 30.672 3.969 -2.055 1.00 6.18 H new ATOM 0 HH12 ARG A 73 32.402 4.181 -2.345 1.00 6.18 H new ATOM 0 HH21 ARG A 73 32.225 3.284 -5.748 1.00 6.67 H new ATOM 0 HH22 ARG A 73 33.276 3.795 -4.423 1.00 6.67 H new ATOM 25 N TRP A 74 22.809 2.184 -3.764 1.00 1.61 N ATOM 26 CA TRP A 74 21.576 2.237 -3.001 1.00 1.14 C ATOM 27 C TRP A 74 20.752 0.990 -3.306 1.00 0.96 C ATOM 28 O TRP A 74 20.727 0.531 -4.451 1.00 1.19 O ATOM 29 CB TRP A 74 20.802 3.507 -3.369 1.00 1.25 C ATOM 30 CG TRP A 74 19.792 3.921 -2.350 1.00 1.15 C ATOM 31 CD1 TRP A 74 18.528 3.443 -2.214 1.00 1.14 C ATOM 32 CD2 TRP A 74 19.959 4.911 -1.330 1.00 1.26 C ATOM 33 NE1 TRP A 74 17.893 4.075 -1.173 1.00 1.26 N ATOM 34 CE2 TRP A 74 18.753 4.977 -0.612 1.00 1.34 C ATOM 35 CE3 TRP A 74 21.011 5.747 -0.951 1.00 1.43 C ATOM 36 CZ2 TRP A 74 18.569 5.840 0.461 1.00 1.61 C ATOM 37 CZ3 TRP A 74 20.829 6.607 0.114 1.00 1.66 C ATOM 38 CH2 TRP A 74 19.615 6.646 0.812 1.00 1.75 C ATOM 0 H TRP A 74 22.745 1.645 -4.628 1.00 1.61 H new ATOM 0 HA TRP A 74 21.792 2.265 -1.933 1.00 1.14 H new ATOM 0 HB2 TRP A 74 21.511 4.322 -3.515 1.00 1.25 H new ATOM 0 HB3 TRP A 74 20.297 3.349 -4.322 1.00 1.25 H new ATOM 0 HD1 TRP A 74 18.086 2.677 -2.834 1.00 1.14 H new ATOM 0 HE1 TRP A 74 16.936 3.900 -0.868 1.00 1.26 H new ATOM 0 HE3 TRP A 74 21.951 5.722 -1.482 1.00 1.43 H new ATOM 0 HZ2 TRP A 74 17.633 5.873 0.998 1.00 1.61 H new ATOM 0 HZ3 TRP A 74 21.635 7.260 0.414 1.00 1.66 H new ATOM 0 HH2 TRP A 74 19.504 7.326 1.643 1.00 1.75 H new ATOM 49 N ASP A 75 20.112 0.422 -2.289 1.00 0.79 N ATOM 50 CA ASP A 75 19.331 -0.801 -2.475 1.00 0.78 C ATOM 51 C ASP A 75 17.950 -0.685 -1.849 1.00 0.67 C ATOM 52 O ASP A 75 17.073 -1.502 -2.099 1.00 0.92 O ATOM 53 CB ASP A 75 20.053 -2.008 -1.863 1.00 0.92 C ATOM 54 CG ASP A 75 21.315 -2.384 -2.610 1.00 1.37 C ATOM 55 OD1 ASP A 75 22.406 -1.920 -2.218 1.00 2.01 O ATOM 56 OD2 ASP A 75 21.226 -3.168 -3.578 1.00 1.86 O ATOM 0 H ASP A 75 20.117 0.783 -1.335 1.00 0.79 H new ATOM 0 HA ASP A 75 19.220 -0.945 -3.550 1.00 0.78 H new ATOM 0 HB2 ASP A 75 20.304 -1.787 -0.826 1.00 0.92 H new ATOM 0 HB3 ASP A 75 19.376 -2.862 -1.852 1.00 0.92 H new ATOM 61 N GLN A 76 17.757 0.315 -1.019 1.00 0.59 N ATOM 62 CA GLN A 76 16.512 0.446 -0.280 1.00 0.77 C ATOM 63 C GLN A 76 15.498 1.358 -0.982 1.00 0.69 C ATOM 64 O GLN A 76 14.507 1.753 -0.379 1.00 0.94 O ATOM 65 CB GLN A 76 16.807 0.935 1.143 1.00 1.07 C ATOM 66 CG GLN A 76 17.613 2.224 1.193 1.00 1.21 C ATOM 67 CD GLN A 76 18.266 2.460 2.538 1.00 1.75 C ATOM 68 OE1 GLN A 76 19.389 2.017 2.779 1.00 2.30 O ATOM 69 NE2 GLN A 76 17.578 3.164 3.419 1.00 2.36 N ATOM 0 H GLN A 76 18.441 1.049 -0.836 1.00 0.59 H new ATOM 0 HA GLN A 76 16.048 -0.539 -0.235 1.00 0.77 H new ATOM 0 HB2 GLN A 76 15.864 1.086 1.668 1.00 1.07 H new ATOM 0 HB3 GLN A 76 17.350 0.157 1.680 1.00 1.07 H new ATOM 0 HG2 GLN A 76 18.382 2.195 0.422 1.00 1.21 H new ATOM 0 HG3 GLN A 76 16.959 3.064 0.960 1.00 1.21 H new ATOM 0 HE21 GLN A 76 16.650 3.513 3.180 1.00 2.36 H new ATOM 0 HE22 GLN A 76 17.975 3.358 4.338 1.00 2.36 H new ATOM 78 N SER A 77 15.746 1.715 -2.237 1.00 0.51 N ATOM 79 CA SER A 77 14.885 2.676 -2.924 1.00 0.56 C ATOM 80 C SER A 77 13.869 2.031 -3.871 1.00 0.43 C ATOM 81 O SER A 77 12.758 2.542 -4.019 1.00 0.54 O ATOM 82 CB SER A 77 15.733 3.679 -3.704 1.00 0.80 C ATOM 83 OG SER A 77 14.932 4.663 -4.335 1.00 1.52 O ATOM 0 H SER A 77 16.523 1.361 -2.794 1.00 0.51 H new ATOM 0 HA SER A 77 14.315 3.177 -2.142 1.00 0.56 H new ATOM 0 HB2 SER A 77 16.438 4.162 -3.028 1.00 0.80 H new ATOM 0 HB3 SER A 77 16.321 3.152 -4.455 1.00 0.80 H new ATOM 0 HG SER A 77 15.507 5.289 -4.823 1.00 1.52 H new ATOM 89 N ASP A 78 14.221 0.921 -4.505 1.00 0.35 N ATOM 90 CA ASP A 78 13.458 0.466 -5.673 1.00 0.38 C ATOM 91 C ASP A 78 12.424 -0.605 -5.338 1.00 0.33 C ATOM 92 O ASP A 78 12.232 -1.556 -6.099 1.00 0.42 O ATOM 93 CB ASP A 78 14.382 -0.018 -6.793 1.00 0.51 C ATOM 94 CG ASP A 78 13.921 0.475 -8.146 1.00 0.94 C ATOM 95 OD1 ASP A 78 13.032 -0.154 -8.750 1.00 1.66 O ATOM 96 OD2 ASP A 78 14.435 1.515 -8.608 1.00 1.66 O ATOM 0 H ASP A 78 15.009 0.328 -4.244 1.00 0.35 H new ATOM 0 HA ASP A 78 12.908 1.339 -6.023 1.00 0.38 H new ATOM 0 HB2 ASP A 78 15.397 0.331 -6.604 1.00 0.51 H new ATOM 0 HB3 ASP A 78 14.414 -1.108 -6.794 1.00 0.51 H new ATOM 101 N LEU A 79 11.777 -0.466 -4.193 1.00 0.26 N ATOM 102 CA LEU A 79 10.641 -1.320 -3.861 1.00 0.26 C ATOM 103 C LEU A 79 9.384 -0.748 -4.504 1.00 0.30 C ATOM 104 O LEU A 79 8.988 0.382 -4.214 1.00 0.51 O ATOM 105 CB LEU A 79 10.453 -1.446 -2.342 1.00 0.28 C ATOM 106 CG LEU A 79 11.340 -2.481 -1.634 1.00 0.28 C ATOM 107 CD1 LEU A 79 11.085 -3.874 -2.184 1.00 0.29 C ATOM 108 CD2 LEU A 79 12.815 -2.119 -1.751 1.00 0.30 C ATOM 0 H LEU A 79 12.014 0.224 -3.480 1.00 0.26 H new ATOM 0 HA LEU A 79 10.834 -2.321 -4.248 1.00 0.26 H new ATOM 0 HB2 LEU A 79 10.638 -0.471 -1.892 1.00 0.28 H new ATOM 0 HB3 LEU A 79 9.410 -1.696 -2.145 1.00 0.28 H new ATOM 0 HG LEU A 79 11.078 -2.475 -0.576 1.00 0.28 H new ATOM 0 HD11 LEU A 79 11.724 -4.591 -1.669 1.00 0.29 H new ATOM 0 HD12 LEU A 79 10.040 -4.141 -2.028 1.00 0.29 H new ATOM 0 HD13 LEU A 79 11.308 -3.890 -3.251 1.00 0.29 H new ATOM 0 HD21 LEU A 79 13.416 -2.871 -1.240 1.00 0.30 H new ATOM 0 HD22 LEU A 79 13.098 -2.082 -2.803 1.00 0.30 H new ATOM 0 HD23 LEU A 79 12.988 -1.145 -1.294 1.00 0.30 H new ATOM 120 N HIS A 80 8.773 -1.516 -5.391 1.00 0.21 N ATOM 121 CA HIS A 80 7.648 -1.026 -6.175 1.00 0.25 C ATOM 122 C HIS A 80 6.395 -1.855 -5.916 1.00 0.22 C ATOM 123 O HIS A 80 6.436 -3.080 -5.975 1.00 0.23 O ATOM 124 CB HIS A 80 8.012 -1.065 -7.665 1.00 0.33 C ATOM 125 CG HIS A 80 6.930 -0.585 -8.580 1.00 1.03 C ATOM 126 ND1 HIS A 80 6.071 -1.438 -9.241 1.00 1.94 N ATOM 127 CD2 HIS A 80 6.578 0.667 -8.959 1.00 1.86 C ATOM 128 CE1 HIS A 80 5.242 -0.732 -9.985 1.00 2.58 C ATOM 129 NE2 HIS A 80 5.528 0.548 -9.833 1.00 2.50 N ATOM 0 H HIS A 80 9.036 -2.482 -5.587 1.00 0.21 H new ATOM 0 HA HIS A 80 7.435 0.001 -5.877 1.00 0.25 H new ATOM 0 HB2 HIS A 80 8.902 -0.457 -7.825 1.00 0.33 H new ATOM 0 HB3 HIS A 80 8.272 -2.088 -7.936 1.00 0.33 H new ATOM 0 HD2 HIS A 80 7.039 1.588 -8.633 1.00 1.86 H new ATOM 0 HE1 HIS A 80 4.460 -1.133 -10.613 1.00 2.58 H new ATOM 0 HE2 HIS A 80 5.047 1.322 -10.291 1.00 2.50 H new ATOM 138 N ILE A 81 5.288 -1.181 -5.638 1.00 0.23 N ATOM 139 CA ILE A 81 4.009 -1.850 -5.456 1.00 0.23 C ATOM 140 C ILE A 81 3.516 -2.369 -6.801 1.00 0.26 C ATOM 141 O ILE A 81 2.923 -1.631 -7.591 1.00 0.36 O ATOM 142 CB ILE A 81 2.948 -0.911 -4.844 1.00 0.24 C ATOM 143 CG1 ILE A 81 3.422 -0.369 -3.493 1.00 0.23 C ATOM 144 CG2 ILE A 81 1.624 -1.647 -4.685 1.00 0.28 C ATOM 145 CD1 ILE A 81 2.474 0.639 -2.880 1.00 0.27 C ATOM 0 H ILE A 81 5.251 -0.167 -5.533 1.00 0.23 H new ATOM 0 HA ILE A 81 4.159 -2.677 -4.761 1.00 0.23 H new ATOM 0 HB ILE A 81 2.802 -0.068 -5.519 1.00 0.24 H new ATOM 0 HG12 ILE A 81 3.551 -1.202 -2.802 1.00 0.23 H new ATOM 0 HG13 ILE A 81 4.400 0.095 -3.620 1.00 0.23 H new ATOM 0 HG21 ILE A 81 0.883 -0.974 -4.252 1.00 0.28 H new ATOM 0 HG22 ILE A 81 1.278 -1.988 -5.661 1.00 0.28 H new ATOM 0 HG23 ILE A 81 1.762 -2.506 -4.028 1.00 0.28 H new ATOM 0 HD11 ILE A 81 2.873 0.980 -1.925 1.00 0.27 H new ATOM 0 HD12 ILE A 81 2.364 1.490 -3.552 1.00 0.27 H new ATOM 0 HD13 ILE A 81 1.501 0.174 -2.721 1.00 0.27 H new ATOM 157 N SER A 82 3.784 -3.633 -7.061 1.00 0.25 N ATOM 158 CA SER A 82 3.510 -4.218 -8.363 1.00 0.29 C ATOM 159 C SER A 82 2.211 -5.019 -8.357 1.00 0.33 C ATOM 160 O SER A 82 1.644 -5.303 -9.412 1.00 0.43 O ATOM 161 CB SER A 82 4.689 -5.090 -8.787 1.00 0.32 C ATOM 162 OG SER A 82 5.873 -4.309 -8.877 1.00 1.10 O ATOM 0 H SER A 82 4.193 -4.279 -6.386 1.00 0.25 H new ATOM 0 HA SER A 82 3.383 -3.412 -9.086 1.00 0.29 H new ATOM 0 HB2 SER A 82 4.831 -5.896 -8.067 1.00 0.32 H new ATOM 0 HB3 SER A 82 4.478 -5.555 -9.750 1.00 0.32 H new ATOM 0 HG SER A 82 5.635 -3.369 -9.017 1.00 1.10 H new ATOM 168 N ASP A 83 1.731 -5.361 -7.173 1.00 0.33 N ATOM 169 CA ASP A 83 0.470 -6.081 -7.038 1.00 0.38 C ATOM 170 C ASP A 83 -0.258 -5.560 -5.813 1.00 0.30 C ATOM 171 O ASP A 83 0.367 -4.968 -4.935 1.00 0.27 O ATOM 172 CB ASP A 83 0.711 -7.594 -6.937 1.00 0.46 C ATOM 173 CG ASP A 83 -0.573 -8.399 -6.959 1.00 1.27 C ATOM 174 OD1 ASP A 83 -1.107 -8.639 -8.062 1.00 2.07 O ATOM 175 OD2 ASP A 83 -1.051 -8.799 -5.880 1.00 1.90 O ATOM 0 H ASP A 83 2.194 -5.152 -6.289 1.00 0.33 H new ATOM 0 HA ASP A 83 -0.144 -5.913 -7.923 1.00 0.38 H new ATOM 0 HB2 ASP A 83 1.347 -7.911 -7.763 1.00 0.46 H new ATOM 0 HB3 ASP A 83 1.253 -7.810 -6.016 1.00 0.46 H new ATOM 180 N GLN A 84 -1.564 -5.755 -5.752 1.00 0.31 N ATOM 181 CA GLN A 84 -2.357 -5.166 -4.688 1.00 0.35 C ATOM 182 C GLN A 84 -3.697 -5.870 -4.542 1.00 0.34 C ATOM 183 O GLN A 84 -3.979 -6.836 -5.256 1.00 0.39 O ATOM 184 CB GLN A 84 -2.571 -3.676 -4.971 1.00 0.49 C ATOM 185 CG GLN A 84 -3.352 -3.414 -6.249 1.00 0.64 C ATOM 186 CD GLN A 84 -2.763 -2.290 -7.078 1.00 1.32 C ATOM 187 OE1 GLN A 84 -2.152 -1.360 -6.551 1.00 2.14 O ATOM 188 NE2 GLN A 84 -2.945 -2.372 -8.385 1.00 1.98 N ATOM 0 H GLN A 84 -2.094 -6.312 -6.422 1.00 0.31 H new ATOM 0 HA GLN A 84 -1.815 -5.285 -3.750 1.00 0.35 H new ATOM 0 HB2 GLN A 84 -3.100 -3.226 -4.131 1.00 0.49 H new ATOM 0 HB3 GLN A 84 -1.601 -3.183 -5.038 1.00 0.49 H new ATOM 0 HG2 GLN A 84 -3.378 -4.325 -6.847 1.00 0.64 H new ATOM 0 HG3 GLN A 84 -4.384 -3.170 -5.995 1.00 0.64 H new ATOM 0 HE21 GLN A 84 -3.458 -3.160 -8.780 1.00 1.98 H new ATOM 0 HE22 GLN A 84 -2.573 -1.647 -8.998 1.00 1.98 H new ATOM 197 N THR A 85 -4.504 -5.387 -3.606 1.00 0.34 N ATOM 198 CA THR A 85 -5.843 -5.907 -3.377 1.00 0.39 C ATOM 199 C THR A 85 -6.634 -6.023 -4.681 1.00 0.50 C ATOM 200 O THR A 85 -6.579 -5.140 -5.537 1.00 0.54 O ATOM 201 CB THR A 85 -6.615 -4.990 -2.412 1.00 0.32 C ATOM 202 OG1 THR A 85 -5.815 -4.712 -1.257 1.00 0.43 O ATOM 203 CG2 THR A 85 -7.930 -5.628 -1.985 1.00 0.42 C ATOM 0 H THR A 85 -4.246 -4.621 -2.983 1.00 0.34 H new ATOM 0 HA THR A 85 -5.732 -6.901 -2.943 1.00 0.39 H new ATOM 0 HB THR A 85 -6.838 -4.059 -2.933 1.00 0.32 H new ATOM 0 HG1 THR A 85 -5.888 -3.762 -1.030 1.00 0.43 H new ATOM 0 HG21 THR A 85 -8.455 -4.959 -1.303 1.00 0.42 H new ATOM 0 HG22 THR A 85 -8.549 -5.809 -2.864 1.00 0.42 H new ATOM 0 HG23 THR A 85 -7.729 -6.574 -1.482 1.00 0.42 H new ATOM 211 N ASP A 86 -7.359 -7.121 -4.825 1.00 0.69 N ATOM 212 CA ASP A 86 -8.200 -7.334 -5.993 1.00 0.89 C ATOM 213 C ASP A 86 -9.501 -6.562 -5.836 1.00 0.83 C ATOM 214 O ASP A 86 -10.375 -6.957 -5.067 1.00 1.12 O ATOM 215 CB ASP A 86 -8.487 -8.826 -6.173 1.00 1.20 C ATOM 216 CG ASP A 86 -9.363 -9.118 -7.376 1.00 1.67 C ATOM 217 OD1 ASP A 86 -8.837 -9.129 -8.508 1.00 2.32 O ATOM 218 OD2 ASP A 86 -10.573 -9.370 -7.191 1.00 2.23 O ATOM 0 H ASP A 86 -7.382 -7.881 -4.145 1.00 0.69 H new ATOM 0 HA ASP A 86 -7.678 -6.973 -6.879 1.00 0.89 H new ATOM 0 HB2 ASP A 86 -7.544 -9.362 -6.278 1.00 1.20 H new ATOM 0 HB3 ASP A 86 -8.973 -9.208 -5.275 1.00 1.20 H new ATOM 223 N THR A 87 -9.611 -5.444 -6.534 1.00 0.72 N ATOM 224 CA THR A 87 -10.806 -4.627 -6.443 1.00 0.74 C ATOM 225 C THR A 87 -11.710 -4.829 -7.658 1.00 0.81 C ATOM 226 O THR A 87 -12.911 -5.051 -7.489 1.00 1.42 O ATOM 227 CB THR A 87 -10.470 -3.125 -6.252 1.00 1.14 C ATOM 228 OG1 THR A 87 -11.674 -2.348 -6.166 1.00 1.36 O ATOM 229 CG2 THR A 87 -9.595 -2.590 -7.376 1.00 1.87 C ATOM 0 H THR A 87 -8.894 -5.085 -7.164 1.00 0.72 H new ATOM 0 HA THR A 87 -11.348 -4.956 -5.556 1.00 0.74 H new ATOM 0 HB THR A 87 -9.912 -3.037 -5.320 1.00 1.14 H new ATOM 0 HG1 THR A 87 -11.473 -1.410 -6.364 1.00 1.36 H new ATOM 0 HG21 THR A 87 -9.384 -1.535 -7.202 1.00 1.87 H new ATOM 0 HG22 THR A 87 -8.659 -3.147 -7.405 1.00 1.87 H new ATOM 0 HG23 THR A 87 -10.115 -2.704 -8.327 1.00 1.87 H new ATOM 237 N LYS A 88 -11.134 -4.781 -8.864 1.00 1.18 N ATOM 238 CA LYS A 88 -11.898 -4.940 -10.104 1.00 1.58 C ATOM 239 C LYS A 88 -13.163 -4.088 -10.074 1.00 1.51 C ATOM 240 O LYS A 88 -14.265 -4.564 -10.361 1.00 1.95 O ATOM 241 CB LYS A 88 -12.251 -6.416 -10.326 1.00 1.89 C ATOM 242 CG LYS A 88 -11.044 -7.348 -10.314 1.00 2.02 C ATOM 243 CD LYS A 88 -10.113 -7.107 -11.496 1.00 2.39 C ATOM 244 CE LYS A 88 -10.688 -7.661 -12.792 1.00 2.73 C ATOM 245 NZ LYS A 88 -10.765 -9.147 -12.775 1.00 3.20 N ATOM 0 H LYS A 88 -10.135 -4.632 -9.007 1.00 1.18 H new ATOM 0 HA LYS A 88 -11.279 -4.600 -10.934 1.00 1.58 H new ATOM 0 HB2 LYS A 88 -12.950 -6.733 -9.552 1.00 1.89 H new ATOM 0 HB3 LYS A 88 -12.766 -6.517 -11.281 1.00 1.89 H new ATOM 0 HG2 LYS A 88 -10.491 -7.210 -9.385 1.00 2.02 H new ATOM 0 HG3 LYS A 88 -11.387 -8.383 -10.330 1.00 2.02 H new ATOM 0 HD2 LYS A 88 -9.935 -6.037 -11.606 1.00 2.39 H new ATOM 0 HD3 LYS A 88 -9.147 -7.573 -11.299 1.00 2.39 H new ATOM 0 HE2 LYS A 88 -11.684 -7.248 -12.953 1.00 2.73 H new ATOM 0 HE3 LYS A 88 -10.070 -7.339 -13.630 1.00 2.73 H new ATOM 0 HZ1 LYS A 88 -10.864 -9.501 -13.748 1.00 3.20 H new ATOM 0 HZ2 LYS A 88 -9.897 -9.535 -12.352 1.00 3.20 H new ATOM 0 HZ3 LYS A 88 -11.587 -9.446 -12.213 1.00 3.20 H new ATOM 259 N GLY A 89 -12.997 -2.830 -9.692 1.00 1.22 N ATOM 260 CA GLY A 89 -14.123 -1.927 -9.596 1.00 1.14 C ATOM 261 C GLY A 89 -14.688 -1.874 -8.192 1.00 0.96 C ATOM 