USER MOD reduce.3.24.130724 H: found=0, std=0, add=1668, rem=0, adj=49 USER MOD reduce.3.24.130724 removed 1666 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 NoAdj : A 66 ASNHD21 : A 66 ASN OD1 : A 198 CACA :(metal ligand) USER MOD NoAdj : A 66 ASNHD22 : A 66 ASN OD1 : A 198 CACA :(metal ligand) USER MOD NoAdj : B 66 ASNHD21 : B 66 ASN OD1 : B 200 CACA :(metal ligand) USER MOD NoAdj : B 66 ASNHD22 : B 66 ASN OD1 : B 200 CACA :(metal ligand) USER MOD Set 1.1: A 74 ASN : amide:sc= 0.527 K(o=1.8,f=-10!) USER MOD Set 1.2: B 85 LYS NZ :NH3+ -118:sc= 1.23 (180deg=-0.0458) USER MOD Set 2.1: B 36 ASN : amide:sc= 2.34 K(o=4.4,f=-13!) USER MOD Set 2.2: B 39 LYS NZ :NH3+ -170:sc= 2.01 (180deg=0.676) USER MOD Set 3.1: A 61 LYS NZ :NH3+ -167:sc= 3.29 (180deg=1.76) USER MOD Set 3.2: A 67 GLN : amide:sc= 1.46 K(o=4.7,f=-8.6!) USER MOD Set 4.1: A 60 MET CE :methyl 145:sc= -0.0753 (180deg=-0.178) USER MOD Set 4.2: A 69 SER OG : rot 180:sc= 0 USER MOD Set 5.1: A 55 SER OG : rot -89:sc= 2.35 USER MOD Set 5.2: A 59 LYS NZ :NH3+ -178:sc= 2.4 (180deg=1.09) USER MOD Set 6.1: A 39 LYS NZ :NH3+ -169:sc= 1.25 (180deg=-0.0874) USER MOD Set 6.2: A 43 THR OG1 : rot 77:sc= 2.18 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -125:sc= 0.278 (180deg=-0.0675) USER MOD Single : A 7 THR OG1 : rot 180:sc= -0.0225 USER MOD Single : A 12 SER OG : rot -32:sc= 1.21 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 83:sc= 1.25 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 GLN : amide:sc= 0.755 K(o=0.75,f=-7.3!) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot -163:sc= 1.3 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 44 GLN : amide:sc= 0.158 X(o=0.16,f=0) USER MOD Single : A 45 GLN : amide:sc= 1.75 K(o=1.7,f=-5.4!) USER MOD Single : A 48 HIS : no HD1:sc= -0.118 K(o=-0.12,f=-1.5) USER MOD Single : A 51 LYS NZ :NH3+ -143:sc= 1.16 (180deg=1.03) USER MOD Single : A 62 SER OG : rot 75:sc= 1.16 USER MOD Single : A 72 LYS NZ :NH3+ -143:sc= 1.09 (180deg=0.0376) USER MOD Single : A 76 TYR OH : rot -73:sc= 1.72 USER MOD Single : A 85 LYS NZ :NH3+ 179:sc= 0.166 (180deg=0.0924) USER MOD Single : A 89 LYS NZ :NH3+ 167:sc= 1.2 (180deg=1.07) USER MOD Single : A 90 LYS NZ :NH3+ -153:sc= 1.22 (180deg=0.7) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ -156:sc= 2.54 (180deg=1.07!) USER MOD Single : A 98 LYS NZ :NH3+ -116:sc= 0.79 (180deg=0.495!) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -172:sc= 1.27 (180deg=1.1) USER MOD Single : B 7 THR OG1 : rot 180:sc= 0 USER MOD Single : B 12 SER OG : rot -90:sc= 0 USER MOD Single : B 15 THR OG1 : rot 180:sc= 0 USER MOD Single : B 18 THR OG1 : rot 180:sc= 0 USER MOD Single : B 19 THR OG1 : rot 88:sc= 1.09 USER MOD Single : B 22 THR OG1 : rot 180:sc= 0 USER MOD Single : B 26 GLN : amide:sc= 0.165 X(o=0.16,f=-0.024) USER MOD Single : B 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 SER OG : rot 175:sc= 1.21 USER MOD Single : B 34 SER OG : rot -121:sc= 0.556 USER MOD Single : B 43 THR OG1 : rot 85:sc= 1.17 USER MOD Single : B 44 GLN : amide:sc= -0.654 K(o=-0.65,f=0) USER MOD Single : B 45 GLN : amide:sc= -0.0586 X(o=-0.059,f=-0.48) USER MOD Single : B 48 HIS : no HD1:sc= -0.0852 X(o=-0.085,f=0) USER MOD Single : B 51 LYS NZ :NH3+ 137:sc= 0.506 (180deg=-1.46!) USER MOD Single : B 55 SER OG : rot -67:sc= 0.915 USER MOD Single : B 59 LYS NZ :NH3+ 139:sc= 2.23 (180deg=-2.49!) USER MOD Single : B 60 MET CE :methyl 163:sc= 0 (180deg=-0.159) USER MOD Single : B 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 62 SER OG : rot 180:sc= 0 USER MOD Single : B 67 GLN : amide:sc= -0.1 X(o=-0.1,f=-0.1) USER MOD Single : B 69 SER OG : rot 45:sc= 0.196 USER MOD Single : B 72 LYS NZ :NH3+ 177:sc= 1.02 (180deg=0.736) USER MOD Single : B 74 ASN : amide:sc= 0.616 K(o=0.62,f=-2.2!) USER MOD Single : B 76 TYR OH : rot -117:sc= 0.724 USER MOD Single : B 89 LYS NZ :NH3+ -168:sc= 0.281 (180deg=-0.909!) USER MOD Single : B 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 91 LYS NZ :NH3+ 171:sc= 1.01 (180deg=0.81) USER MOD Single : B 94 LYS NZ :NH3+ -108:sc= 0.198 (180deg=-2.73!) USER MOD Single : B 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 98 LYS NZ :NH3+ -166:sc= 0.142! (180deg=-1.83!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 6.261 -22.731 -21.492 1.00 4.17 N ATOM 2 CA MET A 1 7.293 -21.995 -22.240 1.00 3.32 C ATOM 3 C MET A 1 7.978 -21.087 -21.222 1.00 2.67 C ATOM 4 O MET A 1 7.811 -21.349 -20.031 1.00 3.18 O ATOM 5 CB MET A 1 6.684 -21.214 -23.417 1.00 3.63 C ATOM 6 CG MET A 1 6.033 -22.108 -24.479 1.00 4.50 C ATOM 7 SD MET A 1 5.382 -21.175 -25.890 1.00 5.51 S ATOM 8 CE MET A 1 4.786 -22.525 -26.931 1.00 6.64 C ATOM 0 H1 MET A 1 6.398 -23.753 -21.626 1.00 4.17 H new ATOM 0 H2 MET A 1 6.335 -22.501 -20.480 1.00 4.17 H new ATOM 0 H3 MET A 1 5.320 -22.459 -21.841 1.00 4.17 H new ATOM 0 HA MET A 1 8.017 -22.668 -22.698 1.00 3.32 H new ATOM 0 HB2 MET A 1 5.937 -20.519 -23.033 1.00 3.63 H new ATOM 0 HB3 MET A 1 7.464 -20.616 -23.887 1.00 3.63 H new ATOM 0 HG2 MET A 1 6.766 -22.831 -24.836 1.00 4.50 H new ATOM 0 HG3 MET A 1 5.223 -22.675 -24.021 1.00 4.50 H new ATOM 0 HE1 MET A 1 4.354 -22.117 -27.844 1.00 6.64 H new ATOM 0 HE2 MET A 1 5.617 -23.182 -27.186 1.00 6.64 H new ATOM 0 HE3 MET A 1 4.027 -23.092 -26.392 1.00 6.64 H new ATOM 20 N ALA A 2 8.688 -20.047 -21.661 1.00 2.47 N ATOM 21 CA ALA A 2 9.066 -18.939 -20.796 1.00 2.31 C ATOM 22 C ALA A 2 