262 O GLY A 89 -14.389 -0.954 -7.432 1.00 1.01 O ATOM 0 H GLY A 89 -12.097 -2.418 -9.446 1.00 1.22 H new ATOM 0 HA2 GLY A 89 -13.813 -0.927 -9.900 1.00 1.14 H new ATOM 0 HA3 GLY A 89 -14.902 -2.244 -10.289 1.00 1.14 H new ATOM 266 N THR A 90 -15.491 -2.866 -7.839 1.00 0.97 N ATOM 267 CA THR A 90 -16.129 -2.900 -6.533 1.00 0.88 C ATOM 268 C THR A 90 -15.903 -4.240 -5.837 1.00 0.82 C ATOM 269 O THR A 90 -16.195 -5.295 -6.396 1.00 1.04 O ATOM 270 CB THR A 90 -17.645 -2.636 -6.651 1.00 1.06 C ATOM 271 OG1 THR A 90 -17.865 -1.397 -7.335 1.00 1.25 O ATOM 272 CG2 THR A 90 -18.307 -2.583 -5.280 1.00 1.02 C ATOM 0 H THR A 90 -15.716 -3.659 -8.440 1.00 0.97 H new ATOM 0 HA THR A 90 -15.673 -2.112 -5.934 1.00 0.88 H new ATOM 0 HB THR A 90 -18.089 -3.457 -7.213 1.00 1.06 H new ATOM 0 HG1 THR A 90 -18.828 -1.232 -7.411 1.00 1.25 H new ATOM 0 HG21 THR A 90 -19.374 -2.396 -5.398 1.00 1.02 H new ATOM 0 HG22 THR A 90 -18.160 -3.534 -4.768 1.00 1.02 H new ATOM 0 HG23 THR A 90 -17.861 -1.781 -4.691 1.00 1.02 H new ATOM 280 N VAL A 91 -15.364 -4.185 -4.628 1.00 0.65 N ATOM 281 CA VAL A 91 -15.221 -5.366 -3.789 1.00 0.77 C ATOM 282 C VAL A 91 -16.455 -5.493 -2.905 1.00 0.55 C ATOM 283 O VAL A 91 -17.161 -4.514 -2.678 1.00 0.46 O ATOM 284 CB VAL A 91 -13.949 -5.281 -2.910 1.00 1.02 C ATOM 285 CG1 VAL A 91 -13.742 -6.548 -2.091 1.00 1.43 C ATOM 286 CG2 VAL A 91 -12.732 -5.020 -3.770 1.00 1.51 C ATOM 0 H VAL A 91 -15.015 -3.326 -4.203 1.00 0.65 H new ATOM 0 HA VAL A 91 -15.124 -6.243 -4.429 1.00 0.77 H new ATOM 0 HB VAL A 91 -14.087 -4.452 -2.216 1.00 1.02 H new ATOM 0 HG11 VAL A 91 -12.839 -6.448 -1.488 1.00 1.43 H new ATOM 0 HG12 VAL A 91 -14.600 -6.703 -1.437 1.00 1.43 H new ATOM 0 HG13 VAL A 91 -13.638 -7.401 -2.761 1.00 1.43 H new ATOM 0 HG21 VAL A 91 -11.846 -4.963 -3.138 1.00 1.51 H new ATOM 0 HG22 VAL A 91 -12.614 -5.831 -4.489 1.00 1.51 H new ATOM 0 HG23 VAL A 91 -12.859 -4.078 -4.304 1.00 1.51 H new ATOM 296 N CYS A 92 -16.705 -6.690 -2.411 1.00 0.79 N ATOM 297 CA CYS A 92 -17.853 -6.949 -1.571 1.00 0.64 C ATOM 298 C CYS A 92 -17.477 -6.792 -0.099 1.00 0.62 C ATOM 299 O CYS A 92 -16.403 -6.270 0.209 1.00 1.20 O ATOM 300 CB CYS A 92 -18.399 -8.348 -1.855 1.00 1.10 C ATOM 301 SG CYS A 92 -17.166 -9.662 -1.728 1.00 1.91 S ATOM 0 H CYS A 92 -16.118 -7.507 -2.581 1.00 0.79 H new ATOM 0 HA CYS A 92 -18.635 -6.224 -1.797 1.00 0.64 H new ATOM 0 HB2 CYS A 92 -19.211 -8.558 -1.158 1.00 1.10 H new ATOM 0 HB3 CYS A 92 -18.827 -8.362 -2.857 1.00 1.10 H new ATOM 0 HG CYS A 92 -16.244 -9.481 -2.627 1.00 1.91 H new ATOM 307 N SER A 93 -18.390 -7.197 0.783 1.00 0.69 N ATOM 308 CA SER A 93 -18.259 -7.042 2.235 1.00 1.02 C ATOM 309 C SER A 93 -16.824 -7.230 2.757 1.00 0.58 C ATOM 310 O SER A 93 -16.050 -8.006 2.190 1.00 0.73 O ATOM 311 CB SER A 93 -19.188 -8.045 2.914 1.00 1.83 C ATOM 312 OG SER A 93 -20.497 -7.953 2.380 1.00 2.58 O ATOM 0 H SER A 93 -19.260 -7.651 0.505 1.00 0.69 H new ATOM 0 HA SER A 93 -18.532 -6.014 2.475 1.00 1.02 H new ATOM 0 HB2 SER A 93 -18.804 -9.056 2.777 1.00 1.83 H new ATOM 0 HB3 SER A 93 -19.213 -7.857 3.987 1.00 1.83 H new ATOM 0 HG SER A 93 -21.079 -8.604 2.825 1.00 2.58 H new ATOM 318 N PRO A 94 -16.496 -6.533 3.875 1.00 0.78 N ATOM 319 CA PRO A 94 -15.164 -6.439 4.475 1.00 0.67 C ATOM 320 C PRO A 94 -14.192 -7.559 4.105 1.00 0.53 C ATOM 321 O PRO A 94 -14.481 -8.749 4.261 1.00 0.59 O ATOM 322 CB PRO A 94 -15.495 -6.480 5.964 1.00 0.93 C ATOM 323 CG PRO A 94 -16.860 -5.861 6.084 1.00 1.39 C ATOM 324 CD PRO A 94 -17.436 -5.755 4.687 1.00 1.43 C ATOM 0 HA PRO A 94 -14.635 -5.552 4.126 1.00 0.67 H new ATOM 0 HB2 PRO A 94 -15.493 -7.503 6.339 1.00 0.93 H new ATOM 0 HB3 PRO A 94 -14.759 -5.925 6.546 1.00 0.93 H new ATOM 0 HG2 PRO A 94 -17.503 -6.471 6.719 1.00 1.39 H new ATOM 0 HG3 PRO A 94 -16.795 -4.877 6.548 1.00 1.39 H new ATOM 0 HD2 PRO A 94 -18.445 -6.163 4.636 1.00 1.43 H new ATOM 0 HD3 PRO A 94 -17.494 -4.719 4.353 1.00 1.43 H new ATOM 332 N PHE A 95 -13.023 -7.150 3.639 1.00 0.43 N ATOM 333 CA PHE A 95 -12.001 -8.069 3.175 1.00 0.40 C ATOM 334 C PHE A 95 -10.633 -7.560 3.625 1.00 0.33 C ATOM 335 O PHE A 95 -10.484 -6.377 3.934 1.00 0.32 O ATOM 336 CB PHE A 95 -12.077 -8.170 1.643 1.00 0.46 C ATOM 337 CG PHE A 95 -11.185 -9.223 1.038 1.00 0.50 C ATOM 338 CD1 PHE A 95 -10.093 -8.867 0.258 1.00 1.26 C ATOM 339 CD2 PHE A 95 -11.439 -10.572 1.246 1.00 1.35 C ATOM 340 CE1 PHE A 95 -9.277 -9.832 -0.300 1.00 1.33 C ATOM 341 CE2 PHE A 95 -10.624 -11.540 0.689 1.00 1.36 C ATOM 342 CZ PHE A 95 -9.542 -11.169 -0.083 1.00 0.68 C ATOM 0 H PHE A 95 -12.757 -6.168 3.572 1.00 0.43 H new ATOM 0 HA PHE A 95 -12.157 -9.062 3.596 1.00 0.40 H new ATOM 0 HB2 PHE A 95 -13.108 -8.378 1.357 1.00 0.46 H new ATOM 0 HB3 PHE A 95 -11.816 -7.202 1.215 1.00 0.46 H new ATOM 0 HD1 PHE A 95 -9.879 -7.823 0.085 1.00 1.26 H new ATOM 0 HD2 PHE A 95 -12.283 -10.869 1.850 1.00 1.35 H new ATOM 0 HE1 PHE A 95 -8.432 -9.540 -0.906 1.00 1.33 H new ATOM 0 HE2 PHE A 95 -10.834 -12.586 0.858 1.00 1.36 H new ATOM 0 HZ PHE A 95 -8.903 -11.924 -0.517 1.00 0.68 H new ATOM 352 N ALA A 96 -9.657 -8.458 3.706 1.00 0.37 N ATOM 353 CA ALA A 96 -8.297 -8.082 4.077 1.00 0.38 C ATOM 354 C ALA A 96 -7.560 -7.510 2.875 1.00 0.35 C ATOM 355 O ALA A 96 -7.443 -8.163 1.836 1.00 0.51 O ATOM 356 CB ALA A 96 -7.544 -9.276 4.642 1.00 0.49 C ATOM 0 H ALA A 96 -9.782 -9.453 3.519 1.00 0.37 H new ATOM 0 HA ALA A 96 -8.352 -7.315 4.850 1.00 0.38 H new ATOM 0 HB1 ALA A 96 -6.532 -8.973 4.912 1.00 0.49 H new ATOM 0 HB2 ALA A 96 -8.061 -9.646 5.528 1.00 0.49 H new ATOM 0 HB3 ALA A 96 -7.498 -10.066 3.892 1.00 0.49 H new ATOM 362 N LEU A 97 -7.058 -6.297 3.029 1.00 0.24 N ATOM 363 CA LEU A 97 -6.425 -5.580 1.933 1.00 0.22 C ATOM 364 C LEU A 97 -4.920 -5.776 1.972 1.00 0.22 C ATOM 365 O LEU A 97 -4.340 -5.958 3.043 1.00 0.24 O ATOM 366 CB LEU A 97 -6.778 -4.089 2.001 1.00 0.23 C ATOM 367 CG LEU A 97 -8.072 -3.680 1.283 1.00 0.46 C ATOM 368 CD1 LEU A 97 -9.205 -4.644 1.585 1.00 1.40 C ATOM 369 CD2 LEU A 97 -8.474 -2.272 1.682 1.00 1.07 C ATOM 0 H LEU A 97 -7.077 -5.783 3.910 1.00 0.24 H new ATOM 0 HA LEU A 97 -6.798 -5.981 0.991 1.00 0.22 H new ATOM 0 HB2 LEU A 97 -6.859 -3.801 3.049 1.00 0.23 H new ATOM 0 HB3 LEU A 97 -5.952 -3.519 1.576 1.00 0.23 H new ATOM 0 HG LEU A 97 -7.878 -3.710 0.211 1.00 0.46 H new ATOM 0 HD11 LEU A 97 -10.105 -4.323 1.060 1.00 1.40 H new ATOM 0 HD12 LEU A 97 -8.929 -5.645 1.254 1.00 1.40 H new ATOM 0 HD13 LEU A 97 -9.396 -4.657 2.658 1.00 1.40 H new ATOM 0 HD21 LEU A 97 -9.393 -1.996 1.165 1.00 1.07 H new ATOM 0 HD22 LEU A 97 -8.637 -2.232 2.759 1.00 1.07 H new ATOM 0 HD23 LEU A 97 -7.681 -1.576 1.409 1.00 1.07 H new ATOM 381 N PHE A 98 -4.289 -5.740 0.809 1.00 0.23 N ATOM 382 CA PHE A 98 -2.868 -6.005 0.723 1.00 0.23 C ATOM 383 C PHE A 98 -2.226 -5.263 -0.438 1.00 0.22 C ATOM 384 O PHE A 98 -2.901 -4.830 -1.372 1.00 0.25 O ATOM 385 CB PHE A 98 -2.618 -7.512 0.587 1.00 0.24 C ATOM 386 CG PHE A 98 -3.331 -8.154 -0.574 1.00 0.26 C ATOM 387 CD1 PHE A 98 -2.706 -8.290 -1.804 1.00 1.26 C ATOM 388 CD2 PHE A 98 -4.627 -8.629 -0.429 1.00 1.18 C ATOM 389 CE1 PHE A 98 -3.361 -8.886 -2.865 1.00 1.31 C ATOM 390 CE2 PHE A 98 -5.284 -9.221 -1.488 1.00 1.17 C ATOM 391 CZ PHE A 98 -4.651 -9.350 -2.706 1.00 0.40 C ATOM 0 H PHE A 98 -4.739 -5.531 -0.082 1.00 0.23 H new ATOM 0 HA PHE A 98 -2.409 -5.644 1.643 1.00 0.23 H new ATOM 0 HB2 PHE A 98 -1.547 -7.683 0.480 1.00 0.24 H new ATOM 0 HB3 PHE A 98 -2.930 -8.005 1.508 1.00 0.24 H new ATOM 0 HD1 PHE A 98 -1.697 -7.927 -1.934 1.00 1.26 H new ATOM 0 HD2 PHE A 98 -5.127 -8.534 0.524 1.00 1.18 H new ATOM 0 HE1 PHE A 98 -2.864 -8.989 -3.818 1.00 1.31 H new ATOM 0 HE2 PHE A 98 -6.294 -9.583 -1.363 1.00 1.17 H new ATOM 0 HZ PHE A 98 -5.164 -9.814 -3.535 1.00 0.40 H new ATOM 401 N ALA A 99 -0.918 -5.107 -0.342 1.00 0.20 N ATOM 402 CA ALA A 99 -0.115 -4.539 -1.408 1.00 0.19 C ATOM 403 C ALA A 99 1.211 -5.275 -1.478 1.00 0.17 C ATOM 404 O ALA A 99 1.785 -5.630 -0.450 1.00 0.19 O ATOM 405 CB ALA A 99 0.107 -3.052 -1.192 1.00 0.21 C ATOM 0 H ALA A 99 -0.380 -5.373 0.483 1.00 0.20 H new ATOM 0 HA ALA A 99 -0.645 -4.656 -2.353 1.00 0.19 H new ATOM 0 HB1 ALA A 99 0.712 -2.652 -2.006 1.00 0.21 H new ATOM 0 HB2 ALA A 99 -0.855 -2.540 -1.170 1.00 0.21 H new ATOM 0 HB3 ALA A 99 0.624 -2.895 -0.245 1.00 0.21 H new ATOM 411 N VAL A 100 1.678 -5.530 -2.679 1.00 0.17 N ATOM 412 CA VAL A 100 2.904 -6.279 -2.876 1.00 0.18 C ATOM 413 C VAL A 100 3.985 -5.397 -3.479 1.00 0.19 C ATOM 414 O VAL A 100 3.790 -4.785 -4.529 1.00 0.22 O ATOM 415 CB VAL A 100 2.665 -7.490 -3.793 1.00 0.23 C ATOM 416 CG1 VAL A 100 3.951 -8.257 -4.039 1.00 0.26 C ATOM 417 CG2 VAL A 100 1.600 -8.405 -3.207 1.00 0.25 C ATOM 0 H VAL A 100 1.225 -5.228 -3.542 1.00 0.17 H new ATOM 0 HA VAL A 100 3.234 -6.632 -1.899 1.00 0.18 H new ATOM 0 HB VAL A 100 2.310 -7.116 -4.753 1.00 0.23 H new ATOM 0 HG11 VAL A 100 3.749 -9.107 -4.691 1.00 0.26 H new ATOM 0 HG12 VAL A 100 4.681 -7.601 -4.514 1.00 0.26 H new ATOM 0 HG13 VAL A 100 4.349 -8.615 -3.089 1.00 0.26 H new ATOM 0 HG21 VAL A 100 1.446 -9.256 -3.871 1.00 0.25 H new ATOM 0 HG22 VAL A 100 1.925 -8.762 -2.230 1.00 0.25 H new ATOM 0 HG23 VAL A 100 0.666 -7.854 -3.100 1.00 0.25 H new ATOM 427 N LEU A 101 5.125 -5.346 -2.814 1.00 0.19 N ATOM 428 CA LEU A 101 6.245 -4.551 -3.276 1.00 0.19 C ATOM 429 C LEU A 101 7.332 -5.459 -3.827 1.00 0.21 C ATOM 430 O LEU A 101 7.868 -6.311 -3.119 1.00 0.23 O ATOM 431 CB LEU A 101 6.820 -3.668 -2.161 1.00 0.19 C ATOM 432 CG LEU A 101 5.854 -2.643 -1.555 1.00 0.22 C ATOM 433 CD1 LEU A 101 4.992 -3.279 -0.473 1.00 0.30 C ATOM 434 CD2 LEU A 101 6.624 -1.453 -1.001 1.00 0.21 C ATOM 0 H LEU A 101 5.299 -5.851 -1.945 1.00 0.19 H new ATOM 0 HA LEU A 101 5.879 -3.893 -4.064 1.00 0.19 H new ATOM 0 HB2 LEU A 101 7.182 -4.315 -1.362 1.00 0.19 H new ATOM 0 HB3 LEU A 101 7.685 -3.135 -2.556 1.00 0.19 H new ATOM 0 HG LEU A 101 5.191 -2.289 -2.345 1.00 0.22 H new ATOM 0 HD11 LEU A 101 4.316 -2.531 -0.060 1.00 0.30 H new ATOM 0 HD12 LEU A 101 4.411 -4.095 -0.903 1.00 0.30 H new ATOM 0 HD13 LEU A 101 5.631 -3.668 0.320 1.00 0.30 H new ATOM 0 HD21 LEU A 101 5.925 -0.734 -0.574 1.00 0.21 H new ATOM 0 HD22 LEU A 101 7.312 -1.793 -0.227 1.00 0.21 H new ATOM 0 HD23 LEU A 101 7.187 -0.978 -1.804 1.00 0.21 H new ATOM 446 N GLU A 102 7.640 -5.278 -5.092 1.00 0.24 N ATOM 447 CA GLU A 102 8.654 -6.065 -5.762 1.00 0.29 C ATOM 448 C GLU A 102 9.939 -5.256 -5.864 1.00 0.28 C ATOM 449 O GLU A 102 9.904 -4.074 -6.214 1.00 0.26 O ATOM 450 CB GLU A 102 8.155 -6.458 -7.156 1.00 0.34 C ATOM 451 CG GLU A 102 9.108 -7.352 -7.933 1.00 0.41 C ATOM 452 CD GLU A 102 8.517 -7.824 -9.246 1.00 0.53 C ATOM 453 OE1 GLU A 102 8.484 -7.034 -10.214 1.00 1.32 O ATOM 454 OE2 GLU A 102 8.075 -8.992 -9.317 1.00 0.95 O ATOM 0 H GLU A 102 7.194 -4.580 -5.687 1.00 0.24 H new ATOM 0 HA GLU A 102 8.855 -6.972 -5.192 1.00 0.29 H new ATOM 0 HB2 GLU A 102 7.197 -6.968 -7.056 1.00 0.34 H new ATOM 0 HB3 GLU A 102 7.974 -5.551 -7.733 1.00 0.34 H new ATOM 0 HG2 GLU A 102 10.033 -6.809 -8.128 1.00 0.41 H new ATOM 0 HG3 GLU A 102 9.369 -8.217 -7.323 1.00 0.41 H new ATOM 461 N ASN A 103 11.065 -5.870 -5.530 1.00 0.38 N ATOM 462 CA ASN A 103 12.345 -5.192 -5.661 1.00 0.44 C ATOM 463 C ASN A 103 12.847 -5.300 -7.092 1.00 0.37 C ATOM 464 O ASN A 103 13.275 -6.360 -7.543 1.00 0.51 O ATOM 465 CB ASN A 103 13.392 -5.725 -4.663 1.00 0.68 C ATOM 466 CG ASN A 103 13.544 -7.236 -4.654 1.00 0.87 C ATOM 467 OD1 ASN A 103 12.863 -7.931 -3.902 1.00 1.76 O ATOM 468 ND2 ASN A 103 14.458 -7.753 -5.459 1.00 1.64 N ATOM 0 H ASN A 103 11.119 -6.823 -5.171 1.00 0.38 H new ATOM 0 HA ASN A 103 12.191 -4.141 -5.418 1.00 0.44 H new ATOM 0 HB2 ASN A 103 14.358 -5.277 -4.896 1.00 0.68 H new ATOM 0 HB3 ASN A 103 13.121 -5.394 -3.660 1.00 0.68 H new ATOM 0 HD21 ASN A 103 14.617 -8.760 -5.470 1.00 1.64 H new ATOM 0 HD22 ASN A 103 15.004 -7.144 -6.069 1.00 1.64 H new ATOM 475 N THR A 104 12.759 -4.201 -7.818 1.00 0.34 N ATOM 476 CA THR A 104 13.194 -4.171 -9.198 1.00 0.38 C ATOM 477 C THR A 104 14.601 -3.599 -9.325 1.00 0.50 C ATOM 478 O THR A 104 14.822 -2.559 -9.947 1.00 0.70 O ATOM 479 CB THR A 104 12.201 -3.383 -10.066 1.00 0.55 C ATOM 480 OG1 THR A 104 11.694 -2.253 -9.340 1.00 0.77 O ATOM 481 CG2 THR A 104 11.045 -4.275 -10.489 1.00 0.73 C ATOM 0 H THR A 104 12.389 -3.316 -7.472 1.00 0.34 H new ATOM 0 HA THR A 104 13.222 -5.199 -9.560 1.00 0.38 H new ATOM 0 HB THR A 104 12.725 -3.032 -10.955 1.00 0.55 H new ATOM 0 HG1 THR A 104 12.438 -1.669 -9.082 1.00 0.77 H new ATOM 0 HG21 THR A 104 10.350 -3.703 -11.103 1.00 0.73 H new ATOM 0 HG22 THR A 104 11.428 -5.118 -11.064 1.00 0.73 H new ATOM 0 HG23 THR A 104 10.527 -4.644 -9.604 1.00 0.73 H new ATOM 489 N GLY A 105 15.551 -4.292 -8.717 1.00 0.52 N ATOM 490 CA GLY A 105 16.939 -3.895 -8.806 1.00 0.72 C ATOM 491 C GLY A 105 17.524 -3.575 -7.455 1.00 0.66 C ATOM 492 O GLY A 105 18.705 -3.809 -7.201 1.00 0.80 O ATOM 0 H GLY A 105 15.383 -5.129 -8.159 1.00 0.52 H new ATOM 0 HA2 GLY A 105 17.516 -4.695 -9.270 1.00 0.72 H new ATOM 0 HA3 GLY A 105 17.025 -3.023 -9.454 1.00 0.72 H new ATOM 496 N GLU A 106 16.692 -3.041 -6.587 1.00 0.60 N ATOM 497 CA GLU A 106 17.110 -2.691 -5.248 1.00 0.56 C ATOM 498 C GLU A 106 16.282 -3.459 -4.230 1.00 0.65 C ATOM 499 O GLU A 106 15.109 -3.158 -4.010 1.00 1.05 O ATOM 500 CB GLU A 106 16.967 -1.189 -5.035 1.00 0.68 C ATOM 501 CG GLU A 106 17.855 -0.355 -5.942 1.00 1.25 C ATOM 502 CD GLU A 106 17.707 1.127 -5.684 1.00 1.91 C ATOM 503 OE1 GLU A 106 17.578 1.515 -4.507 1.00 2.54 O ATOM 504 OE2 GLU A 106 17.734 1.913 -6.657 1.00 2.47 O ATOM 0 H GLU A 106 15.713 -2.838 -6.788 1.00 0.60 H new ATOM 0 HA GLU A 106 18.158 -2.960 -5.116 1.00 0.56 H new ATOM 0 HB2 GLU A 106 15.927 -0.905 -5.199 1.00 0.68 H new ATOM 0 HB3 GLU A 106 17.201 -0.955 -3.997 1.00 0.68 H new ATOM 0 HG2 GLU A 106 18.895 -0.645 -5.795 1.00 1.25 H new ATOM 0 HG3 GLU A 106 17.609 -0.567 -6.983 1.00 1.25 H new ATOM 511 N LYS A 107 16.898 -4.465 -3.631 1.00 0.61 N ATOM 512 CA LYS A 107 16.214 -5.330 -2.681 1.00 0.69 C ATOM 513 C LYS A 107 16.217 -4.728 -1.277 1.00 0.66 C ATOM 514 O LYS A 107 17.176 -4.070 -0.864 1.00 0.76 O ATOM 515 CB LYS A 107 16.855 -6.730 -2.662 1.00 0.86 C ATOM 516 CG LYS A 107 18.194 -6.815 -1.934 1.00 1.37 C ATOM 517 CD LYS A 107 19.315 -6.135 -2.703 1.00 1.80 C ATOM 518 CE LYS A 107 20.626 -6.199 -1.939 1.00 2.66 C ATOM 519 NZ LYS A 107 21.759 -5.649 -2.729 1.00 3.32 N ATOM 0 H LYS A 107 17.877 -4.705 -3.787 1.00 0.61 H new ATOM 0 HA LYS A 107 15.178 -5.422 -3.006 1.00 0.69 H new ATOM 0 HB2 LYS A 107 16.159 -7.426 -2.194 1.00 0.86 H new ATOM 0 HB3 LYS A 107 16.995 -7.063 -3.690 1.00 0.86 H new ATOM 0 HG2 LYS A 107 18.100 -6.354 -0.951 1.00 1.37 H new ATOM 0 HG3 LYS A 107 18.451 -7.862 -1.772 1.00 1.37 H new ATOM 0 HD2 LYS A 107 19.434 -6.613 -3.675 1.00 1.80 H new ATOM 0 HD3 LYS A 107 19.051 -5.094 -2.890 1.00 1.80 H new ATOM 0 HE2 LYS A 107 20.530 -5.642 -1.007 1.00 2.66 H new ATOM 0 HE3 LYS A 107 20.839 -7.234 -1.671 1.00 2.66 H new ATOM 0 HZ1 LYS A 107 22.525 -5.364 -2.086 1.00 3.32 H new ATOM 0 HZ2 LYS A 107 22.110 -6.376 -3.385 1.00 3.32 H new ATOM 0 HZ3 LYS A 107 21.436 -4.822 -3.270 1.00 3.32 H new ATOM 533 N LEU A 108 15.129 -4.965 -0.553 1.00 0.59 N ATOM 534 CA LEU A 108 14.980 -4.475 0.810 1.00 0.57 C ATOM 535 C LEU A 108 15.937 -5.229 1.735 1.00 0.63 C ATOM 536 O LEU A 108 15.653 -6.346 2.172 1.00 0.74 O ATOM 537 CB LEU A 108 13.513 -4.641 1.256 1.00 0.60 C ATOM 538 CG LEU A 108 13.097 -3.921 2.550 1.00 0.58 C ATOM 539 CD1 LEU A 108 13.494 -4.718 3.783 1.00 0.61 C ATOM 540 CD2 LEU A 108 13.704 -2.528 2.603 1.00 0.56 C ATOM 0 H LEU A 108 14.330 -5.500 -0.893 1.00 0.59 H new ATOM 0 HA LEU A 108 15.232 -3.416 0.858 1.00 0.57 H new ATOM 0 HB2 LEU A 108 12.870 -4.288 0.449 1.00 0.60 H new ATOM 0 HB3 LEU A 108 13.314 -5.705 1.380 1.00 0.60 H new ATOM 0 HG LEU A 108 12.011 -3.832 2.545 1.00 0.58 H new ATOM 0 HD11 LEU A 108 13.185 -4.180 4.679 1.00 0.61 H new ATOM 0 HD12 LEU A 108 13.007 -5.693 3.759 1.00 0.61 H new ATOM 0 HD13 LEU A 108 14.575 -4.853 3.796 1.00 0.61 H new ATOM 0 HD21 LEU A 108 13.399 -2.033 3.525 1.00 0.56 H new ATOM 0 HD22 LEU A 108 14.791 -2.603 2.574 1.00 0.56 H new ATOM 0 HD23 LEU A 108 13.358 -1.947 1.748 1.00 0.56 H new ATOM 552 N LYS A 109 17.082 -4.618 2.006 1.00 0.62 N ATOM 553 CA LYS A 109 18.115 -5.260 2.807 1.00 0.73 C ATOM 554 C LYS A 109 18.633 -4.342 3.915 1.00 0.75 C ATOM 555 O LYS A 109 18.937 -4.797 5.017 1.00 1.15 O ATOM 556 CB LYS A 109 19.275 -5.671 1.894 1.00 0.92 C ATOM 557 CG LYS A 109 20.420 -6.365 2.614 1.00 1.17 C ATOM 558 CD LYS A 109 21.615 -6.548 1.690 1.00 1.66 C ATOM 559 CE LYS A 109 22.772 -7.248 2.387 1.00 2.07 C ATOM 560 NZ LYS A 109 22.465 -8.671 2.689 1.00 2.72 N ATOM 0 H LYS A 109 17.319 -3.680 1.683 1.00 0.62 H new ATOM 0 HA LYS A 109 17.677 -6.136 3.285 1.00 0.73 H new ATOM 0 HB2 LYS A 109 18.894 -6.334 1.118 1.00 0.92 H new ATOM 0 HB3 LYS A 109 19.661 -4.783 1.393 1.00 0.92 H new ATOM 0 HG2 LYS A 109 20.715 -5.779 3.484 1.00 1.17 H new ATOM 0 HG3 LYS A 109 20.088 -7.336 2.981 1.00 1.17 H new ATOM 0 HD2 LYS A 109 21.313 -7.127 0.817 1.00 1.66 H new ATOM 0 HD3 LYS A 109 21.945 -5.575 1.328 1.00 1.66 H new ATOM 0 HE2 LYS A 109 23.660 -7.195 1.757 1.00 2.07 H new ATOM 0 HE3 LYS A 109 23.007 -6.724 3.313 1.00 2.07 H new ATOM 0 HZ1 LYS A 109 23.314 -9.136 3.070 1.00 2.72 H new ATOM 0 HZ2 LYS A 109 21.699 -8.720 3.391 1.00 2.72 H new ATOM 0 HZ3 LYS A 109 22.167 -9.154 1.818 1.00 2.72 H new ATOM 574 N LYS A 110 18.725 -3.049 3.631 1.00 0.62 N ATOM 575 CA LYS A 110 19.425 -2.131 4.525 1.00 0.73 C ATOM 576 C LYS A 110 18.481 -1.223 5.310 1.00 0.77 C ATOM 577 O LYS A 110 18.920 -0.225 5.880 1.00 1.53 O ATOM 578 CB LYS A 110 20.415 -1.276 3.730 1.00 0.93 C ATOM 579 CG LYS A 110 21.523 -2.084 3.069 1.00 1.14 C ATOM 580 CD LYS A 110 22.523 -1.190 2.353 1.00 1.46 C ATOM 581 CE LYS A 110 23.218 -0.230 3.310 1.00 1.80 C ATOM 582 NZ LYS A 110 23.966 -0.945 4.380 1.00 1.59 N ATOM 0 H LYS A 110 18.329 -2.614 2.798 1.00 0.62 H new ATOM 0 HA LYS A 110 19.955 -2.748 5.251 1.00 0.73 H new ATOM 0 HB2 LYS A 110 19.872 -0.724 2.963 1.00 0.93 H new ATOM 0 HB3 LYS A 110 20.862 -0.538 4.396 1.00 0.93 H new ATOM 0 HG2 LYS A 110 22.040 -2.677 3.823 1.00 1.14 H new ATOM 0 HG3 LYS A 110 21.087 -2.785 2.357 1.00 1.14 H new ATOM 0 HD2 LYS A 110 23.269 -1.808 1.854 1.00 1.46 H new ATOM 0 HD3 LYS A 110 22.010 -0.621 1.578 1.00 1.46 H new ATOM 0 HE2 LYS A 110 23.906 0.404 2.750 1.00 1.80 H new ATOM 0 HE3 LYS A 110 22.477 0.427 3.765 1.00 1.80 H new ATOM 0 HZ1 LYS A 110 24.570 -0.270 4.892 1.00 1.59 H new ATOM 0 HZ2 LYS A 110 23.293 -1.379 5.043 1.00 1.59 H new ATOM 0 HZ3 LYS A 110 24.559 -1.686 3.954 1.00 1.59 H new ATOM 596 N SER A 111 17.201 -1.565 5.349 1.00 0.51 N ATOM 597 CA SER A 111 16.216 -0.765 6.074 1.00 0.52 C ATOM 598 C SER A 111 14.843 -1.419 6.003 1.00 0.48 C ATOM 599 O SER A 111 14.729 -2.579 5.614 1.00 0.86 O ATOM 600 CB SER A 111 16.161 0.650 5.495 1.00 0.72 C ATOM 601 OG SER A 111 16.044 0.617 4.087 1.00 1.55 O ATOM 0 H SER A 111 16.817 -2.390 4.888 1.00 0.51 H new ATOM 0 HA SER A 111 16.516 -0.706 7.120 1.00 0.52 H new ATOM 0 HB2 SER A 111 15.315 1.189 5.921 1.00 0.72 H new ATOM 0 HB3 SER A 111 17.061 1.197 5.776 1.00 0.72 H new ATOM 0 HG SER A 111 15.154 0.288 3.840 1.00 1.55 H new ATOM 607 N LYS A 112 13.815 -0.684 6.409 1.00 0.39 N ATOM 608 CA LYS A 112 12.442 -1.166 6.344 1.00 0.32 C ATOM 609 C LYS A 112 11.525 -0.066 5.818 1.00 0.28 C ATOM 610 O LYS A 112 11.601 1.081 6.263 1.00 0.33 O ATOM 611 CB LYS A 112 11.965 -1.632 7.724 1.00 0.45 C ATOM 612 CG LYS A 112 12.802 -2.760 8.306 1.00 0.55 C ATOM 613 CD LYS A 112 12.268 -3.223 9.651 1.00 0.69 C ATOM 614 CE LYS A 112 13.129 -4.332 10.234 1.00 0.84 C ATOM 615 NZ LYS A 112 12.591 -4.834 11.523 1.00 1.53 N ATOM 0 H LYS A 112 13.909 0.257 6.790 1.00 0.39 H new ATOM 0 HA LYS A 112 12.408 -2.016 5.662 1.00 0.32 H new ATOM 0 HB2 LYS A 112 11.983 -0.786 8.411 1.00 0.45 H new ATOM 0 HB3 LYS A 112 10.928 -1.961 7.650 1.00 0.45 H new ATOM 0 HG2 LYS A 112 12.814 -3.600 7.611 1.00 0.55 H new ATOM 0 HG3 LYS A 112 13.833 -2.426 8.420 1.00 0.55 H new ATOM 0 HD2 LYS A 112 12.238 -2.381 10.342 1.00 0.69 H new ATOM 0 HD3 LYS A 112 11.244 -3.577 9.536 1.00 0.69 H new ATOM 0 HE2 LYS A 112 13.191 -5.155 9.522 1.00 0.84 H new ATOM 0 HE3 LYS A 112 14.144 -3.963 10.384 1.00 0.84 H new ATOM 0 HZ1 LYS A 112 13.207 -5.589 11.886 1.00 1.53 H new ATOM 0 HZ2 LYS A 112 12.555 -4.055 12.211 1.00 1.53 H new ATOM 0 HZ3 LYS A 112 11.633 -5.210 11.376 1.00 1.53 H new ATOM 629 N TRP A 113 10.675 -0.419 4.862 1.00 0.24 N ATOM 630 CA TRP A 113 9.759 0.539 4.251 1.00 0.22 C ATOM 631 C TRP A 113 8.534 0.769 5.122 1.00 0.21 C ATOM 632 O TRP A 113 7.970 -0.172 5.686 1.00 0.25 O ATOM 633 CB TRP A 113 9.337 0.069 2.856 1.00 0.22 C ATOM 634 CG TRP A 113 10.345 0.396 1.799 1.00 0.23 C ATOM 635 CD1 TRP A 113 11.677 0.102 1.823 1.00 0.24 C ATOM 636 CD2 TRP A 113 10.107 1.078 0.559 1.00 0.24 C ATOM 637 NE1 TRP A 113 12.282 0.569 0.686 1.00 0.25 N ATOM 638 CE2 TRP A 113 11.343 1.168 -0.105 1.00 0.25 C ATOM 639 CE3 TRP A 113 8.973 1.628 -0.055 1.00 0.28 C ATOM 640 CZ2 TRP A 113 11.481 1.780 -1.345 1.00 0.29 C ATOM 641 CZ3 TRP A 113 9.115 2.233 -1.291 1.00 0.32 C ATOM 642 CH2 TRP A 113 10.361 2.304 -1.922 1.00 0.32 C ATOM 0 H TRP A 113 10.600 -1.366 4.491 1.00 0.24 H new ATOM 0 HA TRP A 113 10.289 1.487 4.157 1.00 0.22 H new ATOM 0 HB2 TRP A 113 9.175 -1.009 2.875 1.00 0.22 H new ATOM 0 HB3 TRP A 113 8.384 0.530 2.596 1.00 0.22 H new ATOM 0 HD1 TRP A 113 12.181 -0.422 2.622 1.00 0.24 H new ATOM 0 HE1 TRP A 113 13.274 0.483 0.465 1.00 0.25 H new ATOM 0 HE3 TRP A 113 8.008 1.580 0.427 1.00 0.28 H new ATOM 0 HZ2 TRP A 113 12.442 1.839 -1.835 1.00 0.29 H new ATOM 0 HZ3 TRP A 113 8.249 2.658 -1.777 1.00 0.32 H new ATOM 0 HH2 TRP A 113 10.438 2.784 -2.886 1.00 0.32 H new ATOM 653 N LYS A 114 8.140 2.029 5.221 1.00 0.20 N ATOM 654 CA LYS A 114 6.992 2.428 6.015 1.00 0.24 C ATOM 655 C LYS A 114 5.755 2.527 5.134 1.00 0.20 C ATOM 656 O LYS A 114 5.799 3.126 4.057 1.00 0.24 O ATOM 657 CB LYS A 114 7.268 3.784 6.666 1.00 0.37 C ATOM 658 CG LYS A 114 6.148 4.281 7.565 1.00 0.58 C ATOM 659 CD LYS A 114 6.153 3.588 8.918 1.00 1.04 C ATOM 660 CE LYS A 114 5.026 4.106 9.798 1.00 1.08 C ATOM 661 NZ LYS A 114 5.072 3.532 11.168 1.00 1.66 N ATOM 0 H LYS A 114 8.609 2.804 4.752 1.00 0.20 H new ATOM 0 HA LYS A 114 6.817 1.680 6.788 1.00 0.24 H new ATOM 0 HB2 LYS A 114 8.185 3.714 7.251 1.00 0.37 H new ATOM 0 HB3 LYS A 114 7.445 4.521 5.883 1.00 0.37 H new ATOM 0 HG2 LYS A 114 6.249 5.357 7.708 1.00 0.58 H new ATOM 0 HG3 LYS A 114 5.189 4.113 7.075 1.00 0.58 H new ATOM 0 HD2 LYS A 114 6.047 2.512 8.780 1.00 1.04 H new ATOM 0 HD3 LYS A 114 7.111 3.753 9.412 1.00 1.04 H new ATOM 0 HE2 LYS A 114 5.086 5.193 9.859 1.00 1.08 H new ATOM 0 HE3 LYS A 114 4.068 3.865 9.337 1.00 1.08 H new ATOM 0 HZ1 LYS A 114 4.285 3.914 11.731 1.00 1.66 H new ATOM 0 HZ2 LYS A 114 4.988 2.497 11.114 1.00 1.66 H new ATOM 0 HZ3 LYS A 114 5.975 3.783 11.620 1.00 1.66 H new ATOM 675 N TRP A 115 4.658 1.941 5.586 1.00 0.17 N ATOM 676 CA TRP A 115 3.414 2.003 4.838 1.00 0.15 C ATOM 677 C TRP A 115 2.264 2.446 5.726 1.00 0.16 C ATOM 678 O TRP A 115 2.299 2.268 6.947 1.00 0.18 O ATOM 679 CB TRP A 115 3.089 0.647 4.209 1.00 0.15 C ATOM 680 CG TRP A 115 2.867 -0.450 5.209 1.00 0.16 C ATOM 681 CD1 TRP A 115 3.813 -1.279 5.726 1.00 0.19 C ATOM 682 CD2 TRP A 115 1.622 -0.842 5.804 1.00 0.17 C ATOM 683 NE1 TRP A 115 3.238 -2.161 6.605 1.00 0.22 N ATOM 684 CE2 TRP A 115 1.896 -1.915 6.671 1.00 0.20 C ATOM 685 CE3 TRP A 115 0.303 -0.392 5.691 1.00 0.18 C ATOM 686 CZ2 TRP A 115 0.905 -2.542 7.418 1.00 0.23 C ATOM 687 CZ3 TRP A 115 -0.681 -1.016 6.434 1.00 0.20 C ATOM 688 CH2 TRP A 115 -0.374 -2.082 7.288 1.00 0.22 C ATOM 0 H TRP A 115 4.604 1.420 6.461 1.00 0.17 H new ATOM 0 HA TRP A 115 3.545 2.738 4.044 1.00 0.15 H new ATOM 0 HB2 TRP A 115 2.196 0.749 3.592 1.00 0.15 H new ATOM 0 HB3 TRP A 115 3.905 0.361 3.545 1.00 0.15 H new ATOM 0 HD1 TRP A 115 4.864 -1.247 5.480 1.00 0.19 H new ATOM 0 HE1 TRP A 115 3.733 -2.885 7.126 1.00 0.22 H new ATOM 0 HE3 TRP A 115 0.057 0.429 5.034 1.00 0.18 H new ATOM 0 HZ2 TRP A 115 1.139 -3.364 8.078 1.00 0.23 H new ATOM 0 HZ3 TRP A 115 -1.703 -0.676 6.355 1.00 0.20 H new ATOM 0 HH2 TRP A 115 -1.165 -2.550 7.855 1.00 0.22 H new ATOM 699 N GLU A 116 1.256 3.030 5.099 1.00 0.17 N ATOM 700 CA GLU A 116 0.028 3.400 5.781 1.00 0.20 C ATOM 701 C GLU A 116 -1.167 3.046 4.906 1.00 0.19 C ATOM 702 O GLU A 116 -1.144 3.286 3.696 1.00 0.25 O ATOM 703 CB GLU A 116 -0.011 4.903 6.062 1.00 0.32 C ATOM 704 CG GLU A 116 1.191 5.459 6.800 1.00 0.50 C ATOM 705 CD GLU A 116 1.128 6.969 6.885 1.00 0.64 C ATOM 706 OE1 GLU A 116 1.606 7.541 7.885 1.00 1.40 O ATOM 707 OE2 GLU A 116 0.578 7.594 5.949 1.00 1.22 O ATOM 0 H GLU A 116 1.266 3.260 4.105 1.00 0.17 H new ATOM 0 HA GLU A 116 -0.011 2.856 6.725 1.00 0.20 H new ATOM 0 HB2 GLU A 116 -0.109 5.430 5.113 1.00 0.32 H new ATOM 0 HB3 GLU A 116 -0.906 5.123 6.643 1.00 0.32 H new ATOM 0 HG2 GLU A 116 1.232 5.037 7.804 1.00 0.50 H new ATOM 0 HG3 GLU A 116 2.106 5.158 6.290 1.00 0.50 H new ATOM 714 N LEU A 117 -2.203 2.479 5.502 1.00 0.17 N ATOM 715 CA LEU A 117 -3.453 2.273 4.789 1.00 0.16 C ATOM 716 C LEU A 117 -4.326 3.499 4.968 1.00 0.15 C ATOM 717 O LEU A 117 -4.601 3.910 6.094 1.00 0.19 O ATOM 718 CB LEU A 117 -4.204 1.039 5.287 1.00 0.19 C ATOM 719 CG LEU A 117 -5.521 0.769 4.551 1.00 0.21 C ATOM 720 CD1 LEU A 117 -5.269 0.171 3.177 1.00 0.22 C ATOM 721 CD2 LEU A 117 -6.421 -0.130 5.371 1.00 0.25 C ATOM 0 H LEU A 117 -2.204 2.156 6.469 1.00 0.17 H new ATOM 0 HA LEU A 117 -3.219 2.112 3.737 1.00 0.16 H new ATOM 0 HB2 LEU A 117 -3.558 0.167 5.184 1.00 0.19 H new ATOM 0 HB3 LEU A 117 -4.412 1.158 6.350 1.00 0.19 H new ATOM 0 HG LEU A 117 -6.028 1.724 4.412 1.00 0.21 H new ATOM 0 HD11 LEU A 117 -6.221 -0.010 2.679 1.00 0.22 H new ATOM 0 HD12 LEU A 117 -4.674 0.864 2.582 1.00 0.22 H new ATOM 0 HD13 LEU A 117 -4.731 -0.771 3.283 1.00 0.22 H new ATOM 0 HD21 LEU A 117 -7.350 -0.308 4.829 1.00 0.25 H new ATOM 0 HD22 LEU A 117 -5.919 -1.080 5.552 1.00 0.25 H new ATOM 0 HD23 LEU A 117 -6.644 0.350 6.324 1.00 0.25 H new ATOM 733 N HIS A 118 -4.751 4.084 3.869 1.00 0.13 N ATOM 734 CA HIS A 118 -5.500 5.323 3.916 1.00 0.14 C ATOM 735 C HIS A 118 -6.953 5.103 3.535 1.00 0.18 C ATOM 736 O HIS A 118 -7.262 4.293 