7.821 -18.185 -20.331 1.00 2.13 C ATOM 23 O ALA A 2 6.705 -18.502 -20.747 1.00 2.53 O ATOM 24 CB ALA A 2 10.043 -18.028 -21.547 1.00 3.05 C ATOM 0 H ALA A 2 9.014 -19.953 -22.623 1.00 2.47 H new ATOM 0 HA ALA A 2 9.566 -19.313 -19.903 1.00 2.31 H new ATOM 0 HB1 ALA A 2 10.331 -17.195 -20.905 1.00 3.05 H new ATOM 0 HB2 ALA A 2 10.931 -18.596 -21.824 1.00 3.05 H new ATOM 0 HB3 ALA A 2 9.563 -17.643 -22.447 1.00 3.05 H new ATOM 30 N ALA A 3 8.063 -17.194 -19.472 1.00 2.13 N ATOM 31 CA ALA A 3 7.118 -16.389 -18.715 1.00 2.33 C ATOM 32 C ALA A 3 7.053 -16.909 -17.279 1.00 1.82 C ATOM 33 O ALA A 3 6.399 -17.910 -17.000 1.00 2.39 O ATOM 34 CB ALA A 3 5.729 -16.261 -19.357 1.00 3.24 C ATOM 0 H ALA A 3 9.023 -16.911 -19.273 1.00 2.13 H new ATOM 0 HA ALA A 3 7.493 -15.366 -18.716 1.00 2.33 H new ATOM 0 HB1 ALA A 3 5.091 -15.644 -18.724 1.00 3.24 H new ATOM 0 HB2 ALA A 3 5.823 -15.797 -20.339 1.00 3.24 H new ATOM 0 HB3 ALA A 3 5.285 -17.251 -19.465 1.00 3.24 H new ATOM 40 N GLU A 4 7.782 -16.238 -16.386 1.00 1.39 N ATOM 41 CA GLU A 4 7.962 -16.625 -14.999 1.00 1.45 C ATOM 42 C GLU A 4 6.953 -15.864 -14.131 1.00 1.30 C ATOM 43 O GLU A 4 7.018 -14.636 -14.082 1.00 1.34 O ATOM 44 CB GLU A 4 9.426 -16.388 -14.582 1.00 2.17 C ATOM 45 CG GLU A 4 10.143 -15.246 -15.329 1.00 2.72 C ATOM 46 CD GLU A 4 11.582 -15.055 -14.863 1.00 3.98 C ATOM 47 OE1 GLU A 4 12.061 -15.915 -14.093 1.00 4.82 O ATOM 48 OE2 GLU A 4 12.189 -14.064 -15.321 1.00 4.77 O ATOM 0 H GLU A 4 8.279 -15.380 -16.625 1.00 1.39 H new ATOM 0 HA GLU A 4 7.767 -17.688 -14.861 1.00 1.45 H new ATOM 0 HB2 GLU A 4 9.453 -16.175 -13.513 1.00 2.17 H new ATOM 0 HB3 GLU A 4 9.986 -17.310 -14.738 1.00 2.17 H new ATOM 0 HG2 GLU A 4 10.136 -15.455 -16.399 1.00 2.72 H new ATOM 0 HG3 GLU A 4 9.591 -14.318 -15.182 1.00 2.72 H new ATOM 55 N PRO A 5 6.000 -16.549 -13.472 1.00 1.63 N ATOM 56 CA PRO A 5 5.080 -15.896 -12.559 1.00 1.84 C ATOM 57 C PRO A 5 5.857 -15.472 -11.313 1.00 1.48 C ATOM 58 O PRO A 5 6.811 -16.142 -10.915 1.00 1.67 O ATOM 59 CB PRO A 5 4.009 -16.940 -12.241 1.00 2.59 C ATOM 60 CG PRO A 5 4.774 -18.258 -12.346 1.00 2.73 C ATOM 61 CD PRO A 5 5.795 -17.991 -13.454 1.00 2.20 C ATOM 0 HA PRO A 5 4.617 -15.000 -12.972 1.00 1.84 H new ATOM 0 HB2 PRO A 5 3.587 -16.796 -11.246 1.00 2.59 H new ATOM 0 HB3 PRO A 5 3.180 -16.897 -12.948 1.00 2.59 H new ATOM 0 HG2 PRO A 5 5.261 -18.516 -11.405 1.00 2.73 H new ATOM 0 HG3 PRO A 5 4.113 -19.087 -12.600 1.00 2.73 H new ATOM 0 HD2 PRO A 5 6.730 -18.516 -13.258 1.00 2.20 H new ATOM 0 HD3 PRO A 5 5.427 -18.345 -14.417 1.00 2.20 H new ATOM 69 N LEU A 6 5.458 -14.355 -10.713 1.00 1.23 N ATOM 70 CA LEU A 6 6.126 -13.760 -9.568 1.00 1.09 C ATOM 71 C LEU A 6 5.331 -14.123 -8.305 