2.660 1.00 0.21 O ATOM 737 CB HIS A 118 -4.873 6.361 2.984 1.00 0.18 C ATOM 738 CG HIS A 118 -3.545 6.871 3.455 1.00 0.20 C ATOM 739 ND1 HIS A 118 -3.193 8.201 3.408 1.00 0.50 N ATOM 740 CD2 HIS A 118 -2.485 6.226 3.995 1.00 0.24 C ATOM 741 CE1 HIS A 118 -1.977 8.347 3.903 1.00 0.45 C ATOM 742 NE2 HIS A 118 -1.523 7.169 4.267 1.00 0.22 N ATOM 0 H HIS A 118 -4.591 3.721 2.929 1.00 0.13 H new ATOM 0 HA HIS A 118 -5.465 5.692 4.941 1.00 0.14 H new ATOM 0 HB2 HIS A 118 -4.753 5.921 1.994 1.00 0.18 H new ATOM 0 HB3 HIS A 118 -5.558 7.202 2.878 1.00 0.18 H new ATOM 0 HD2 HIS A 118 -2.409 5.164 4.179 1.00 0.24 H new ATOM 0 HE1 HIS A 118 -1.443 9.282 3.994 1.00 0.45 H new ATOM 0 HE2 HIS A 118 -0.610 6.985 4.682 1.00 0.22 H new ATOM 751 N LYS A 119 -7.830 5.812 4.220 1.00 0.22 N ATOM 752 CA LYS A 119 -9.237 5.849 3.874 1.00 0.29 C ATOM 753 C LYS A 119 -9.498 7.039 2.961 1.00 0.27 C ATOM 754 O LYS A 119 -9.608 8.176 3.421 1.00 0.43 O ATOM 755 CB LYS A 119 -10.096 5.953 5.138 1.00 0.43 C ATOM 756 CG LYS A 119 -11.573 6.194 4.863 1.00 0.70 C ATOM 757 CD LYS A 119 -12.187 5.069 4.049 1.00 0.84 C ATOM 758 CE LYS A 119 -13.629 5.369 3.684 1.00 1.04 C ATOM 759 NZ LYS A 119 -13.747 6.532 2.762 1.00 1.69 N ATOM 0 H LYS A 119 -7.586 6.379 5.032 1.00 0.22 H new ATOM 0 HA LYS A 119 -9.504 4.928 3.355 1.00 0.29 H new ATOM 0 HB2 LYS A 119 -9.989 5.034 5.714 1.00 0.43 H new ATOM 0 HB3 LYS A 119 -9.715 6.764 5.758 1.00 0.43 H new ATOM 0 HG2 LYS A 119 -12.107 6.292 5.808 1.00 0.70 H new ATOM 0 HG3 LYS A 119 -11.694 7.137 4.329 1.00 0.70 H new ATOM 0 HD2 LYS A 119 -11.605 4.917 3.140 1.00 0.84 H new ATOM 0 HD3 LYS A 119 -12.140 4.140 4.617 1.00 0.84 H new ATOM 0 HE2 LYS A 119 -14.074 4.491 3.216 1.00 1.04 H new ATOM 0 HE3 LYS A 119 -14.198 5.569 4.592 1.00 1.04 H new ATOM 0 HZ1 LYS A 119 -14.645 6.472 2.240 1.00 1.69 H new ATOM 0 HZ2 LYS A 119 -13.724 7.415 3.312 1.00 1.69 H new ATOM 0 HZ3 LYS A 119 -12.954 6.523 2.089 1.00 1.69 H new ATOM 773 N LEU A 120 -9.589 6.778 1.672 1.00 0.23 N ATOM 774 CA LEU A 120 -9.776 7.838 0.702 1.00 0.26 C ATOM 775 C LEU A 120 -11.262 8.044 0.457 1.00 0.34 C ATOM 776 O LEU A 120 -12.045 7.092 0.467 1.00 0.37 O ATOM 777 CB LEU A 120 -9.046 7.524 -0.616 1.00 0.24 C ATOM 778 CG LEU A 120 -7.510 7.462 -0.542 1.00 0.20 C ATOM 779 CD1 LEU A 120 -6.944 8.653 0.221 1.00 0.25 C ATOM 780 CD2 LEU A 120 -7.041 6.156 0.076 1.00 0.21 C ATOM 0 H LEU A 120 -9.536 5.841 1.272 1.00 0.23 H new ATOM 0 HA LEU A 120 -9.346 8.757 1.102 1.00 0.26 H new ATOM 0 HB2 LEU A 120 -9.410 6.567 -0.990 1.00 0.24 H new ATOM 0 HB3 LEU A 120 -9.324 8.280 -1.350 1.00 0.24 H new ATOM 0 HG LEU A 120 -7.132 7.507 -1.564 1.00 0.20 H new ATOM 0 HD11 LEU A 120 -5.857 8.580 0.256 1.00 0.25 H new ATOM 0 HD12 LEU A 120 -7.230 9.577 -0.282 1.00 0.25 H new ATOM 0 HD13 LEU A 120 -7.340 8.656 1.237 1.00 0.25 H new ATOM 0 HD21 LEU A 120 -5.952 6.142 0.115 1.00 0.21 H new ATOM 0 HD22 LEU A 120 -7.441 6.067 1.086 1.00 0.21 H new ATOM 0 HD23 LEU A 120 -7.393 5.320 -0.529 1.00 0.21 H new ATOM 792 N GLU A 121 -11.652 9.294 0.271 1.00 0.46 N ATOM 793 CA GLU A 121 -13.050 9.634 0.057 1.00 0.57 C ATOM 794 C GLU A 121 -13.366 9.661 -1.432 1.00 0.58 C ATOM 795 O GLU A 121 -14.530 9.681 -1.834 1.00 0.69 O ATOM 796 CB GLU A 121 -13.366 10.994 0.681 1.00 0.70 C ATOM 797 CG GLU A 121 -13.101 11.061 2.177 1.00 0.80 C ATOM 798 CD GLU A 121 -13.899 10.037 2.956 1.00 1.63 C ATOM 799 OE1 GLU A 121 -15.116 10.240 3.139 1.00 2.36 O ATOM 800 OE2 GLU A 121 -13.312 9.029 3.400 1.00 2.22 O ATOM 0 H GLU A 121 -11.018 10.093 0.264 1.00 0.46 H new ATOM 0 HA GLU A 121 -13.668 8.874 0.535 1.00 0.57 H new ATOM 0 HB2 GLU A 121 -12.771 11.759 0.182 1.00 0.70 H new ATOM 0 HB3 GLU A 121 -14.413 11.233 0.496 1.00 0.70 H new ATOM 0 HG2 GLU A 121 -12.038 10.905 2.361 1.00 0.80 H new ATOM 0 HG3 GLU A 121 -13.344 12.059 2.541 1.00 0.80 H new ATOM 807 N ASN A 122 -12.318 9.658 -2.242 1.00 0.53 N ATOM 808 CA ASN A 122 -12.458 9.726 -3.687 1.00 0.60 C ATOM 809 C ASN A 122 -11.243 9.098 -4.348 1.00 0.62 C ATOM 810 O ASN A 122 -10.109 9.358 -3.948 1.00 1.22 O ATOM 811 CB ASN A 122 -12.616 11.183 -4.126 1.00 0.73 C ATOM 812 CG ASN A 122 -12.825 11.334 -5.617 1.00 1.03 C ATOM 813 OD1 ASN A 122 -13.347 10.440 -6.282 1.00 1.16 O ATOM 814 ND2 ASN A 122 -12.431 12.475 -6.151 1.00 1.87 N ATOM 0 H ASN A 122 -11.352 9.609 -1.918 1.00 0.53 H new ATOM 0 HA ASN A 122 -13.347 9.174 -3.992 1.00 0.60 H new ATOM 0 HB2 ASN A 122 -13.462 11.625 -3.600 1.00 0.73 H new ATOM 0 HB3 ASN A 122 -11.729 11.743 -3.831 1.00 0.73 H new ATOM 0 HD21 ASN A 122 -12.555 12.640 -7.150 1.00 1.87 H new ATOM 0 HD22 ASN A 122 -12.002 13.191 -5.565 1.00 1.87 H new ATOM 821 N ALA A 123 -11.480 8.264 -5.350 1.00 0.67 N ATOM 822 CA ALA A 123 -10.405 7.505 -5.977 1.00 0.66 C ATOM 823 C ALA A 123 -10.073 8.018 -7.375 1.00 0.71 C ATOM 824 O ALA A 123 -9.238 7.438 -8.069 1.00 0.90 O ATOM 825 CB ALA A 123 -10.780 6.034 -6.039 1.00 0.69 C ATOM 0 H ALA A 123 -12.405 8.095 -5.746 1.00 0.67 H new ATOM 0 HA ALA A 123 -9.513 7.634 -5.364 1.00 0.66 H new ATOM 0 HB1 ALA A 123 -9.973 5.472 -6.509 1.00 0.69 H new ATOM 0 HB2 ALA A 123 -10.945 5.658 -5.029 1.00 0.69 H new ATOM 0 HB3 ALA A 123 -11.692 5.915 -6.624 1.00 0.69 H new ATOM 831 N ARG A 124 -10.715 9.102 -7.788 1.00 0.72 N ATOM 832 CA ARG A 124 -10.491 9.639 -9.129 1.00 0.83 C ATOM 833 C ARG A 124 -9.672 10.924 -9.068 1.00 0.75 C ATOM 834 O ARG A 124 -9.614 11.692 -10.027 1.00 0.86 O ATOM 835 CB ARG A 124 -11.822 9.872 -9.852 1.00 1.08 C ATOM 836 CG ARG A 124 -12.647 11.023 -9.299 1.00 1.37 C ATOM 837 CD ARG A 124 -14.021 11.073 -9.947 1.00 1.63 C ATOM 838 NE ARG A 124 -13.939 11.161 -11.403 1.00 2.28 N ATOM 839 CZ ARG A 124 -14.755 10.518 -12.238 1.00 2.84 C ATOM 840 NH1 ARG A 124 -15.731 9.749 -11.765 1.00 2.76 N ATOM 841 NH2 ARG A 124 -14.593 10.648 -13.550 1.00 3.84 N ATOM 0 H ARG A 124 -11.387 9.623 -7.225 1.00 0.72 H new ATOM 0 HA ARG A 124 -9.923 8.904 -9.698 1.00 0.83 H new ATOM 0 HB2 ARG A 124 -11.620 10.060 -10.906 1.00 1.08 H new ATOM 0 HB3 ARG A 124 -12.414 8.959 -9.799 1.00 1.08 H new ATOM 0 HG2 ARG A 124 -12.754 10.912 -8.220 1.00 1.37 H new ATOM 0 HG3 ARG A 124 -12.125 11.964 -9.472 1.00 1.37 H new ATOM 0 HD2 ARG A 124 -14.585 10.183 -9.669 1.00 1.63 H new ATOM 0 HD3 ARG A 124 -14.572 11.932 -9.563 1.00 1.63 H new ATOM 0 HE ARG A 124 -13.212 11.752 -11.806 1.00 2.28 H new ATOM 0 HH11 ARG A 124 -15.859 9.649 -10.758 1.00 2.76 H new ATOM 0 HH12 ARG A 124 -16.352 9.260 -12.409 1.00 2.76 H new ATOM 0 HH21 ARG A 124 -13.846 11.238 -13.916 1.00 3.84 H new ATOM 0 HH22 ARG A 124 -15.216 10.157 -14.192 1.00 3.84 H new ATOM 855 N LYS A 125 -9.042 11.138 -7.927 1.00 0.75 N ATOM 856 CA LYS A 125 -8.179 12.286 -7.704 1.00 0.68 C ATOM 857 C LYS A 125 -6.886 11.811 -7.062 1.00 0.55 C ATOM 858 O LYS A 125 -6.840 10.697 -6.539 1.00 0.53 O ATOM 859 CB LYS A 125 -8.877 13.311 -6.796 1.00 0.79 C ATOM 860 CG LYS A 125 -10.037 14.042 -7.457 1.00 0.93 C ATOM 861 CD LYS A 125 -9.571 14.905 -8.618 1.00 1.64 C ATOM 862 CE LYS A 125 -10.734 15.618 -9.291 1.00 1.90 C ATOM 863 NZ LYS A 125 -11.481 16.494 -8.348 1.00 2.26 N ATOM 0 H LYS A 125 -9.115 10.516 -7.122 1.00 0.75 H new ATOM 0 HA LYS A 125 -7.961 12.769 -8.657 1.00 0.68 H new ATOM 0 HB2 LYS A 125 -9.244 12.800 -5.906 1.00 0.79 H new ATOM 0 HB3 LYS A 125 -8.143 14.044 -6.463 1.00 0.79 H new ATOM 0 HG2 LYS A 125 -10.768 13.316 -7.814 1.00 0.93 H new ATOM 0 HG3 LYS A 125 -10.541 14.666 -6.719 1.00 0.93 H new ATOM 0 HD2 LYS A 125 -8.852 15.641 -8.259 1.00 1.64 H new ATOM 0 HD3 LYS A 125 -9.053 14.284 -9.349 1.00 1.64 H new ATOM 0 HE2 LYS A 125 -10.359 16.217 -10.121 1.00 1.90 H new ATOM 0 HE3 LYS A 125 -11.415 14.879 -9.714 1.00 1.90 H new ATOM 0 HZ1 LYS A 125 -12.127 17.108 -8.883 1.00 2.26 H new ATOM 0 HZ2 LYS A 125 -12.029 15.906 -7.688 1.00 2.26 H new ATOM 0 HZ3 LYS A 125 -10.809 17.081 -7.813 1.00 2.26 H new ATOM 877 N PRO A 126 -5.813 12.620 -7.114 1.00 0.51 N ATOM 878 CA PRO A 126 -4.547 12.281 -6.462 1.00 0.45 C ATOM 879 C PRO A 126 -4.762 11.961 -4.990 1.00 0.39 C ATOM 880 O PRO A 126 -5.265 12.797 -4.232 1.00 0.47 O ATOM 881 CB PRO A 126 -3.695 13.547 -6.618 1.00 0.51 C ATOM 882 CG PRO A 126 -4.654 14.618 -7.024 1.00 0.59 C ATOM 883 CD PRO A 126 -5.736 13.920 -7.796 1.00 0.60 C ATOM 0 HA PRO A 126 -4.078 11.400 -6.899 1.00 0.45 H new ATOM 0 HB2 PRO A 126 -3.193 13.801 -5.684 1.00 0.51 H new ATOM 0 HB3 PRO A 126 -2.918 13.408 -7.370 1.00 0.51 H new ATOM 0 HG2 PRO A 126 -5.062 15.130 -6.152 1.00 0.59 H new ATOM 0 HG3 PRO A 126 -4.161 15.374 -7.636 1.00 0.59 H new ATOM 0 HD2 PRO A 126 -6.682 14.460 -7.751 1.00 0.60 H new ATOM 0 HD3 PRO A 126 -5.480 13.813 -8.850 1.00 0.60 H new ATOM 891 N LEU A 127 -4.393 10.755 -4.592 1.00 0.32 N ATOM 892 CA LEU A 127 -4.663 10.286 -3.248 1.00 0.26 C ATOM 893 C LEU A 127 -3.875 11.093 -2.228 1.00 0.29 C ATOM 894 O LEU A 127 -2.747 11.522 -2.482 1.00 0.37 O ATOM 895 CB LEU A 127 -4.352 8.796 -3.122 1.00 0.24 C ATOM 896 CG LEU A 127 -5.020 7.898 -4.170 1.00 0.26 C ATOM 897 CD1 LEU A 127 -4.773 6.438 -3.843 1.00 0.26 C ATOM 898 CD2 LEU A 127 -6.513 8.182 -4.266 1.00 0.27 C ATOM 0 H LEU A 127 -3.905 10.083 -5.184 1.00 0.32 H new ATOM 0 HA LEU A 127 -5.724 10.428 -3.044 1.00 0.26 H new ATOM 0 HB2 LEU A 127 -3.272 8.660 -3.186 1.00 0.24 H new ATOM 0 HB3 LEU A 127 -4.658 8.460 -2.131 1.00 0.24 H new ATOM 0 HG LEU A 127 -4.577 8.119 -5.141 1.00 0.26 H new ATOM 0 HD11 LEU A 127 -5.252 5.811 -4.594 1.00 0.26 H new ATOM 0 HD12 LEU A 127 -3.701 6.243 -3.838 1.00 0.26 H new ATOM 0 HD13 LEU A 127 -5.188 6.210 -2.861 1.00 0.26 H new ATOM 0 HD21 LEU A 127 -6.960 7.530 -5.017 1.00 0.27 H new ATOM 0 HD22 LEU A 127 -6.982 7.996 -3.300 1.00 0.27 H new ATOM 0 HD23 LEU A 127 -6.668 9.223 -4.550 1.00 0.27 H new ATOM 910 N LYS A 128 -4.481 11.283 -1.072 1.00 0.29 N ATOM 911 CA LYS A 128 -3.962 12.206 -0.082 1.00 0.36 C ATOM 912 C LYS A 128 -3.618 11.504 1.224 1.00 0.26 C ATOM 913 O LYS A 128 -4.207 10.479 1.582 1.00 0.23 O ATOM 914 CB LYS A 128 -4.993 13.303 0.174 1.00 0.51 C ATOM 915 CG LYS A 128 -6.353 12.770 0.601 1.00 1.10 C ATOM 916 CD LYS A 128 -7.373 13.883 0.770 1.00 1.37 C ATOM 917 CE LYS A 128 -7.699 14.555 -0.556 1.00 1.80 C ATOM 918 NZ LYS A 128 -8.721 15.622 -0.402 1.00 2.27 N ATOM 0 H LYS A 128 -5.339 10.807 -0.794 1.00 0.29 H new ATOM 0 HA LYS A 128 -3.041 12.639 -0.473 1.00 0.36 H new ATOM 0 HB2 LYS A 128 -4.615 13.973 0.947 1.00 0.51 H new ATOM 0 HB3 LYS A 128 -5.112 13.897 -0.732 1.00 0.51 H new ATOM 0 HG2 LYS A 128 -6.713 12.058 -0.142 1.00 1.10 H new ATOM 0 HG3 LYS A 128 -6.251 12.226 1.540 1.00 1.10 H new ATOM 0 HD2 LYS A 128 -8.286 13.477 1.206 1.00 1.37 H new ATOM 0 HD3 LYS A 128 -6.989 14.626 1.469 1.00 1.37 H new ATOM 0 HE2 LYS A 128 -6.790 14.982 -0.979 1.00 1.80 H new ATOM 0 HE3 LYS A 128 -8.059 13.807 -1.263 1.00 1.80 H new ATOM 0 HZ1 LYS A 128 -8.914 16.054 -1.328 1.00 2.27 H new ATOM 0 HZ2 LYS A 128 -9.598 15.211 -0.022 1.00 2.27 H new ATOM 0 HZ3 LYS A 128 -8.368 16.349 0.252 1.00 2.27 H new ATOM 932 N ASP A 129 -2.649 12.067 1.922 1.00 0.32 N ATOM 933 CA ASP A 129 -2.252 11.580 3.228 1.00 0.39 C ATOM 934 C ASP A 129 -2.910 12.402 4.325 1.00 0.45 C ATOM 935 O ASP A 129 -3.422 13.492 4.072 1.00 0.51 O ATOM 936 CB ASP A 129 -0.729 11.604 3.391 1.00 0.59 C ATOM 937 CG ASP A 129 -0.132 12.989 3.245 1.00 1.00 C ATOM 938 OD1 ASP A 129 -0.057 13.721 4.249 1.00 1.56 O ATOM 939 OD2 ASP A 129 0.293 13.336 2.123 1.00 1.88 O ATOM 0 H ASP A 129 -2.116 12.874 1.599 1.00 0.32 H new ATOM 0 HA ASP A 129 -2.585 10.546 3.313 1.00 0.39 H new ATOM 0 HB2 ASP A 129 -0.469 11.206 4.372 1.00 0.59 H new ATOM 0 HB3 ASP A 129 -0.281 10.943 2.649 1.00 0.59 H new ATOM 944 N GLY A 130 -2.905 11.867 5.533 1.00 0.51 N ATOM 945 CA GLY A 130 -3.559 12.529 6.642 1.00 0.62 C ATOM 946 C GLY A 130 -4.605 11.636 7.263 1.00 0.60 C ATOM 947 O GLY A 130 -4.885 11.710 8.459 1.00 0.75 O ATOM 0 H GLY A 130 -2.457 10.981 5.768 1.00 0.51 H new ATOM 0 HA2 GLY A 130 -2.819 12.805 7.393 1.00 0.62 H new ATOM 0 HA3 GLY A 130 -4.023 13.453 6.297 1.00 0.62 H new ATOM 951 N ASN A 131 -5.191 10.796 6.432 1.00 0.47 N ATOM 952 CA ASN A 131 -6.091 9.756 6.884 1.00 0.46 C ATOM 953 C ASN A 131 -5.343 8.431 6.907 1.00 0.40 C ATOM 954 O ASN A 131 -4.666 8.083 5.944 1.00 0.46 O ATOM 955 CB ASN A 131 -7.312 9.670 5.961 1.00 0.51 C ATOM 956 CG ASN A 131 -6.931 9.619 4.490 1.00 1.32 C ATOM 957 OD1 ASN A 131 -6.742 8.549 3.922 1.00 2.28 O ATOM 958 ND2 ASN A 131 -6.798 10.782 3.862 1.00 1.45 N ATOM 0 H ASN A 131 -5.055 10.817 5.421 1.00 0.47 H new ATOM 0 HA ASN A 131 -6.445 9.989 7.888 1.00 0.46 H new ATOM 0 HB2 ASN A 131 -7.892 8.782 6.213 1.00 0.51 H new ATOM 0 HB3 ASN A 131 -7.956 10.532 6.136 1.00 0.51 H new ATOM 0 HD21 ASN A 131 -6.531 10.803 2.878 1.00 1.45 H new ATOM 0 HD22 ASN A 131 -6.963 11.654 4.364 1.00 1.45 H new ATOM 965 N VAL A 132 -5.433 7.712 8.008 1.00 0.36 N ATOM 966 CA VAL A 132 -4.720 6.456 8.143 1.00 0.31 C ATOM 967 C VAL A 132 -5.476 5.499 9.054 1.00 0.28 C ATOM 968 O VAL A 132 -5.970 5.881 10.115 1.00 0.35 O ATOM 969 CB VAL A 132 -3.281 6.673 8.667 1.00 0.35 C ATOM 970 CG1 VAL A 132 -3.290 7.388 10.008 1.00 0.73 C ATOM 971 CG2 VAL A 132 -2.534 5.353 8.770 1.00 0.71 C ATOM 0 H VAL A 132 -5.991 7.974 8.821 1.00 0.36 H new ATOM 0 HA VAL A 132 -4.652 6.012 7.150 1.00 0.31 H new ATOM 0 HB VAL A 132 -2.758 7.305 7.949 1.00 0.35 H new ATOM 0 HG11 VAL A 132 -2.265 7.527 10.353 1.00 0.73 H new ATOM 0 HG12 VAL A 132 -3.772 8.360 9.899 1.00 0.73 H new ATOM 0 HG13 VAL A 132 -3.839 6.790 10.735 1.00 0.73 H new ATOM 0 HG21 VAL A 132 -1.525 5.534 9.141 1.00 0.71 H new ATOM 0 HG22 VAL A 132 -3.060 4.690 9.457 1.00 0.71 H new ATOM 0 HG23 VAL A 132 -2.481 4.887 7.786 1.00 0.71 H new ATOM 981 N ILE A 133 -5.581 4.260 8.613 1.00 0.23 N ATOM 982 CA ILE A 133 -6.319 3.245 9.340 1.00 0.26 C ATOM 983 C ILE A 133 -5.358 2.283 10.029 1.00 0.28 C ATOM 984 O ILE A 133 -5.479 2.012 11.225 1.00 0.38 O ATOM 985 CB ILE A 133 -7.240 2.462 8.386 1.00 0.31 C ATOM 986 CG1 ILE A 133 -8.096 3.427 7.556 1.00 0.34 C ATOM 987 CG2 ILE A 133 -8.122 1.501 9.165 1.00 0.38 C ATOM 988 CD1 ILE A 133 -8.969 4.347 8.386 1.00 0.35 C ATOM 0 H ILE A 133 -5.159 3.930 7.745 1.00 0.23 H new ATOM 0 HA ILE A 133 -6.930 3.741 10.094 1.00 0.26 H new ATOM 0 HB ILE A 133 -6.618 1.881 7.706 1.00 0.31 H new ATOM 0 HG12 ILE A 133 -7.440 4.032 6.931 1.00 0.34 H new ATOM 0 HG13 ILE A 133 -8.731 2.848 6.885 1.00 0.34 H new ATOM 0 HG21 ILE A 133 -8.766 0.957 8.474 1.00 0.38 H new ATOM 0 HG22 ILE A 133 -7.497 0.795 9.711 1.00 0.38 H new ATOM 0 HG23 ILE A 133 -8.737 2.061 9.869 1.00 0.38 H new ATOM 0 HD11 ILE A 133 -9.543 4.998 7.726 1.00 0.35 H new ATOM 0 HD12 ILE A 133 -9.652 3.752 8.992 1.00 0.35 H new ATOM 0 HD13 ILE A 133 -8.341 4.954 9.038 1.00 0.35 H new ATOM 1000 N GLU A 134 -4.391 1.790 9.270 1.00 0.25 N ATOM 1001 CA GLU A 134 -3.358 0.909 9.793 1.00 0.30 C ATOM 1002 C GLU A 134 -2.021 1.289 9.183 1.00 0.23 C ATOM 1003 O GLU A 134 -1.979 1.878 8.103 1.00 0.21 O ATOM 1004 CB GLU A 134 -3.672 -0.563 9.503 1.00 0.43 C ATOM 1005 CG GLU A 134 -4.806 -1.122 10.346 1.00 0.63 C ATOM 1006 CD GLU A 134 -4.972 -2.621 10.202 1.00 0.74 C ATOM 1007 OE1 GLU A 134 -3.971 -3.317 9.942 1.00 1.50 O ATOM 1008 OE2 GLU A 134 -6.106 -3.110 10.378 1.00 1.42 O ATOM 0 H GLU A 134 -4.300 1.990 8.274 1.00 0.25 H new ATOM 0 HA GLU A 134 -3.319 1.028 10.876 1.00 0.30 H new ATOM 0 HB2 GLU A 134 -3.927 -0.670 8.449 1.00 0.43 H new ATOM 0 HB3 GLU A 134 -2.775 -1.158 9.676 1.00 0.43 H new ATOM 0 HG2 GLU A 134 -4.624 -0.882 11.394 1.00 0.63 H new ATOM 0 HG3 GLU A 134 -5.737 -0.631 10.063 1.00 0.63 H new ATOM 1015 N LYS A 135 -0.940 0.963 9.870 1.00 0.28 N ATOM 1016 CA LYS A 135 0.391 1.354 9.428 1.00 0.25 C ATOM 1017 C LYS A 135 1.455 0.465 10.046 1.00 0.27 C ATOM 1018 O LYS A 135 1.215 -0.207 11.050 1.00 0.34 O ATOM 1019 CB LYS A 135 0.657 2.820 9.789 1.00 0.32 C ATOM 1020 CG LYS A 135 0.241 3.176 11.208 1.00 0.56 C ATOM 1021 CD LYS A 135 0.520 4.633 11.524 1.00 0.62 C ATOM 1022 CE LYS A 135 -0.026 5.028 12.888 1.00 0.74 C ATOM 1023 NZ LYS A 135 0.654 4.309 13.997 1.00 1.53 N ATOM 0 H LYS A 135 -0.956 0.428 10.738 1.00 0.28 H new ATOM 0 HA LYS A 135 0.436 1.237 8.345 1.00 0.25 H new ATOM 0 HB2 LYS A 135 1.719 3.030 9.666 1.00 0.32 H new ATOM 0 HB3 LYS A 135 0.122 3.462 9.089 1.00 0.32 H new ATOM 0 HG2 LYS A 135 -0.822 2.972 11.338 1.00 0.56 H new ATOM 0 HG3 LYS A 135 0.776 2.541 11.914 1.00 0.56 H new ATOM 0 HD2 LYS A 135 1.595 4.812 11.497 1.00 0.62 H new ATOM 0 HD3 LYS A 135 0.072 5.264 10.756 1.00 0.62 H new ATOM 0 HE2 LYS A 135 0.093 6.102 13.027 1.00 0.74 H new ATOM 0 HE3 LYS A 135 -1.095 4.819 12.924 1.00 0.74 H new ATOM 0 HZ1 LYS A 135 0.297 4.659 14.909 1.00 1.53 H new ATOM 0 HZ2 LYS A 135 0.463 3.290 13.919 1.00 1.53 H new ATOM 0 HZ3 LYS A 135 1.679 4.474 13.941 1.00 1.53 H new ATOM 1037 N GLY A 136 2.625 0.459 9.432 1.00 0.30 N ATOM 1038 CA GLY A 136 3.733 -0.311 9.949 1.00 0.38 C ATOM 1039 C GLY A 136 4.865 -0.388 8.959 1.00 0.34 C ATOM 1040 O GLY A 136 5.066 0.536 8.167 1.00 0.29 O ATOM 0 H GLY A 136 2.828 0.978 8.578 1.00 0.30 H new ATOM 0 HA2 GLY A 136 4.089 0.140 10.875 1.00 0.38 H new ATOM 0 HA3 GLY A 136 3.394 -1.318 10.194 1.00 0.38 H new ATOM 1044 N PHE A 137 5.597 -1.484 8.998 1.00 0.38 N ATOM 1045 CA PHE A 137 6.671 -1.723 8.057 1.00 0.32 C ATOM 1046 C PHE A 137 6.333 -2.956 7.240 1.00 0.33 C ATOM 1047 O PHE A 137 5.476 -3.740 7.647 1.00 0.46 O ATOM 1048 CB PHE A 137 8.006 -1.924 8.782 1.00 0.42 C ATOM 1049 CG PHE A 137 8.336 -0.840 9.773 1.00 1.07 C ATOM 1050 CD1 PHE A 137 8.170 -1.056 11.133 1.00 2.05 C ATOM 1051 CD2 PHE A 137 8.810 0.393 9.348 1.00 1.81 C ATOM 1052 CE1 PHE A 137 8.471 -0.066 12.049 1.00 2.86 C ATOM 1053 CE2 PHE A 137 9.111 1.385 10.262 1.00 2.60 C ATOM 1054 CZ PHE A 137 8.940 1.155 11.612 1.00 2.93 C ATOM 0 H PHE A 137 5.464 -2.230 9.680 1.00 0.38 H new ATOM 0 HA PHE A 137 6.775 -0.855 7.406 1.00 0.32 H new ATOM 0 HB2 PHE A 137 7.985 -2.882 9.301 1.00 0.42 H new ATOM 0 HB3 PHE A 137 8.804 -1.980 8.042 1.00 0.42 H new ATOM 0 HD1 PHE A 137 7.801 -2.010 11.480 1.00 2.05 H new ATOM 0 HD2 PHE A 137 8.945 0.579 8.293 1.00 1.81 H new ATOM 0 HE1 PHE A 137 8.339 -0.248 13.105 1.00 2.86 H new ATOM 0 HE2 PHE A 137 9.480 2.340 9.920 1.00 2.60 H new ATOM 0 HZ PHE A 137 9.173 1.931 12.326 1.00 2.93 H new ATOM 1064 N VAL A 138 6.969 -3.125 6.093 1.00 0.27 N ATOM 1065 CA VAL A 138 6.660 -4.262 5.236 1.00 0.41 C ATOM 1066 C VAL A 138 6.996 -5.583 5.932 1.00 0.70 C ATOM 1067 O VAL A 138 6.089 -6.327 6.310 1.00 1.41 O ATOM 1068 CB VAL A 138 7.397 -4.163 3.883 1.00 0.53 C ATOM 1069 CG1 VAL A 138 7.119 -5.383 3.024 1.00 0.76 C ATOM 1070 CG2 VAL A 138 6.989 -2.900 3.139 1.00 0.48 C ATOM 0 H VAL A 138 7.692 -2.501 5.736 1.00 0.27 H new ATOM 0 HA VAL A 138 5.588 -4.240 5.040 1.00 0.41 H new ATOM 0 HB VAL A 138 8.467 -4.119 4.089 1.00 0.53 H new ATOM 0 HG11 VAL A 138 7.649 -5.289 2.076 1.00 0.76 H new ATOM 0 HG12 VAL A 138 7.459 -6.279 3.543 1.00 0.76 H new ATOM 0 HG13 VAL A 138 6.048 -5.458 2.835 1.00 0.76 H new ATOM 0 HG21 VAL A 138 7.520 -2.850 2.188 1.00 0.48 H new ATOM 0 HG22 VAL A 138 5.915 -2.918 2.954 1.00 0.48 H new ATOM 0 HG23 VAL A 138 7.239 -2.026 3.741 1.00 0.48 H new ATOM 1080 N SER A 139 8.291 -5.835 6.131 1.00 0.32 N ATOM 1081 CA SER A 139 8.772 -7.011 6.866 1.00 0.51 C ATOM 1082 C SER A 139 8.001 -8.291 6.515 1.00 0.39 C ATOM 1083 O SER A 139 7.483 -8.979 7.401 1.00 1.13 O ATOM 1084 CB SER A 139 8.688 -6.742 8.368 1.00 1.03 C ATOM 1085 OG SER A 139 9.420 -5.574 8.714 1.00 1.68 O ATOM 0 H SER A 139 9.038 -5.231 5.788 1.00 0.32 H new ATOM 0 HA SER A 139 9.807 -7.179 6.569 1.00 0.51 H new ATOM 0 HB2 SER A 139 7.645 -6.624 8.663 1.00 1.03 H new ATOM 0 HB3 SER A 139 9.080 -7.598 8.918 1.00 1.03 H new ATOM 0 HG SER A 139 9.352 -5.419 9.679 1.00 1.68 H new ATOM 1091 N ASN A 140 7.930 -8.616 5.230 1.00 0.51 N ATOM 1092 CA ASN A 140 7.214 -9.808 4.789 1.00 0.34 C ATOM 1093 C ASN A 140 7.733 -10.280 3.435 1.00 0.27 C ATOM 1094 O ASN A 140 7.507 -9.636 2.411 1.00 0.37 O ATOM 1095 CB ASN A 140 5.709 -9.530 4.711 1.00 0.37 C ATOM 1096 CG ASN A 140 4.892 -10.755 4.335 1.00 0.38 C ATOM 1097 OD1 ASN A 140 3.872 -10.645 3.657 1.00 0.94 O ATOM 1098 ND2 ASN A 140 5.314 -11.927 4.791 1.00 0.88 N ATOM 0 H ASN A 140 8.357 -8.075 4.478 1.00 0.51 H new ATOM 0 HA ASN A 140 7.387 -10.598 5.519 1.00 0.34 H new ATOM 0 HB2 ASN A 140 5.365 -9.154 5.675 1.00 0.37 H new ATOM 0 HB3 ASN A 140 5.529 -8.743 3.979 1.00 0.37 H new ATOM 0 HD21 ASN A 140 4.787 -12.775 4.582 1.00 0.88 H new ATOM 0 HD22 ASN A 140 6.165 -11.980 5.351 1.00 0.88 H new ATOM 1105 N GLN A 141 8.430 -11.406 3.442 1.00 0.35 N ATOM 1106 CA GLN A 141 9.037 -11.950 2.236 1.00 0.32 C ATOM 1107 C GLN A 141 8.185 -13.092 1.680 1.00 0.30 C ATOM 1108 O GLN A 141 8.384 -14.256 2.038 1.00 0.36 O ATOM 1109 CB GLN A 141 10.443 -12.462 2.555 1.00 0.39 C ATOM 1110 CG GLN A 141 11.303 -12.729 1.332 1.00 0.39 C ATOM 1111 CD GLN A 141 11.865 -11.456 0.730 1.00 0.52 C ATOM 1112 OE1 GLN A 141 12.948 -11.009 1.105 1.00 0.69 O ATOM 1113 NE2 GLN A 141 11.140 -10.861 -0.206 1.00 0.63 N ATOM 0 H GLN A 141 8.591 -11.966 4.279 1.00 0.35 H new ATOM 0 HA GLN A 141 9.098 -11.162 1.486 1.00 0.32 H new ATOM 0 HB2 GLN A 141 10.948 -11.732 3.188 1.00 0.39 H new ATOM 0 HB3 GLN A 141 10.359 -13.382 3.134 1.00 0.39 H new ATOM 0 HG2 GLN A 141 12.124 -13.391 1.607 1.00 0.39 H new ATOM 0 HG3 GLN A 141 10.710 -13.251 0.581 1.00 0.39 H new ATOM 0 HE21 GLN A 141 10.246 -11.262 -0.491 1.00 0.63 H new ATOM 0 HE22 GLN A 141 11.476 -10.002 -0.642 1.00 0.63 H new ATOM 1122 N ILE A 142 7.235 -12.762 0.813 1.00 0.25 N ATOM 1123 CA ILE A 142 6.360 -13.776 0.225 1.00 0.27 C ATOM 1124 C ILE A 142 7.028 -14.457 -0.965 1.00 0.30 C ATOM 1125 O ILE A 142 6.566 -15.494 -1.442 1.00 0.37 O ATOM 1126 CB ILE A 142 5.000 -13.198 -0.223 1.00 0.27 C ATOM 1127 CG1 ILE A 142 5.191 -12.072 -1.243 1.00 0.24 C ATOM 1128 CG2 ILE A 142 4.217 -12.703 0.983 1.00 0.29 C ATOM 1129 CD1 ILE A 142 3.908 -11.656 -1.931 1.00 0.26 C ATOM 0 H ILE A 142 7.050 -11.809 0.502 1.00 0.25 H new ATOM 0 HA ILE A 142 6.177 -14.507 1.012 1.00 0.27 H new ATOM 0 HB ILE A 142 4.432 -13.993 -0.706 1.00 0.27 H new ATOM 0 HG12 ILE A 142 5.621 -11.206 -0.740 1.00 0.24 H new ATOM 0 HG13 ILE A 142 5.910 -12.393 -1.996 1.00 0.24 H new ATOM 0 HG21 ILE A 142 3.260 -12.298 0.654 1.00 0.29 H new ATOM 0 HG22 ILE A 142 4.044 -13.532 1.669 1.00 0.29 H new ATOM 0 HG23 ILE A 142 4.785 -11.924 1.491 1.00 0.29 H new ATOM 0 HD11 ILE A 142 4.118 -10.855 -2.640 1.00 0.26 H new ATOM 0 HD12 ILE A 142 3.487 -12.509 -2.463 1.00 0.26 H new ATOM 0 HD13 ILE A 142 3.194 -11.304 -1.187 1.00 0.26 H new ATOM 1141 N GLY A 143 8.105 -13.861 -1.443 1.00 0.28 N ATOM 1142 CA GLY A 143 8.879 -14.455 -2.515 1.00 0.34 C ATOM 1143 C GLY A 143 10.316 -14.015 -2.430 1.00 0.40 C ATOM 1144 O GLY A 143 10.626 -13.131 -1.640 1.00 0.53 O ATOM 0 H GLY A 143 8.462 -12.967 -1.106 1.00 0.28 H new ATOM 0 HA2 GLY A 143 8.821 -15.542 -2.455 1.00 0.34 H new ATOM 0 HA3 GLY A 143 8.460 -14.166 -3.479 1.00 0.34 H new ATOM 1148 N ASP A 144 11.189 -14.604 -3.241 1.00 0.48 N ATOM 1149 CA ASP A 144 12.617 -14.277 -3.198 1.00 0.56 C ATOM 1150 C ASP A 144 12.836 -12.787 -3.423 1.00 0.48 C ATOM 1151 O ASP A 144 13.704 -12.170 -2.802 1.00 0.56 O ATOM 1152 CB ASP A 144 13.399 -15.068 -4.255 1.00 0.70 C ATOM 1153 CG ASP A 144 13.332 -16.568 -4.055 1.00 1.63 C ATOM 1154 OD1 ASP A 144 14.139 -17.113 -3.268 1.00 2.49 O ATOM 1155 OD2 ASP A 144 12.483 -17.216 -4.698 1.00 2.30 O ATOM 0 H ASP A 144 10.938 -15.308 -3.935 1.00 0.48 H new ATOM 0 HA ASP A 144 12.984 -14.551 -2.209 1.00 0.56 H new ATOM 0 HB2 ASP A 144 13.010 -14.823 -5.243 1.00 0.70 H new ATOM 0 HB3 ASP A 144 14.442 -14.753 -4.236 1.00 0.70 H new ATOM 1160 N SER A 145 12.038 -12.212 -4.303 1.00 0.38 N ATOM 1161 CA SER A 145 12.135 -10.800 -4.609 1.00 0.35 C ATOM 1162 C SER A 145 10.766 -10.145 -4.550 1.00 0.31 C ATOM 1163 O SER A 145 10.455 -9.249 -5.335 1.00 0.36 O ATOM 1164 CB SER A 145 12.756 -10.617 -5.989 1.00 0.38 C ATOM 1165 OG SER A 145 12.139 -11.470 -6.939 1.00 1.08 O ATOM 0 H SER A 145 11.311 -12.706 -4.821 1.00 0.38 H new ATOM 0 HA SER A 145 12.771 -10.319 -3.866 1.00 0.35 H new ATOM 0 HB2 SER A 145 12.651 -9.579 -6.304 1.00 0.38 H new ATOM 0 HB3 SER A 145 13.824 -10.830 -5.943 1.00 0.38 H new ATOM 0 HG SER A 145 12.552 -11.334 -7.817 1.00 1.08 H new ATOM 1171 N LEU A 146 9.951 -10.588 -3.608 1.00 0.27 N ATOM 1172 CA LEU A 146 8.592 -10.103 -3.508 1.00 0.22 C ATOM 1173 C LEU A 146 8.210 -9.893 -2.047 1.00 0.21 C ATOM 1174 O LEU A 146 8.341 -10.804 -1.223 1.00 0.23 O ATOM 1175 CB LEU A 146 7.647 -11.104 -4.172 1.00 0.23 C ATOM 1176 CG LEU A 146 6.364 -10.518 -4.744 1.00 0.23 C ATOM 1177 CD1 LEU A 146 6.676 -9.567 -5.887 1.00 0.26 C ATOM 1178 CD2 LEU A 146 5.439 -11.629 -5.214 1.00 0.27 C ATOM 0 H LEU A 146 10.209 -11.281 -2.905 1.00 0.27 H new ATOM 0 HA LEU A 146 8.512 -9.144 -4.020 1.00 0.22 H new ATOM 0 HB2 LEU A 146 8.185 -11.607 -4.975 1.00 0.23 H new ATOM 0 HB3 LEU A 146 7.382 -11.867 -3.440 1.00 0.23 H new ATOM 0 HG LEU A 146 5.860 -9.956 -3.958 1.00 0.23 H new ATOM 0 HD11 LEU A 146 5.747 -9.158 -6.284 1.00 0.26 H new ATOM 0 HD12 LEU A 146 7.304 -8.754 -5.523 1.00 0.26 H new ATOM 0 HD13 LEU A 146 7.201 -10.106 -6.676 1.00 0.26 H new ATOM 0 HD21 LEU A 146 4.526 -11.194 -5.620 1.00 0.27 H new ATOM 0 HD22 LEU A 146 5.937 -12.215 -5.986 1.00 0.27 H new ATOM 0 HD23 LEU A 146 5.190 -12.275 -4.372 1.00 0.27 H new ATOM 1190 N TYR A 147 7.766 -8.687 -1.730 1.00 0.18 N ATOM 1191 CA TYR A 147 7.354 -8.345 -0.376 1.00 0.18 C ATOM 1192 C TYR A 147 5.872 -8.011 -0.360 1.00 0.16 C ATOM 1193 O TYR A 147 5.323 -7.608 -1.375 1.00 0.19 O ATOM 1194 CB TYR A 147 8.161 -7.154 0.146 1.00 0.19 C ATOM 1195 CG TYR A 147 9.628 -7.449 0.375 1.00 0.23 C ATOM 1196 CD1 TYR A 147 10.557 -7.306 -0.649 1.00 1.21 C ATOM 1197 CD2 TYR A 147 10.082 -7.869 1.619 1.00 1.10 C ATOM 1198 CE1 TYR A 147 11.895 -7.579 -0.440 1.00 1.24 C ATOM 1199 CE2 TYR A 147 11.417 -8.141 1.834 1.00 1.10 C ATOM 1200 CZ TYR A 147 12.317 -7.994 0.803 1.00 0.36 C ATOM 1201 OH TYR A 147 13.643 -8.282 1.012 1.00 0.43 O ATOM 0 H TYR A 147 7.681 -7.921 -2.399 1.00 0.18 H new ATOM 0 HA TYR A 147 7.539 -9.201 0.273 1.00 0.18 H new ATOM 0 HB2 TYR A 147 8.074 -6.332 -0.564 1.00 0.19 H new ATOM 0 HB3 TYR A 147 7.720 -6.814 1.083 1.00 0.19 H new ATOM 0 HD1 TYR A 147 10.228 -6.976 -1.623 1.00 1.21 H new ATOM 0 HD2 TYR A 147 9.379 -7.984 