1.00 1.17 C ATOM 72 O LEU A 6 4.271 -14.745 -8.399 1.00 1.29 O ATOM 73 CB LEU A 6 6.232 -12.252 -9.839 1.00 1.08 C ATOM 74 CG LEU A 6 7.005 -11.915 -11.133 1.00 1.01 C ATOM 75 CD1 LEU A 6 6.800 -10.429 -11.459 1.00 1.44 C ATOM 76 CD2 LEU A 6 8.505 -12.192 -10.973 1.00 1.42 C ATOM 0 H LEU A 6 4.640 -13.828 -11.020 1.00 1.23 H new ATOM 0 HA LEU A 6 7.137 -14.134 -9.410 1.00 1.09 H new ATOM 0 HB2 LEU A 6 5.229 -11.830 -9.903 1.00 1.08 H new ATOM 0 HB3 LEU A 6 6.726 -11.772 -8.994 1.00 1.08 H new ATOM 0 HG LEU A 6 6.625 -12.543 -11.939 1.00 1.01 H new ATOM 0 HD11 LEU A 6 7.341 -10.179 -12.371 1.00 1.44 H new ATOM 0 HD12 LEU A 6 5.738 -10.231 -11.601 1.00 1.44 H new ATOM 0 HD13 LEU A 6 7.175 -9.821 -10.636 1.00 1.44 H new ATOM 0 HD21 LEU A 6 9.022 -11.945 -11.900 1.00 1.42 H new ATOM 0 HD22 LEU A 6 8.903 -11.582 -10.162 1.00 1.42 H new ATOM 0 HD23 LEU A 6 8.658 -13.246 -10.742 1.00 1.42 H new ATOM 88 N THR A 7 5.828 -13.803 -7.105 1.00 1.23 N ATOM 89 CA THR A 7 5.065 -14.115 -5.895 1.00 1.41 C ATOM 90 C THR A 7 3.841 -13.194 -5.794 1.00 1.29 C ATOM 91 O THR A 7 3.813 -12.131 -6.409 1.00 1.27 O ATOM 92 CB THR A 7 5.952 -14.068 -4.641 1.00 1.63 C ATOM 93 OG1 THR A 7 5.186 -14.430 -3.506 1.00 2.51 O ATOM 94 CG2 THR A 7 6.577 -12.692 -4.408 1.00 1.10 C ATOM 0 H THR A 7 6.725 -13.343 -6.948 1.00 1.23 H new ATOM 0 HA THR A 7 4.699 -15.140 -5.962 1.00 1.41 H new ATOM 0 HB THR A 7 6.768 -14.774 -4.799 1.00 1.63 H new ATOM 0 HG1 THR A 7 5.752 -14.402 -2.707 1.00 2.51 H new ATOM 0 HG21 THR A 7 7.192 -12.719 -3.509 1.00 1.10 H new ATOM 0 HG22 THR A 7 7.197 -12.424 -5.264 1.00 1.10 H new ATOM 0 HG23 THR A 7 5.788 -11.950 -4.285 1.00 1.10 H new ATOM 102 N GLU A 8 2.842 -13.567 -4.987 1.00 1.46 N ATOM 103 CA GLU A 8 1.619 -12.796 -4.790 1.00 1.45 C ATOM 104 C GLU A 8 1.925 -11.332 -4.512 1.00 1.14 C ATOM 105 O GLU A 8 1.272 -10.435 -5.046 1.00 1.19 O ATOM 106 CB GLU A 8 0.833 -13.391 -3.617 1.00 1.78 C ATOM 107 CG GLU A 8 -0.034 -14.543 -4.123 1.00 1.68 C ATOM 108 CD GLU A 8 -0.499 -15.450 -2.990 1.00 1.96 C ATOM 109 OE1 GLU A 8 0.394 -15.954 -2.275 1.00 2.09 O ATOM 110 OE2 GLU A 8 -1.728 -15.632 -2.869 1.00 2.61 O ATOM 0 H GLU A 8 2.865 -14.430 -4.444 1.00 1.46 H new ATOM 0 HA GLU A 8 1.027 -12.847 -5.704 1.00 1.45 H new ATOM 0 HB2 GLU A 8 1.519 -13.747 -2.848 1.00 1.78 H new ATOM 0 HB3 GLU A 8 0.208 -12.625 -3.157 1.00 1.78 H new ATOM 0 HG2 GLU A 8 -0.902 -14.141 -4.645 1.00 1.68 H new ATOM 0 HG3 GLU A 8 0.530 -15.129 -4.848 1.00 1.68 H new ATOM 117 N LEU A 9 2.918 -11.089 -3.657 1.00 0.90 N ATOM 118 CA LEU A 9 3.251 -9.737 -3.279 1.00 0.70 C ATOM 119 C LEU A 9 3.725 -8.968 -4.515 1.00 0.66 C ATOM 120 O LEU A 9 3.133 -7.947 -4.847 1.00 0.63 O ATOM 121 CB LEU A 9 