2.430 1.00 1.10 H new ATOM 0 HE1 TYR A 147 12.605 -7.468 -1.246 1.00 1.24 H new ATOM 0 HE2 TYR A 147 11.754 -8.468 2.807 1.00 1.10 H new ATOM 0 HH TYR A 147 13.755 -9.250 1.113 1.00 0.43 H new ATOM 1211 N LYS A 148 5.223 -8.168 0.781 1.00 0.17 N ATOM 1212 CA LYS A 148 3.786 -7.941 0.852 1.00 0.18 C ATOM 1213 C LYS A 148 3.379 -7.299 2.171 1.00 0.19 C ATOM 1214 O LYS A 148 3.926 -7.609 3.225 1.00 0.28 O ATOM 1215 CB LYS A 148 3.054 -9.268 0.659 1.00 0.26 C ATOM 1216 CG LYS A 148 1.539 -9.157 0.609 1.00 0.34 C ATOM 1217 CD LYS A 148 0.910 -10.498 0.261 1.00 0.50 C ATOM 1218 CE LYS A 148 -0.609 -10.444 0.296 1.00 0.62 C ATOM 1219 NZ LYS A 148 -1.220 -11.718 -0.166 1.00 0.84 N ATOM 0 H LYS A 148 5.658 -8.448 1.660 1.00 0.17 H new ATOM 0 HA LYS A 148 3.510 -7.248 0.057 1.00 0.18 H new ATOM 0 HB2 LYS A 148 3.402 -9.728 -0.266 1.00 0.26 H new ATOM 0 HB3 LYS A 148 3.329 -9.940 1.472 1.00 0.26 H new ATOM 0 HG2 LYS A 148 1.163 -8.813 1.573 1.00 0.34 H new ATOM 0 HG3 LYS A 148 1.249 -8.411 -0.131 1.00 0.34 H new ATOM 0 HD2 LYS A 148 1.239 -10.805 -0.732 1.00 0.50 H new ATOM 0 HD3 LYS A 148 1.262 -11.255 0.962 1.00 0.50 H new ATOM 0 HE2 LYS A 148 -0.941 -10.229 1.312 1.00 0.62 H new ATOM 0 HE3 LYS A 148 -0.958 -9.625 -0.333 1.00 0.62 H new ATOM 0 HZ1 LYS A 148 -2.256 -11.640 -0.127 1.00 0.84 H new ATOM 0 HZ2 LYS A 148 -0.924 -11.910 -1.144 1.00 0.84 H new ATOM 0 HZ3 LYS A 148 -0.908 -12.496 0.450 1.00 0.84 H new ATOM 1233 N ILE A 149 2.417 -6.395 2.093 1.00 0.15 N ATOM 1234 CA ILE A 149 1.844 -5.763 3.268 1.00 0.18 C ATOM 1235 C ILE A 149 0.343 -5.987 3.290 1.00 0.22 C ATOM 1236 O ILE A 149 -0.308 -5.937 2.249 1.00 0.35 O ATOM 1237 CB ILE A 149 2.149 -4.252 3.315 1.00 0.18 C ATOM 1238 CG1 ILE A 149 1.900 -3.596 1.951 1.00 0.19 C ATOM 1239 CG2 ILE A 149 3.575 -4.029 3.768 1.00 0.19 C ATOM 1240 CD1 ILE A 149 2.181 -2.109 1.926 1.00 0.20 C ATOM 0 H ILE A 149 2.011 -6.079 1.212 1.00 0.15 H new ATOM 0 HA ILE A 149 2.300 -6.219 4.147 1.00 0.18 H new ATOM 0 HB ILE A 149 1.475 -3.784 4.033 1.00 0.18 H new ATOM 0 HG12 ILE A 149 2.524 -4.086 1.204 1.00 0.19 H new ATOM 0 HG13 ILE A 149 0.863 -3.765 1.661 1.00 0.19 H new ATOM 0 HG21 ILE A 149 3.784 -2.960 3.799 1.00 0.19 H new ATOM 0 HG22 ILE A 149 3.712 -4.454 4.762 1.00 0.19 H new ATOM 0 HG23 ILE A 149 4.258 -4.512 3.070 1.00 0.19 H new ATOM 0 HD11 ILE A 149 1.982 -1.718 0.928 1.00 0.20 H new ATOM 0 HD12 ILE A 149 1.539 -1.605 2.648 1.00 0.20 H new ATOM 0 HD13 ILE A 149 3.225 -1.932 2.183 1.00 0.20 H new ATOM 1252 N GLU A 150 -0.197 -6.252 4.468 1.00 0.24 N ATOM 1253 CA GLU A 150 -1.605 -6.598 4.604 1.00 0.27 C ATOM 1254 C GLU A 150 -2.229 -5.876 5.783 1.00 0.24 C ATOM 1255 O GLU A 150 -1.542 -5.522 6.741 1.00 0.31 O ATOM 1256 CB GLU A 150 -1.759 -8.105 4.812 1.00 0.40 C ATOM 1257 CG GLU A 150 -1.225 -8.947 3.670 1.00 1.08 C ATOM 1258 CD GLU A 150 -1.180 -10.418 4.010 1.00 1.55 C ATOM 1259 OE1 GLU A 150 -2.157 -11.137 3.712 1.00 2.03 O ATOM 1260 OE2 GLU A 150 -0.162 -10.863 4.585 1.00 2.30 O ATOM 0 H GLU A 150 0.319 -6.234 5.348 1.00 0.24 H new ATOM 0 HA GLU A 150 -2.113 -6.294 3.689 1.00 0.27 H new ATOM 0 HB2 GLU A 150 -1.244 -8.388 5.730 1.00 0.40 H new ATOM 0 HB3 GLU A 150 -2.815 -8.335 4.955 1.00 0.40 H new ATOM 0 HG2 GLU A 150 -1.851 -8.799 2.790 1.00 1.08 H new ATOM 0 HG3 GLU A 150 -0.223 -8.607 3.409 1.00 1.08 H new ATOM 1267 N THR A 151 -3.529 -5.661 5.705 1.00 0.21 N ATOM 1268 CA THR A 151 -4.275 -5.116 6.820 1.00 0.23 C ATOM 1269 C THR A 151 -4.557 -6.225 7.825 1.00 0.24 C ATOM 1270 O THR A 151 -4.893 -7.348 7.442 1.00 0.27 O ATOM 1271 CB THR A 151 -5.599 -4.485 6.345 1.00 0.25 C ATOM 1272 OG1 THR A 151 -6.428 -5.469 5.708 1.00 0.25 O ATOM 1273 CG2 THR A 151 -5.326 -3.357 5.370 1.00 0.29 C ATOM 0 H THR A 151 -4.091 -5.857 4.877 1.00 0.21 H new ATOM 0 HA THR A 151 -3.680 -4.333 7.291 1.00 0.23 H new ATOM 0 HB THR A 151 -6.117 -4.091 7.219 1.00 0.25 H new ATOM 0 HG1 THR A 151 -7.181 -5.691 6.294 1.00 0.25 H new ATOM 0 HG21 THR A 151 -6.270 -2.922 5.044 1.00 0.29 H new ATOM 0 HG22 THR A 151 -4.723 -2.592 5.859 1.00 0.29 H new ATOM 0 HG23 THR A 151 -4.788 -3.746 4.505 1.00 0.29 H new ATOM 1281 N LYS A 152 -4.407 -5.921 9.108 1.00 0.31 N ATOM 1282 CA LYS A 152 -4.561 -6.934 10.143 1.00 0.38 C ATOM 1283 C LYS A 152 -6.029 -7.259 10.391 1.00 0.39 C ATOM 1284 O LYS A 152 -6.348 -8.239 11.062 1.00 0.51 O ATOM 1285 CB LYS A 152 -3.882 -6.493 11.442 1.00 0.48 C ATOM 1286 CG LYS A 152 -2.368 -6.399 11.328 1.00 0.80 C ATOM 1287 CD LYS A 152 -1.719 -6.065 12.660 1.00 1.02 C ATOM 1288 CE LYS A 152 -0.204 -5.989 12.529 1.00 1.99 C ATOM 1289 NZ LYS A 152 0.456 -5.650 13.817 1.00 2.42 N ATOM 0 H LYS A 152 -4.181 -4.989 9.454 1.00 0.31 H new ATOM 0 HA LYS A 152 -4.073 -7.842 9.789 1.00 0.38 H new ATOM 0 HB2 LYS A 152 -4.278 -5.522 11.739 1.00 0.48 H new ATOM 0 HB3 LYS A 152 -4.137 -7.197 12.234 1.00 0.48 H new ATOM 0 HG2 LYS A 152 -1.972 -7.345 10.959 1.00 0.80 H new ATOM 0 HG3 LYS A 152 -2.106 -5.636 10.595 1.00 0.80 H new ATOM 0 HD2 LYS A 152 -2.103 -5.113 13.027 1.00 1.02 H new ATOM 0 HD3 LYS A 152 -1.986 -6.822 13.398 1.00 1.02 H new ATOM 0 HE2 LYS A 152 0.176 -6.945 12.169 1.00 1.99 H new ATOM 0 HE3 LYS A 152 0.057 -5.240 11.781 1.00 1.99 H new ATOM 0 HZ1 LYS A 152 1.486 -5.609 13.679 1.00 2.42 H new ATOM 0 HZ2 LYS A 152 0.114 -4.726 14.149 1.00 2.42 H new ATOM 0 HZ3 LYS A 152 0.230 -6.378 14.525 1.00 2.42 H new ATOM 1303 N LYS A 153 -6.915 -6.439 9.849 1.00 0.37 N ATOM 1304 CA LYS A 153 -8.347 -6.693 9.939 1.00 0.43 C ATOM 1305 C LYS A 153 -9.030 -6.374 8.616 1.00 0.40 C ATOM 1306 O LYS A 153 -8.402 -5.855 7.689 1.00 0.40 O ATOM 1307 CB LYS A 153 -8.975 -5.855 11.057 1.00 0.51 C ATOM 1308 CG LYS A 153 -8.907 -4.358 10.809 1.00 0.57 C ATOM 1309 CD LYS A 153 -9.581 -3.576 11.922 1.00 0.66 C ATOM 1310 CE LYS A 153 -9.287 -2.092 11.803 1.00 0.69 C ATOM 1311 NZ LYS A 153 -7.837 -1.802 11.968 1.00 1.29 N ATOM 0 H LYS A 153 -6.669 -5.590 9.341 1.00 0.37 H new ATOM 0 HA LYS A 153 -8.488 -7.750 10.167 1.00 0.43 H new ATOM 0 HB2 LYS A 153 -10.018 -6.148 11.176 1.00 0.51 H new ATOM 0 HB3 LYS A 153 -8.471 -6.082 11.996 1.00 0.51 H new ATOM 0 HG2 LYS A 153 -7.865 -4.049 10.726 1.00 0.57 H new ATOM 0 HG3 LYS A 153 -9.385 -4.124 9.858 1.00 0.57 H new ATOM 0 HD2 LYS A 153 -10.658 -3.741 11.886 1.00 0.66 H new ATOM 0 HD3 LYS A 153 -9.235 -3.942 12.889 1.00 0.66 H new ATOM 0 HE2 LYS A 153 -9.621 -1.732 10.830 1.00 0.69 H new ATOM 0 HE3 LYS A 153 -9.855 -1.547 12.557 1.00 0.69 H new ATOM 0 HZ1 LYS A 153 -7.708 -0.797 12.202 1.00 1.29 H new ATOM 0 HZ2 LYS A 153 -7.451 -2.388 12.735 1.00 1.29 H new ATOM 0 HZ3 LYS A 153 -7.337 -2.018 11.082 1.00 1.29 H new ATOM 1325 N LYS A 154 -10.312 -6.694 8.539 1.00 0.43 N ATOM 1326 CA LYS A 154 -11.118 -6.372 7.375 1.00 0.44 C ATOM 1327 C LYS A 154 -11.762 -5.007 7.572 1.00 0.53 C ATOM 1328 O LYS A 154 -12.325 -4.727 8.632 1.00 0.67 O ATOM 1329 CB LYS A 154 -12.192 -7.439 7.165 1.00 0.44 C ATOM 1330 CG LYS A 154 -11.631 -8.827 6.902 1.00 0.47 C ATOM 1331 CD LYS A 154 -12.740 -9.858 6.794 1.00 0.54 C ATOM 1332 CE LYS A 154 -12.189 -11.238 6.478 1.00 0.66 C ATOM 1333 NZ LYS A 154 -13.260 -12.268 6.440 1.00 1.41 N ATOM 0 H LYS A 154 -10.820 -7.181 9.277 1.00 0.43 H new ATOM 0 HA LYS A 154 -10.482 -6.346 6.490 1.00 0.44 H new ATOM 0 HB2 LYS A 154 -12.832 -7.476 8.047 1.00 0.44 H new ATOM 0 HB3 LYS A 154 -12.823 -7.147 6.326 1.00 0.44 H new ATOM 0 HG2 LYS A 154 -11.049 -8.818 5.980 1.00 0.47 H new ATOM 0 HG3 LYS A 154 -10.950 -9.105 7.706 1.00 0.47 H new ATOM 0 HD2 LYS A 154 -13.298 -9.893 7.730 1.00 0.54 H new ATOM 0 HD3 LYS A 154 -13.442 -9.559 6.016 1.00 0.54 H new ATOM 0 HE2 LYS A 154 -11.676 -11.212 5.517 1.00 0.66 H new ATOM 0 HE3 LYS A 154 -11.447 -11.513 7.228 1.00 0.66 H new ATOM 0 HZ1 LYS A 154 -12.842 -13.195 6.221 1.00 1.41 H new ATOM 0 HZ2 LYS A 154 -13.733 -12.311 7.365 1.00 1.41 H new ATOM 0 HZ3 LYS A 154 -13.955 -12.020 5.707 1.00 1.41 H new ATOM 1347 N MET A 155 -11.680 -4.161 6.561 1.00 0.61 N ATOM 1348 CA MET A 155 -12.140 -2.784 6.684 1.00 0.76 C ATOM 1349 C MET A 155 -13.601 -2.643 6.295 1.00 0.62 C ATOM 1350 O MET A 155 -14.128 -3.426 5.502 1.00 0.57 O ATOM 1351 CB MET A 155 -11.284 -1.870 5.813 1.00 1.01 C ATOM 1352 CG MET A 155 -9.815 -1.909 6.176 1.00 1.22 C ATOM 1353 SD MET A 155 -9.523 -1.499 7.906 1.00 0.95 S ATOM 1354 CE MET A 155 -7.800 -1.943 8.048 1.00 0.80 C ATOM 0 H MET A 155 -11.300 -4.400 5.645 1.00 0.61 H new ATOM 0 HA MET A 155 -12.042 -2.494 7.730 1.00 0.76 H new ATOM 0 HB2 MET A 155 -11.402 -2.159 4.769 1.00 1.01 H new ATOM 0 HB3 MET A 155 -11.648 -0.846 5.904 1.00 1.01 H new ATOM 0 HG2 MET A 155 -9.419 -2.903 5.969 1.00 1.22 H new ATOM 0 HG3 MET A 155 -9.268 -1.210 5.543 1.00 1.22 H new ATOM 0 HE1 MET A 155 -7.704 -2.833 8.670 1.00 0.80 H new ATOM 0 HE2 MET A 155 -7.394 -2.147 7.057 1.00 0.80 H new ATOM 0 HE3 MET A 155 -7.249 -1.121 8.504 1.00 0.80 H new ATOM 1364 N LYS A 156 -14.247 -1.634 6.873 1.00 0.65 N ATOM 1365 CA LYS A 156 -15.621 -1.295 6.530 1.00 0.59 C ATOM 1366 C LYS A 156 -15.682 -0.770 5.098 1.00 0.44 C ATOM 1367 O LYS A 156 -14.670 -0.311 4.570 1.00 0.42 O ATOM 1368 CB LYS A 156 -16.176 -0.235 7.494 1.00 0.72 C ATOM 1369 CG LYS A 156 -16.708 -0.784 8.815 1.00 1.28 C ATOM 1370 CD LYS A 156 -15.609 -1.348 9.704 1.00 1.79 C ATOM 1371 CE LYS A 156 -16.164 -1.784 11.051 1.00 2.54 C ATOM 1372 NZ LYS A 156 -15.110 -2.346 11.934 1.00 3.40 N ATOM 0 H LYS A 156 -13.835 -1.033 7.587 1.00 0.65 H new ATOM 0 HA LYS A 156 -16.230 -2.195 6.614 1.00 0.59 H new ATOM 0 HB2 LYS A 156 -15.389 0.488 7.708 1.00 0.72 H new ATOM 0 HB3 LYS A 156 -16.978 0.306 6.993 1.00 0.72 H new ATOM 0 HG2 LYS A 156 -17.230 0.010 9.349 1.00 1.28 H new ATOM 0 HG3 LYS A 156 -17.440 -1.565 8.610 1.00 1.28 H new ATOM 0 HD2 LYS A 156 -15.137 -2.197 9.210 1.00 1.79 H new ATOM 0 HD3 LYS A 156 -14.835 -0.595 9.853 1.00 1.79 H new ATOM 0 HE2 LYS A 156 -16.632 -0.931 11.543 1.00 2.54 H new ATOM 0 HE3 LYS A 156 -16.943 -2.530 10.897 1.00 2.54 H new ATOM 0 HZ1 LYS A 156 -15.532 -2.630 12.841 1.00 3.40 H new ATOM 0 HZ2 LYS A 156 -14.680 -3.176 11.477 1.00 3.40 H new ATOM 0 HZ3 LYS A 156 -14.379 -1.626 12.103 1.00 3.40 H new ATOM 1386 N PRO A 157 -16.859 -0.843 4.452 1.00 0.46 N ATOM 1387 CA PRO A 157 -17.053 -0.355 3.082 1.00 0.41 C ATOM 1388 C PRO A 157 -16.506 1.058 2.870 1.00 0.37 C ATOM 1389 O PRO A 157 -16.712 1.951 3.698 1.00 0.46 O ATOM 1390 CB PRO A 157 -18.578 -0.372 2.892 1.00 0.52 C ATOM 1391 CG PRO A 157 -19.156 -0.674 4.236 1.00 0.63 C ATOM 1392 CD PRO A 157 -18.095 -1.415 4.993 1.00 0.63 C ATOM 0 HA PRO A 157 -16.516 -0.975 2.364 1.00 0.41 H new ATOM 0 HB2 PRO A 157 -18.936 0.588 2.520 1.00 0.52 H new ATOM 0 HB3 PRO A 157 -18.872 -1.126 2.162 1.00 0.52 H new ATOM 0 HG2 PRO A 157 -19.435 0.243 4.754 1.00 0.63 H new ATOM 0 HG3 PRO A 157 -20.060 -1.276 4.144 1.00 0.63 H new ATOM 0 HD2 PRO A 157 -18.178 -1.257 6.068 1.00 0.63 H new ATOM 0 HD3 PRO A 157 -18.152 -2.490 4.824 1.00 0.63 H new ATOM 1400 N GLY A 158 -15.811 1.251 1.758 1.00 0.32 N ATOM 1401 CA GLY A 158 -15.211 2.530 1.455 1.00 0.33 C ATOM 1402 C GLY A 158 -14.027 2.388 0.519 1.00 0.27 C ATOM 1403 O GLY A 158 -13.690 1.277 0.107 1.00 0.27 O ATOM 0 H GLY A 158 -15.652 0.532 1.052 1.00 0.32 H new ATOM 0 HA2 GLY A 158 -15.957 3.183 1.002 1.00 0.33 H new ATOM 0 HA3 GLY A 158 -14.888 3.008 2.380 1.00 0.33 H new ATOM 1407 N ILE A 159 -13.395 3.504 0.185 1.00 0.29 N ATOM 1408 CA ILE A 159 -12.222 3.493 -0.678 1.00 0.26 C ATOM 1409 C ILE A 159 -10.951 3.484 0.161 1.00 0.21 C ATOM 1410 O ILE A 159 -10.811 4.278 1.093 1.00 0.24 O ATOM 1411 CB ILE A 159 -12.192 4.722 -1.610 1.00 0.30 C ATOM 1412 CG1 ILE A 159 -13.516 4.849 -2.369 1.00 0.40 C ATOM 1413 CG2 ILE A 159 -11.022 4.624 -2.579 1.00 0.29 C ATOM 1414 CD1 ILE A 159 -13.591 6.068 -3.259 1.00 0.44 C ATOM 0 H ILE A 159 -13.676 4.432 0.500 1.00 0.29 H new ATOM 0 HA ILE A 159 -12.277 2.591 -1.287 1.00 0.26 H new ATOM 0 HB ILE A 159 -12.059 5.617 -1.003 1.00 0.30 H new ATOM 0 HG12 ILE A 159 -13.663 3.956 -2.977 1.00 0.40 H new ATOM 0 HG13 ILE A 159 -14.335 4.884 -1.650 1.00 0.40 H new ATOM 0 HG21 ILE A 159 -11.014 5.498 -3.230 1.00 0.29 H new ATOM 0 HG22 ILE A 159 -10.088 4.581 -2.019 1.00 0.29 H new ATOM 0 HG23 ILE A 159 -11.125 3.723 -3.183 1.00 0.29 H new ATOM 0 HD11 ILE A 159 -14.557 6.091 -3.764 1.00 0.44 H new ATOM 0 HD12 ILE A 159 -13.476 6.968 -2.654 1.00 0.44 H new ATOM 0 HD13 ILE A 159 -12.794 6.026 -4.002 1.00 0.44 H new ATOM 1426 N TYR A 160 -10.035 2.584 -0.158 1.00 0.18 N ATOM 1427 CA TYR A 160 -8.786 2.479 0.582 1.00 0.17 C ATOM 1428 C TYR A 160 -7.610 2.353 -0.372 1.00 0.16 C ATOM 1429 O TYR A 160 -7.773 1.939 -1.520 1.00 0.19 O ATOM 1430 CB TYR A 160 -8.812 1.270 1.526 1.00 0.21 C ATOM 1431 CG TYR A 160 -9.894 1.335 2.583 1.00 0.23 C ATOM 1432 CD1 TYR A 160 -11.198 0.962 2.290 1.00 1.20 C ATOM 1433 CD2 TYR A 160 -9.612 1.767 3.875 1.00 1.24 C ATOM 1434 CE1 TYR A 160 -12.189 1.021 3.245 1.00 1.23 C ATOM 1435 CE2 TYR A 160 -10.602 1.825 4.836 1.00 1.24 C ATOM 1436 CZ TYR A 160 -11.887 1.453 4.514 1.00 0.35 C ATOM 1437 OH TYR A 160 -12.875 1.512 5.468 1.00 0.43 O ATOM 0 H TYR A 160 -10.132 1.916 -0.923 1.00 0.18 H new ATOM 0 HA TYR A 160 -8.671 3.387 1.174 1.00 0.17 H new ATOM 0 HB2 TYR A 160 -8.950 0.364 0.935 1.00 0.21 H new ATOM 0 HB3 TYR A 160 -7.843 1.186 2.018 1.00 0.21 H new ATOM 0 HD1 TYR A 160 -11.440 0.619 1.295 1.00 1.20 H new ATOM 0 HD2 TYR A 160 -8.605 2.061 4.130 1.00 1.24 H new ATOM 0 HE1 TYR A 160 -13.199 0.729 2.997 1.00 1.23 H new ATOM 0 HE2 TYR A 160 -10.369 2.161 5.836 1.00 1.24 H new ATOM 0 HH TYR A 160 -13.579 0.866 5.250 1.00 0.43 H new ATOM 1447 N ALA A 161 -6.434 2.719 0.110 1.00 0.14 N ATOM 1448 CA ALA A 161 -5.206 2.593 -0.658 1.00 0.14 C ATOM 1449 C ALA A 161 -4.006 2.569 0.276 1.00 0.14 C ATOM 1450 O ALA A 161 -4.072 3.074 1.398 1.00 0.14 O ATOM 1451 CB ALA A 161 -5.076 3.736 -1.651 1.00 0.14 C ATOM 0 H ALA A 161 -6.303 3.111 1.043 1.00 0.14 H new ATOM 0 HA ALA A 161 -5.240 1.656 -1.214 1.00 0.14 H new ATOM 0 HB1 ALA A 161 -4.151 3.624 -2.216 1.00 0.14 H new ATOM 0 HB2 ALA A 161 -5.924 3.721 -2.336 1.00 0.14 H new ATOM 0 HB3 ALA A 161 -5.060 4.684 -1.114 1.00 0.14 H new ATOM 1457 N PHE A 162 -2.919 1.974 -0.183 1.00 0.14 N ATOM 1458 CA PHE A 162 -1.695 1.912 0.600 1.00 0.15 C ATOM 1459 C PHE A 162 -0.724 2.987 0.146 1.00 0.15 C ATOM 1460 O PHE A 162 -0.481 3.145 -1.051 1.00 0.15 O ATOM 1461 CB PHE A 162 -1.017 0.543 0.473 1.00 0.17 C ATOM 1462 CG PHE A 162 -1.746 -0.579 1.160 1.00 0.18 C ATOM 1463 CD1 PHE A 162 -1.491 -0.872 2.490 1.00 1.13 C ATOM 1464 CD2 PHE A 162 -2.674 -1.349 0.476 1.00 1.15 C ATOM 1465 CE1 PHE A 162 -2.146 -1.910 3.125 1.00 1.13 C ATOM 1466 CE2 PHE A 162 -3.332 -2.386 1.106 1.00 1.16 C ATOM 1467 CZ PHE A 162 -3.067 -2.667 2.432 1.00 0.24 C ATOM 0 H PHE A 162 -2.858 1.525 -1.097 1.00 0.14 H new ATOM 0 HA PHE A 162 -1.967 2.073 1.643 1.00 0.15 H new ATOM 0 HB2 PHE A 162 -0.914 0.299 -0.584 1.00 0.17 H new ATOM 0 HB3 PHE A 162 -0.010 0.611 0.884 1.00 0.17 H new ATOM 0 HD1 PHE A 162 -0.771 -0.282 3.037 1.00 1.13 H new ATOM 0 HD2 PHE A 162 -2.884 -1.135 -0.561 1.00 1.15 H new ATOM 0 HE1 PHE A 162 -1.937 -2.128 4.162 1.00 1.13 H new ATOM 0 HE2 PHE A 162 -4.054 -2.977 0.562 1.00 1.16 H new ATOM 0 HZ PHE A 162 -3.581 -3.479 2.926 1.00 0.24 H new ATOM 1477 N LYS A 163 -0.183 3.727 1.095 1.00 0.16 N ATOM 1478 CA LYS A 163 0.842 4.708 0.792 1.00 0.18 C ATOM 1479 C LYS A 163 2.169 4.252 1.369 1.00 0.20 C ATOM 1480 O LYS A 163 2.364 4.274 2.586 1.00 0.23 O ATOM 1481 CB LYS A 163 0.496 6.093 1.359 1.00 0.23 C ATOM 1482 CG LYS A 163 1.545 7.149 1.011 1.00 0.31 C ATOM 1483 CD LYS A 163 1.260 8.496 1.669 1.00 0.45 C ATOM 1484 CE LYS A 163 2.428 9.460 1.485 1.00 0.74 C ATOM 1485 NZ LYS A 163 2.167 10.790 2.096 1.00 1.28 N ATOM 0 H LYS A 163 -0.436 3.668 2.081 1.00 0.16 H new ATOM 0 HA LYS A 163 0.907 4.793 -0.293 1.00 0.18 H new ATOM 0 HB2 LYS A 163 -0.473 6.408 0.973 1.00 0.23 H new ATOM 0 HB3 LYS A 163 0.400 6.024 2.443 1.00 0.23 H new ATOM 0 HG2 LYS A 163 2.528 6.797 1.323 1.00 0.31 H new ATOM 0 HG3 LYS A 163 1.581 7.277 -0.071 1.00 0.31 H new ATOM 0 HD2 LYS A 163 0.357 8.929 1.239 1.00 0.45 H new ATOM 0 HD3 LYS A 163 1.069 8.351 2.732 1.00 0.45 H new ATOM 0 HE2 LYS A 163 3.325 9.029 1.930 1.00 0.74 H new ATOM 0 HE3 LYS A 163 2.628 9.585 0.421 1.00 0.74 H new ATOM 0 HZ1 LYS A 163 3.054 11.331 2.142 1.00 1.28 H new ATOM 0 HZ2 LYS A 163 1.475 11.308 1.518 1.00 1.28 H new ATOM 0 HZ3 LYS A 163 1.789 10.663 3.056 1.00 1.28 H new ATOM 1499 N VAL A 164 3.067 3.820 0.505 1.00 0.22 N ATOM 1500 CA VAL A 164 4.411 3.488 0.930 1.00 0.26 C ATOM 1501 C VAL A 164 5.335 4.638 0.545 1.00 0.33 C ATOM 1502 O VAL A 164 5.286 5.135 -0.582 1.00 0.34 O ATOM 1503 CB VAL A 164 4.906 2.141 0.332 1.00 0.28 C ATOM 1504 CG1 VAL A 164 3.884 1.043 0.583 1.00 0.27 C ATOM 1505 CG2 VAL A 164 5.210 2.249 -1.154 1.00 0.29 C ATOM 0 H VAL A 164 2.891 3.691 -0.491 1.00 0.22 H new ATOM 0 HA VAL A 164 4.415 3.352 2.011 1.00 0.26 H new ATOM 0 HB VAL A 164 5.838 1.887 0.836 1.00 0.28 H new ATOM 0 HG11 VAL A 164 4.245 0.106 0.158 1.00 0.27 H new ATOM 0 HG12 VAL A 164 3.736 0.922 1.656 1.00 0.27 H new ATOM 0 HG13 VAL A 164 2.938 1.313 0.115 1.00 0.27 H new ATOM 0 HG21 VAL A 164 5.552 1.283 -1.526 1.00 0.29 H new ATOM 0 HG22 VAL A 164 4.308 2.545 -1.689 1.00 0.29 H new ATOM 0 HG23 VAL A 164 5.988 2.996 -1.313 1.00 0.29 H new ATOM 1515 N TYR A 165 6.130 5.110 1.488 1.00 0.45 N ATOM 1516 CA TYR A 165 6.970 6.264 1.226 1.00 0.57 C ATOM 1517 C TYR A 165 8.402 6.034 1.682 1.00 0.70 C ATOM 1518 O TYR A 165 8.880 6.655 2.634 1.00 1.67 O ATOM 1519 CB TYR A 165 6.376 7.548 1.840 1.00 0.62 C ATOM 1520 CG TYR A 165 5.907 7.433 3.280 1.00 0.63 C ATOM 1521 CD1 TYR A 165 4.659 6.899 3.588 1.00 1.30 C ATOM 1522 CD2 TYR A 165 6.700 7.884 4.328 1.00 1.38 C ATOM 1523 CE1 TYR A 165 4.221 6.816 4.896 1.00 1.31 C ATOM 1524 CE2 TYR A 165 6.268 7.802 5.638 1.00 1.45 C ATOM 1525 CZ TYR A 165 5.028 7.269 5.916 1.00 0.79 C ATOM 1526 OH TYR A 165 4.592 7.189 7.219 1.00 0.93 O ATOM 0 H TYR A 165 6.212 4.720 2.427 1.00 0.45 H new ATOM 0 HA TYR A 165 6.997 6.404 0.145 1.00 0.57 H new ATOM 0 HB2 TYR A 165 7.126 8.337 1.783 1.00 0.62 H new ATOM 0 HB3 TYR A 165 5.533 7.866 1.227 1.00 0.62 H new ATOM 0 HD1 TYR A 165 4.022 6.544 2.791 1.00 1.30 H new ATOM 0 HD2 TYR A 165 7.671 8.306 4.115 1.00 1.38 H new ATOM 0 HE1 TYR A 165 3.250 6.398 5.117 1.00 1.31 H new ATOM 0 HE2 TYR A 165 6.899 8.154 6.440 1.00 1.45 H new ATOM 0 HH TYR A 165 3.637 7.404 7.258 1.00 0.93 H new ATOM 1536 N LYS A 166 9.074 5.121 0.977 1.00 0.48 N ATOM 1537 CA LYS A 166 10.503 4.876 1.154 1.00 0.49 C ATOM 1538 C LYS A 166 10.789 4.262 2.538 1.00 0.46 C ATOM 1539 O LYS A 166 9.869 4.079 3.339 1.00 0.55 O ATOM 1540 CB LYS A 166 11.282 6.193 0.948 1.00 0.57 C ATOM 1541 CG LYS A 166 10.905 6.948 -0.325 1.00 0.71 C ATOM 1542 CD LYS A 166 10.992 6.091 -1.585 1.00 0.94 C ATOM 1543 CE LYS A 166 12.428 5.807 -1.997 1.00 1.35 C ATOM 1544 NZ LYS A 166 12.504 5.310 -3.396 1.00 1.53 N ATOM 0 H LYS A 166 8.640 4.531 0.267 1.00 0.48 H new ATOM 0 HA LYS A 166 10.837 4.155 0.408 1.00 0.49 H new ATOM 0 HB2 LYS A 166 11.111 6.842 1.807 1.00 0.57 H new ATOM 0 HB3 LYS A 166 12.349 5.971 0.924 1.00 0.57 H new ATOM 0 HG2 LYS A 166 9.890 7.331 -0.224 1.00 0.71 H new ATOM 0 HG3 LYS A 166 11.562 7.811 -0.435 1.00 0.71 H new ATOM 0 HD2 LYS A 166 10.472 5.148 -1.416 1.00 0.94 H new ATOM 0 HD3 LYS A 166 10.476 6.597 -2.401 1.00 0.94 H new ATOM 0 HE2 LYS A 166 13.022 6.716 -1.900 1.00 1.35 H new ATOM 0 HE3 LYS A 166 12.862 5.068 -1.323 1.00 1.35 H new ATOM 0 HZ1 LYS A 166 13.473 5.430 -3.755 1.00 1.53 H new ATOM 0 HZ2 LYS A 166 12.248 4.302 -3.421 1.00 1.53 H new ATOM 0 HZ3 LYS A 166 11.845 5.850 -3.992 1.00 1.53 H new ATOM 1558 N PRO A 167 12.050 3.878 2.828 1.00 0.44 N ATOM 1559 CA PRO A 167 12.426 3.379 4.160 1.00 0.47 C ATOM 1560 C PRO A 167 12.161 4.405 5.253 1.00 0.47 C ATOM 1561 O PRO A 167 12.273 5.613 5.029 1.00 0.50 O ATOM 1562 CB PRO A 167 13.929 3.116 4.031 1.00 0.58 C ATOM 1563 CG PRO A 167 14.143 2.909 2.576 1.00 0.60 C ATOM 1564 CD PRO A 167 13.198 3.855 1.901 1.00 0.49 C ATOM 0 HA PRO A 167 11.849 2.499 4.444 1.00 0.47 H new ATOM 0 HB2 PRO A 167 14.513 3.958 4.403 1.00 0.58 H new ATOM 0 HB3 PRO A 167 14.230 2.240 4.606 1.00 0.58 H new ATOM 0 HG2 PRO A 167 15.176 3.118 2.296 1.00 0.60 H new ATOM 0 HG3 PRO A 167 13.938 1.877 2.291 1.00 0.60 H new ATOM 0 HD2 PRO A 167 13.637 4.845 1.774 1.00 0.49 H new ATOM 0 HD3 PRO A 167 12.912 3.504 0.910 1.00 0.49 H new ATOM 1572 N ALA A 168 11.794 3.918 6.430 1.00 0.53 N ATOM 1573 CA ALA A 168 11.535 4.785 7.569 1.00 0.64 C ATOM 1574 C ALA A 168 12.786 5.570 7.946 1.00 0.71 C ATOM 1575 O ALA A 168 13.863 4.994 8.124 1.00 0.76 O ATOM 1576 CB ALA A 168 11.043 3.970 8.753 1.00 0.72 C ATOM 0 H ALA A 168 11.669 2.924 6.621 1.00 0.53 H new ATOM 0 HA ALA A 168 10.758 5.496 7.288 1.00 0.64 H new ATOM 0 HB1 ALA A 168 10.854 4.633 9.597 1.00 0.72 H new ATOM 0 HB2 ALA A 168 10.121 3.455 8.482 1.00 0.72 H new ATOM 0 HB3 ALA A 168 11.801 3.237 9.030 1.00 0.72 H new ATOM 1582 N GLY A 169 12.644 6.884 8.061 1.00 0.82 N ATOM 1583 CA GLY A 169 13.783 7.725 8.362 1.00 0.95 C ATOM 1584 C GLY A 169 14.242 8.516 7.156 1.00 0.96 C ATOM 1585 O GLY A 169 15.064 9.425 7.279 1.00 1.14 O ATOM 0 H GLY A 169 11.760 7.381 7.951 1.00 0.82 H new ATOM 0 HA2 GLY A 169 13.523 8.412 9.168 1.00 0.95 H new ATOM 0 HA3 GLY A 169 14.604 7.106 8.723 1.00 0.95 H new ATOM 1589 N TYR A 170 13.721 8.169 5.988 1.00 0.80 N ATOM 1590 CA TYR A 170 14.070 8.867 4.761 1.00 0.82 C ATOM 1591 C TYR A 170 13.213 10.126 4.613 1.00 0.86 C ATOM 1592 O TYR A 170 11.983 10.050 4.648 1.00 0.89 O ATOM 1593 CB TYR A 170 13.859 7.943 3.556 1.00 0.83 C ATOM 1594 CG TYR A 170 14.500 8.439 2.274 1.00 0.91 C ATOM 1595 CD1 TYR A 170 15.713 7.916 1.839 1.00 1.15 C ATOM 1596 CD2 TYR A 170 13.896 9.425 1.496 1.00 1.74 C ATOM 1597 CE1 TYR A 170 16.303 8.361 0.672 1.00 1.21 C ATOM 1598 CE2 TYR A 170 14.484 9.871 0.329 1.00 1.82 C ATOM 1599 CZ TYR A 170 15.685 9.334 -0.080 1.00 1.11 C ATOM 1600 OH TYR A 170 16.274 9.775 -1.243 1.00 1.24 O ATOM 0 H TYR A 170 13.054 7.407 5.865 1.00 0.80 H new ATOM 0 HA TYR A 170 15.120 9.158 4.805 1.00 0.82 H new ATOM 0 HB2 TYR A 170 14.261 6.958 3.793 1.00 0.83 H new ATOM 0 HB3 TYR A 170 12.789 7.819 3.390 1.00 0.83 H new ATOM 0 HD1 TYR A 170 16.201 7.150 2.423 1.00 1.15 H new ATOM 0 HD2 TYR A 170 12.953 9.847 1.811 1.00 1.74 H new ATOM 0 HE1 TYR A 170 17.247 7.946 0.350 1.00 1.21 H new ATOM 0 HE2 TYR A 170 14.004 10.638 -0.261 1.00 1.82 H new ATOM 0 HH TYR A 170 15.710 10.462 -1.655 1.00 1.24 H new ATOM 1610 N PRO A 171 13.844 11.306 4.471 1.00 0.97 N ATOM 1611 CA PRO A 171 13.116 12.569 4.296 1.00 1.10 C ATOM 1612 C PRO A 171 12.325 12.609 2.988 1.00 1.07 C ATOM 1613 O PRO A 171 12.899 12.524 1.899 1.00 1.05 O ATOM 1614 CB PRO A 171 14.223 13.632 4.279 1.00 1.25 C ATOM 1615 CG PRO A 171 15.466 12.892 3.919 1.00 1.31 C ATOM 1616 CD PRO A 171 15.305 11.510 4.488 1.00 1.07 C ATOM 0 HA PRO A 171 12.378 12.718 5.084 1.00 1.10 H new ATOM 0 HB2 PRO A 171 14.006 14.415 3.553 1.00 1.25 H new ATOM 0 HB3 PRO A 171 14.320 14.116 5.251 1.00 1.25 H new ATOM 0 HG2 PRO A 171 15.599 12.856 2.838 1.00 1.31 H new ATOM 0 HG3 PRO A 171 16.347 13.384 4.332 1.00 1.31 H new ATOM 0 HD2 PRO A 171 15.823 10.764 3.885 1.00 1.07 H new ATOM 0 HD3 PRO A 171 15.709 11.441 5.498 1.00 1.07 H new ATOM 1624 N ALA A 172 11.006 12.739 3.103 1.00 1.22 N ATOM 1625 CA ALA A 172 10.135 12.797 1.934 1.00 1.31 C ATOM 1626 C ALA A 172 10.389 14.078 1.145 1.00 1.40 C ATOM 1627 O ALA A 172 10.643 15.133 1.729 1.00 1.67 O ATOM 1628 CB ALA A 172 8.675 12.703 2.356 1.00 1.60 C ATOM 0 H ALA A 172 10.517 12.806 3.996 1.00 1.22 H new ATOM 0 HA ALA A 172 10.360 11.948 1.288 1.00 1.31 H new ATOM 0 HB1 ALA A 172 8.037 12.748 1.473 1.00 1.60 H new ATOM 0 HB2 ALA A 172 8.507 11.761 2.878 1.00 1.60 H new ATOM 0 HB3 ALA A 172 8.434 13.533 3.020 1.00 1.60 H new ATOM 1634 N ASN A 173 10.323 13.993 -0.179 1.00 1.38 N ATOM 1635 CA ASN A 173 10.671 15.131 -1.022 1.00 1.53 C ATOM 1636 C ASN A 173 9.802 15.182 -2.283 1.00 1.91 C ATOM 1637 O ASN A 173 10.299 15.405 -3.387 1.00 2.60 O ATOM 1638 CB ASN A 173 12.153 15.054 -1.399 1.00 1.89 C ATOM 1639 CG ASN A 173 12.683 16.350 -1.987 1.00 2.51 C ATOM 1640 OD1 ASN A 173 12.235 17.440 -1.631 1.00 2.97 O ATOM 1641 ND2 ASN A 173 13.640 16.235 -2.892 1.00 3.18 N ATOM 0 H ASN A 173 10.035 13.157 -0.688 1.00 1.38 H new ATOM 0 HA ASN A 173 10.485 16.045 -0.459 1.00 1.53 H new ATOM 0 HB2 ASN A 173 12.735 14.798 -0.513 1.00 1.89 H new ATOM 0 HB3 ASN A 173 12.298 14.249 -2.119 1.00 1.89 H new ATOM 0 HD21 ASN A 173 14.036 17.070 -3.324 1.00 3.18 H new ATOM 0 HD22 ASN A 173 13.982 15.312 -3.158 1.00 3.18 H new ATOM 1648 N GLY A 174 8.508 14.939 -2.117 1.00 2.02 N ATOM 1649 CA GLY A 174 7.559 15.107 -3.214 1.00 2.69 C ATOM 1650 C GLY A 174 7.552 13.956 -4.209 1.00 2.26 C ATOM 1651 O GLY A 174 6.532 13.683 -4.840 1.00 2.93 O ATOM 0 H GLY A 174 8.092 14.627 -1.240 1.00 2.02 H new ATOM 0 HA2 GLY A 174 6.557 15.221 -2.800 1.00 2.69 H new ATOM 0 HA3 GLY A 174 7.792 16.030 -3.744 1.00 2.69 H new ATOM 1655 N SER A 175 8.681 13.287 -4.357 1.00 1.44 N ATOM 1656 CA SER A 175 8.780 12.141 -5.247 1.00 1.23 C ATOM 1657 C SER A 175 9.262 10.923 -4.469 1.00 0.94 C ATOM 1658 O SER A 175 10.050 10.116 -4.961 1.00 1.36 O ATOM 1659 CB SER A 175 9.736 12.451 -6.398 1.00 1.79 C ATOM 1660 OG SER A 175 9.338 13.628 -7.086 1.00 2.26 O ATOM 0 H SER A 175 9.547 13.518 -3.870 1.00 1.44 H new ATOM 0 HA SER A 175 7.796 11.925 -5.663 1.00 1.23 H new ATOM 0 HB2 SER A 175 10.748 12.575 -6.012 1.00 1.79 H new ATOM 0 HB3 SER A 175 9.761 11.611 -7.092 1.00 1.79 H new ATOM 0 HG SER A 175 9.965 13.808 -7.817 1.00 2.26 H new ATOM 1666 N THR A 176 8.796 10.820 -3.236 1.00 0.64 N ATOM 1667 CA THR A 176 9.210 9.754 -2.342 1.00 0.90 C ATOM 1668 C THR A 176 8.039 8.882 -1.900 1.00 0.80 C ATOM 1669 O THR A 176 8.174 8.075 -0.986 1.00 1.05 O ATOM 1670 CB THR A 176 9.896 10.341 -1.103 1.00 1.30 C ATOM 1671 OG1 THR A 176 9.209 11.536 -0.707 1.00 1.49 O ATOM 1672 CG2 THR A 176 11.360 10.650 -1.381 1.00 1.76 C ATOM 0 H THR A 176 8.123 11.470 -2.829 1.00 0.64 H new ATOM 0 HA THR A 176 9.907 9.126 -2.897 1.00 0.90 H new ATOM 0 HB THR A 176 9.856 9.606 -0.299 1.00 1.30 H new ATOM 0 HG1 THR A 176 8.402 11.298 -0.204 1.00 1.49 H new ATOM 0 HG21 THR A 176 11.821 11.065 -0.485 1.00 1.76 H new ATOM 0 HG22 THR A 176 11.878 9.734 -1.664 1.00 1.76 H new ATOM 0 HG23 THR A 176 11.431 11.373 -2.194 1.00 1.76 H new ATOM 1680 N PHE A 177 6.886 9.043 -2.528 1.00 0.52 N ATOM 1681 CA PHE A 177 5.713 8.282 -2.120 1.00 0.45 C ATOM 1682 C PHE A 177 5.128 7.508 -3.293 1.00 0.41 C ATOM 1683 O PHE A 177 5.196 7.952 -4.439 1.00 0.50 O ATOM 1684 CB PHE A 177 4.648 9.193 -1.484 1.00 0.49 C ATOM 1685 CG PHE A 177 4.211 10.356 -2.339 1.00 0.55 C ATOM 1686 CD1 PHE A 177 3.278 10.183 -3.352 1.00 1.37 C ATOM 1687 CD2 PHE A 177 4.721 11.627 -2.116 1.00 1.31 C ATOM 1688 CE1 PHE A 177 2.866 11.250 -4.125 1.00 1.46 C ATOM 1689 CE2 PHE A 177 4.314 12.695 -2.888 1.00 1.38 C ATOM 1690 CZ PHE A 177 3.385 12.507 -3.893 1.00 0.86 C ATOM 0 H PHE A 177 6.736 9.682 -3.309 1.00 0.52 H new ATOM 0 HA PHE A 177 6.034 7.564 -1.365 1.00 0.45 H new ATOM 0 HB2 PHE A 177 3.773 8.590 -1.243 1.00 0.49 H new ATOM 0 HB3 PHE A 177 5.038 9.580 -0.543 1.00 0.49 H new ATOM 0 HD1 PHE A 177 2.869 9.201 -3.538 1.00 1.37 H new ATOM 0 HD2 PHE A 177 5.445 11.782 -1.329 1.00 1.31 H new ATOM 0 HE1 PHE A 177 2.139 11.101 -4.910 1.00 1.46 H new ATOM 0 HE2 PHE A 177 4.722 13.679 -2.707 1.00 1.38 H new ATOM 0 HZ PHE A 177 3.065 13.344 -4.497 1.00 0.86 H new ATOM 1700 N GLU A 178 4.570 6.345 -2.999 1.00 0.34 N ATOM 1701 CA GLU A 178 3.963 5.514 -4.015 1.00 0.32 C ATOM 1702 C GLU A 178 2.633 4.971 -3.511 1.00 0.28 C ATOM 1703 O GLU A 178 2.562 4.378 -2.432 1.00 0.28 O ATOM 1704 CB GLU A 178 4.910 4.373 -4.387 1.00 0.37 C ATOM 1705 CG GLU A 178 4.467 3.584 -5.602 1.00 0.40 C ATOM 1706 CD GLU A 178 5.530 2.621 -6.080 1.00 1.20 C ATOM 1707 OE1 GLU A 178 5.289 1.401 -6.041 1.00 1.91 O ATOM 1708 OE2 GLU A 178 6.610 3.084 -6.505 1.00 1.96 O ATOM 0 H GLU A 178 4.527 5.957 -2.057 1.00 0.34 H new ATOM 0 HA GLU A 178 3.776 6.111 -4.908 1.00 0.32 H new ATOM 0 HB2 GLU A 178 5.903 4.783 -4.573 1.00 0.37 H new ATOM 0 HB3 GLU A 178 4.999 3.695 -3.538 1.00 0.37 H new ATOM 0 HG2 GLU A 178 3.560 3.030 -5.362 1.00 0.40 H new ATOM 0 HG3 GLU A 178 4.215 4.273 -6.408 1.00 0.40 H new ATOM 1715 N TRP A 179 1.578 5.204 -4.275 1.00 0.28 N ATOM 1716 CA TRP A 179 0.250 4.755 -3.893 1.00 0.26 C ATOM 1717 C TRP A 179 -0.104 3.441 -4.571 1.00 0.27 C ATOM 1718 O TRP A 179 0.223 3.217 -5.739 1.00 0.38 O ATOM 1719 CB TRP A 179 -0.811 5.794 -4.267 1.00 0.27 C ATOM 1720 CG TRP A 179 -0.835 7.006 -3.389 1.00 0.27 C ATOM 1721 CD1 TRP A 179 -0.303 8.233 -3.663 1.00 0.32 C ATOM 1722 CD2 TRP A 179 -1.447 7.112 -2.100 1.00 0.24 C ATOM 1723 NE1 TRP A 179 -0.553 9.095 -2.624 1.00 0.32 N ATOM 1724 CE2 TRP A 179 -1.249 8.431 -1.654 1.00 0.27 C ATOM 1725 CE3 TRP A 179 -2.144 6.222 -1.278 1.00 0.20 C ATOM 1726 CZ2 TRP A 179 -1.724 8.883 -0.431 1.00 0.27 C ATOM 1727 CZ3 TRP A 179 -2.615 6.674 -0.063 1.00 0.21 C ATOM 1728 CH2 TRP A 179 -2.403 7.996 0.351 1.00 0.24 C ATOM 0 H TRP A 179 1.616 5.702 -5.164 1.00 0.28 H new ATOM 0 HA TRP A 179 0.263 4.615 -2.812 1.00 0.26 H new ATOM 0 HB2 TRP A 179 -0.643 6.111 -5.296 1.00 0.27 H new ATOM 0 HB3 TRP A 179 -1.792 5.320 -4.236 1.00 0.27 H new ATOM 0 HD1 TRP A 179 0.235 8.488 -4.564 1.00 0.32 H new ATOM 0 HE1 TRP A 179 -0.266 10.073 -2.583 1.00 0.32 H new ATOM 0 HE3 TRP A 179 -2.310 5.201 -1.588 1.00 0.20 H new ATOM 0 HZ2 TRP A 179 -1.562 9.901 -0.110 1.00 0.27 H new ATOM 0 HZ3 TRP A 179 -3.157 5.997 0.581 1.00 0.21 H new ATOM 0 HH2 TRP A 179 -2.785 8.319 1.308 1.00 0.24 H new ATOM 1739 N SER A 180 -0.769 2.581 -3.826 1.00 0.23 N ATOM 1740 CA SER A 180 -1.393 1.404 -4.395 1.00 0.28 C ATOM 1741 C SER A 180 -2.714 1.843 -5.013 1.00 0.28 C ATOM 1742 O SER A 180 -3.344 2.776 -4.510 1.00 0.36 O ATOM 1743 CB SER A 180 -1.629 0.355 -3.302 1.00 0.33 C ATOM 1744 OG SER A 180 -1.994 -0.898 -3.846 1.00 1.06 O ATOM 0 H SER A 180 -0.891 2.677 -2.818 1.00 0.23 H new ATOM 0 HA SER A 180 -0.753 0.953 -5.153 1.00 0.28 H new ATOM 0 HB2 SER A 180 -0.724 0.242 -2.705 1.00 0.33 H new ATOM 0 HB3 SER A 180 -2.413 0.701 -2.629 1.00 0.33 H new ATOM 0 HG SER A 180 -1.989 -0.844 -4.824 1.00 1.06 H new ATOM 1750 N GLU A 181 -3.112 1.206 -6.108 1.00 0.31 N ATOM 1751 CA GLU A 181 -4.363 1.556 -6.772 1.00 0.38 C ATOM 1752 C GLU A 181 -5.524 1.451 -5.790 1.00 0.34 C ATOM 1753 O GLU A 181 -5.599 0.495 -5.018 1.00 0.49 O ATOM 1754 CB GLU A 181 -4.620 0.658 -7.982 1.00 0.56 C ATOM 1755 CG GLU A 181 -3.672 0.900 -9.146 1.00 0.74 C ATOM 1756 CD GLU A 181 -4.085 0.137 -10.386 1.00 1.38 C ATOM 1757 OE1 GLU A 181 -3.318 -0.742 -10.839 1.00 2.12 O ATOM 1758 OE2 GLU A 181 -5.187 0.404 -10.908 1.00 1.91 O ATOM 0 H GLU A 181 -2.591 0.450 -6.553 1.00 0.31 H new ATOM 0 HA GLU A 181 -4.280 2.584 -7.125 1.00 0.38 H new ATOM 0 HB2 GLU A 181 -4.539 -0.384 -7.672 1.00 0.56 H new ATOM 0 HB3 GLU A 181 -5.644 0.810 -8.323 1.00 0.56 H new ATOM 0 HG2 GLU A 181 -3.640 1.966 -9.371 1.00 0.74 H new ATOM 0 HG3 GLU A 181 -2.663 0.604 -8.858 1.00 0.74 H new ATOM 1765 N PRO A 182 -6.450 2.422 -5.814 1.00 0.29 N ATOM 1766 CA PRO A 182 -7.493 2.528 -4.803 1.00 0.26 C ATOM 1767 C PRO A 182 -8.554 1.446 -4.956 1.00 0.28 C ATOM 1768 O PRO A 182 -9.294 1.417 -5.944 1.00 0.32 O ATOM 1769 CB PRO A 182 -8.114 3.915 -5.036 1.00 0.29 C ATOM 1770 CG PRO A 182 -7.335 4.552 -6.147 1.00 0.35 C ATOM 1771 CD PRO A 182 -6.585 3.456 -6.847 1.00 0.39 C ATOM 0 HA PRO A 182 -7.085 2.402 -3.800 1.00 0.26 H new ATOM 0 HB2 PRO A 182 -9.168 3.828 -5.302 1.00 0.29 H new ATOM 0 HB3 PRO A 182 -8.063 4.520 -4.131 1.00 0.29 H new ATOM 0 HG2 PRO A 182 -8.002 5.065 -6.840 1.00 0.35 H new ATOM 0 HG3 PRO A 182 -6.646 5.300 -5.754 1.00 0.35 H new ATOM 0 HD2 PRO A 182 -7.131 3.087 -7.716 1.00 0.39 H new ATOM 0 HD3 PRO A 182 -5.613 3.798 -7.203 1.00 0.39 H new ATOM 1779 N MET A 183 -8.621 0.558 -3.979 1.00 0.28 N ATOM 1780 CA MET A 183 -9.640 -0.477 -3.961 1.00 0.30 C ATOM 1781 C MET A 183 -10.868 0.020 -3.220 1.00 0.26 C ATOM 1782 O MET A 183 -10.759 0.695 -2.194 1.00 0.25 O ATOM 1783 CB MET A 183 -9.127 -1.775 -3.319 1.00 0.34 C ATOM 1784 CG MET A 183 -8.395 -1.583 -2.001 1.00 0.29 C ATOM 1785 SD MET A 183 -6.683 -1.068 -2.237 1.00 0.31 S ATOM 1786 CE MET A 183 -6.137 -0.906 -0.544 1.00 0.27 C ATOM 0 H MET A 183 -7.980 0.533 -3.186 1.00 0.28 H new ATOM 0 HA MET A 183 -9.902 -0.703 -4.995 1.00 0.30 H new ATOM 0 HB2 MET A 183 -9.973 -2.443 -3.156 1.00 0.34 H new ATOM 0 HB3 MET A 183 -8.459 -2.273 -4.022 1.00 0.34 H new ATOM 0 HG2 MET A 183 -8.918 -0.836 -1.403 1.00 0.29 H new ATOM 0 HG3 MET A 183 -8.417 -2.515 -1.437 1.00 0.29 H new ATOM 0 HE1 MET A 183 -5.123 -0.507 -0.525 1.00 0.27 H new ATOM 0 HE2 MET A 183 -6.803 -0.228 -0.010 1.00 0.27 H new ATOM 0 HE3 MET A 183 -6.152 -1.883 -0.062 1.00 0.27 H new ATOM 1796 N ARG A 184 -12.032 -0.306 -3.747 1.00 0.28 N ATOM 1797 CA ARG A 184 -13.278 0.158 -3.167 1.00 0.29 C ATOM 1798 C ARG A 184 -14.074 -1.014 -2.620 1.00 0.31 C ATOM 1799 O ARG A 184 -14.487 -1.901 -3.368 1.00 0.39 O ATOM 1800 CB ARG A 184 -14.106 0.913 -4.210 1.00 0.35 C ATOM 1801 CG ARG A 184 -13.333 2.009 -4.925 1.00 1.17 C ATOM 1802 CD ARG A 184 -14.191 2.713 -5.962 1.00 1.16 C ATOM 1803 NE ARG A 184 -15.378 3.342 -5.377 1.00 1.88 N ATOM 1804 CZ ARG A 184 -16.035 4.355 -5.941 1.00 2.24 C ATOM 1805 NH1 ARG A 184 -15.618 4.864 -7.096 1.00 1.94 N ATOM 1806 NH2 ARG A 184 -17.114 4.854 -5.352 1.00 3.32 N ATOM 0 H ARG A 184 -12.141 -0.890 -4.576 1.00 0.28 H new ATOM 0 HA ARG A 184 -13.044 0.838 -2.348 1.00 0.29 H new ATOM 0 HB2 ARG A 184 -14.480 0.203 -4.948 1.00 0.35 H new ATOM 0 HB3 ARG A 184 -14.976 1.353 -3.722 1.00 0.35 H new ATOM 0 HG2 ARG A 184 -12.972 2.735 -4.197 1.00 1.17 H new ATOM 0 HG3 ARG A 184 -12.455 1.580 -5.409 1.00 1.17 H new ATOM 0 HD2 ARG A 184 -13.594 3.472 -6.468 1.00 1.16 H new ATOM 0 HD3 ARG A 184 -14.501 1.994 -6.720 1.00 1.16 H new ATOM 0 HE ARG A 184 -15.722 2.984 -4.486 1.00 1.88 H new ATOM 0 HH11 ARG A 184 -14.792 4.479 -7.554 1.00 1.94 H new ATOM 0 HH12 ARG A 184 -16.124 5.639 -7.524 1.00 1.94 H new ATOM 0 HH21 ARG A 184 -17.440 4.462 -4.468 1.00 3.32 H new ATOM 0 HH22 ARG A 184 -17.618 5.629 -5.783 1.00 3.32 H new ATOM 1820 N LEU A 185 -14.272 -1.020 -1.313 1.00 0.28 N ATOM 1821 CA LEU A 185 -15.030 -2.076 -0.660 1.00 0.32 C ATOM 1822 C LEU A 185 -16.469 -1.616 -0.488 1.00 0.36 C ATOM 1823 O LEU A 185 -16.710 -0.479 -0.087 1.00 0.51 O ATOM 1824 CB LEU A 185 -14.426 -2.413 0.712 1.00 0.36 C ATOM 1825 CG LEU A 185 -12.900 -2.551 0.761 1.00 0.46 C ATOM 1826 CD1 LEU A 185 -12.457 -3.014 2.139 1.00 0.75 C ATOM 1827 CD2 LEU A 185 -12.397 -3.510 -0.303 1.00 0.74 C ATOM 0 H LEU A 185 -13.917 -0.303 -0.680 1.00 0.28 H new ATOM 0 HA LEU A 185 -14.994 -2.973 -1.278 1.00 0.32 H new ATOM 0 HB2 LEU A 185 -14.723 -1.637 1.418 1.00 0.36 H new ATOM 0 HB3 LEU A 185 -14.866 -3.347 1.061 1.00 0.36 H new ATOM 0 HG LEU A 185 -12.468 -1.571 0.560 1.00 0.46 H new ATOM 0 HD11 LEU A 185 -11.371 -3.108 2.160 1.00 0.75 H new ATOM 0 HD12 LEU A 185 -12.773 -2.286 2.886 1.00 0.75 H new ATOM 0 HD13 LEU A 185 -12.909 -3.981 2.361 1.00 0.75 H new ATOM 0 HD21 LEU A 185 -11.311 -3.585 -0.241 1.00 0.74 H new ATOM 0 HD22 LEU A 185 -12.839 -4.494 -0.144 1.00 0.74 H new ATOM 0 HD23 LEU A 185 -12.679 -3.140 -1.289 1.00 0.74 H new ATOM 1839 N ALA A 186 -17.423 -2.474 -0.801 1.00 0.57 N ATOM 1840 CA ALA A 186 -18.824 -2.103 -0.698 1.00 0.77 C ATOM 1841 C ALA A 186 -19.702 -3.324 -0.476 1.00 1.02 C ATOM 1842 O ALA A 186 -19.412 -4.410 -0.969 1.00 1.53 O ATOM 1843 CB ALA A 186 -19.259 -1.365 -1.954 1.00 1.00 C ATOM 0 H ALA A 186 -17.256 -3.426 -1.126 1.00 0.57 H new ATOM 0 HA ALA A 186 -18.939 -1.445 0.164 1.00 0.77 H new ATOM 0 HB1 ALA A 186 -20.310 -1.090 -1.869 1.00 1.00 H new ATOM 0 HB2 ALA A 186 -18.657 -0.464 -2.074 1.00 1.00 H new ATOM 0 HB3 ALA A 186 -19.122 -2.011 -2.821 1.00 1.00 H new ATOM 1849 N LYS A 187 -20.776 -3.145 0.271 1.00 0.89 N ATOM 1850 CA LYS A 187 -21.738 -4.214 0.469 1.00 1.11 C ATOM 1851 C LYS A 187 -22.793 -4.154 -0.623 1.00 1.49 C ATOM 1852 O LYS A 187 -23.799 -3.451 -0.500 1.00 1.61 O ATOM 1853 CB LYS A 187 -22.390 -4.116 1.849 1.00 1.11 C ATOM 1854 CG LYS A 187 -21.428 -4.381 2.993 1.00 1.17 C ATOM 1855 CD LYS A 187 -22.144 -4.333 4.328 1.00 1.45 C ATOM 1856 CE LYS A 187 -21.193 -4.579 5.485 1.00 1.82 C ATOM 1857 NZ LYS A 187 -21.882 -4.465 6.797 1.00 2.78 N ATOM 0 H LYS A 187 -21.004 -2.273 0.749 1.00 0.89 H new ATOM 0 HA LYS A 187 -21.217 -5.170 0.415 1.00 1.11 H new ATOM 0 HB2 LYS A 187 -22.820 -3.122 1.969 1.00 1.11 H new ATOM 0 HB3 LYS A 187 -23.213 -4.828 1.905 1.00 1.11 H new ATOM 0 HG2 LYS A 187 -20.961 -5.357 2.862 1.00 1.17 H new ATOM 0 HG3 LYS A 187 -20.628 -3.641 2.979 1.00 1.17 H new ATOM 0 HD2 LYS A 187 -22.621 -3.361 4.450 1.00 1.45 H new ATOM 0 HD3 LYS A 187 -22.936 -5.081 4.343 1.00 1.45 H new ATOM 0 HE2 LYS A 187 -20.753 -5.572 5.390 1.00 1.82 H new ATOM 0 HE3 LYS A 187 -20.373 -3.862 5.441 1.00 1.82 H new ATOM 0 HZ1 LYS A 187 -21.201 -4.639 7.563 1.00 2.78 H new ATOM 0 HZ2 LYS A 187 -22.280 -3.509 6.898 1.00 2.78 H new ATOM 0 HZ3 LYS A 187 -22.648 -5.166 6.849 1.00 2.78 H new ATOM 1871 N CYS A 188 -22.548 -4.885 -1.695 1.00 1.82 N ATOM 1872 CA CYS A 188 -23.432 -4.872 -2.845 1.00 2.29 C ATOM 1873 C CYS A 188 -24.159 -6.203 -2.959 1.00 2.51 C ATOM 1874 O CYS A 188 -23.541 -7.268 -2.888 1.00 2.68 O ATOM 1875 CB CYS A 188 -22.635 -4.588 -4.124 1.00 2.71 C ATOM 1876 SG CYS A 188 -23.640 -4.482 -5.620 1.00 3.14 S ATOM 0 H CYS A 188 -21.739 -5.498 -1.793 1.00 1.82 H new ATOM 0 HA CYS A 188 -24.170 -4.080 -2.713 1.00 2.29 H new ATOM 0 HB2 CYS A 188 -22.092 -3.651 -3.999 1.00 2.71 H new ATOM 0 HB3 CYS A 188 -21.891 -5.373 -4.256 1.00 2.71 H new ATOM 0 HG CYS A 188 -22.874 -4.238 -6.641 1.00 3.14 H new ATOM 1882 N ASP A 189 -25.473 -6.141 -3.111 1.00 2.70 N ATOM 1883 CA ASP A 189 -26.270 -7.344 -3.274 1.00 3.08 C ATOM 1884 C ASP A 189 -26.309 -7.750 -4.744 1.00 3.61 C ATOM 1885 O ASP A 189 -26.979 -7.127 -5.570 1.00 3.87 O ATOM 1886 CB ASP A 189 -27.688 -7.160 -2.702 1.00 3.12 C ATOM 1887 CG ASP A 189 -28.460 -6.014 -3.331 1.00 3.50 C ATOM 1888 OD1 ASP A 189 -29.479 -6.278 -4.001 1.00 3.76 O ATOM 1889 OD2 ASP A 189 -28.060 -4.845 -3.142 1.00 4.05 O ATOM 0 H ASP A 189 -26.008 -5.272 -3.125 1.00 2.70 H new ATOM 0 HA ASP A 189 -25.801 -8.149 -2.708 1.00 3.08 H new ATOM 0 HB2 ASP A 189 -28.249 -8.084 -2.843 1.00 3.12 H new ATOM 0 HB3 ASP A 189 -27.617 -6.991 -1.628 1.00 3.12 H new ATOM 1894 N GLU A 190 -25.539 -8.774 -5.067 1.00 3.97 N ATOM 1895 CA GLU A 190 -25.456 -9.284 -6.421 1.00 4.63 C ATOM 1896 C GLU A 190 -25.451 -10.807 -6.383 1.00 5.25 C ATOM 1897 O GLU A 190 -26.529 -11.409 -6.540 1.00 5.64 O ATOM 1898 CB GLU A 190 -24.190 -8.756 -7.106 1.00 4.83 C ATOM 1899 CG GLU A 190 -24.074 -9.138 -8.574 1.00 5.57 C ATOM 1900 CD GLU A 190 -25.142 -8.497 -9.435 1.00 5.94 C ATOM 1901 OE1 GLU A 190 -26.178 -9.147 -9.693 1.00 6.06 O ATOM 1902 OE2 GLU A 190 -24.947 -7.343 -9.864 1.00 6.43 O ATOM 1903 OXT GLU A 190 -24.372 -11.397 -6.153 1.00 5.62 O ATOM 0 H GLU A 190 -24.955 -9.274 -4.397 1.00 3.97 H new ATOM 0 HA GLU A 190 -26.319 -8.945 -6.994 1.00 4.63 H new ATOM 0 HB2 GLU A 190 -24.170 -7.669 -7.022 1.00 4.83 H new ATOM 0 HB3 GLU A 190 -23.317 -9.133 -6.573 1.00 4.83 H new ATOM 0 HG2 GLU A 190 -23.092 -8.845 -8.944 1.00 5.57 H new ATOM 0 HG3 GLU A 190 -24.140 -10.222 -8.669 1.00 5.57 H new TER 1910 GLU A 190