4.252 -9.723 -2.119 1.00 0.60 C ATOM 122 CG LEU A 9 3.624 -10.295 -0.830 1.00 0.76 C ATOM 123 CD1 LEU A 9 3.774 -11.818 -0.713 1.00 1.88 C ATOM 124 CD2 LEU A 9 4.266 -9.627 0.391 1.00 1.96 C ATOM 0 H LEU A 9 3.494 -11.810 -3.223 1.00 0.90 H new ATOM 0 HA LEU A 9 2.367 -9.223 -2.902 1.00 0.70 H new ATOM 0 HB2 LEU A 9 5.132 -10.308 -2.388 1.00 0.60 H new ATOM 0 HB3 LEU A 9 4.590 -8.702 -1.940 1.00 0.60 H new ATOM 0 HG LEU A 9 2.556 -10.080 -0.874 1.00 0.76 H new ATOM 0 HD11 LEU A 9 3.313 -12.159 0.214 1.00 1.88 H new ATOM 0 HD12 LEU A 9 3.284 -12.298 -1.560 1.00 1.88 H new ATOM 0 HD13 LEU A 9 4.832 -12.080 -0.709 1.00 1.88 H new ATOM 0 HD21 LEU A 9 3.823 -10.031 1.301 1.00 1.96 H new ATOM 0 HD22 LEU A 9 5.338 -9.823 0.391 1.00 1.96 H new ATOM 0 HD23 LEU A 9 4.094 -8.551 0.350 1.00 1.96 H new ATOM 136 N GLU A 10 4.728 -9.491 -5.222 1.00 0.67 N ATOM 137 CA GLU A 10 5.246 -8.963 -6.480 1.00 0.63 C ATOM 138 C GLU A 10 4.106 -8.695 -7.472 1.00 0.67 C ATOM 139 O GLU A 10 3.925 -7.563 -7.923 1.00 0.73 O ATOM 140 CB GLU A 10 6.277 -9.941 -7.059 1.00 0.71 C ATOM 141 CG GLU A 10 7.550 -10.004 -6.200 1.00 1.38 C ATOM 142 CD GLU A 10 8.526 -11.104 -6.619 1.00 1.58 C ATOM 143 OE1 GLU A 10 8.034 -12.186 -7.017 1.00 2.70 O ATOM 144 OE2 GLU A 10 9.746 -10.855 -6.506 1.00 2.16 O ATOM 0 H GLU A 10 5.221 -10.331 -4.918 1.00 0.67 H new ATOM 0 HA GLU A 10 5.739 -8.009 -6.293 1.00 0.63 H new ATOM 0 HB2 GLU A 10 5.836 -10.935 -7.128 1.00 0.71 H new ATOM 0 HB3 GLU A 10 6.537 -9.637 -8.073 1.00 0.71 H new ATOM 0 HG2 GLU A 10 8.059 -9.041 -6.251 1.00 1.38 H new ATOM 0 HG3 GLU A 10 7.267 -10.160 -5.159 1.00 1.38 H new ATOM 151 N GLU A 11 3.326 -9.734 -7.787 1.00 0.69 N ATOM 152 CA GLU A 11 2.176 -9.646 -8.677 1.00 0.76 C ATOM 153 C GLU A 11 1.274 -8.482 -8.252 1.00 0.77 C ATOM 154 O GLU A 11 0.922 -7.639 -9.072 1.00 0.78 O ATOM 155 CB GLU A 11 1.401 -10.975 -8.675 1.00 0.87 C ATOM 156 CG GLU A 11 2.194 -12.164 -9.253 1.00 1.47 C ATOM 157 CD GLU A 11 2.366 -12.140 -10.770 1.00 2.21 C ATOM 158 OE1 GLU A 11 1.653 -11.346 -11.421 1.00 2.19 O ATOM 159 OE2 GLU A 11 3.202 -12.936 -11.257 1.00 3.59 O ATOM 0 H GLU A 11 3.483 -10.673 -7.422 1.00 0.69 H new ATOM 0 HA GLU A 11 2.522 -9.458 -9.693 1.00 0.76 H new ATOM 0 HB2 GLU A 11 1.107 -11.211 -7.652 1.00 0.87 H new ATOM 0 HB3 GLU A 11 0.483 -10.850 -9.250 1.00 0.87 H new ATOM 0 HG2 GLU A 11 3.180 -12.185 -8.790 1.00 1.47 H new ATOM 0 HG3 GLU A 11 1.691 -13.089 -8.973 1.00 1.47 H new ATOM 166 N SER A 12 0.897 -8.412 -6.971 1.00 0.81 N ATOM 167 CA SER A 12 0.009 -7.364 -6.488 1.00 0.89 C ATOM 168 C SER A 12 0.640 -5.968 -6.606 1.00 0.84 C ATOM 169 O SER A 12 -0.003 -5.042 -7.106 1.00 0.98 O ATOM 170 CB SER A 12 -0.492 -7.677 -5.072 1.00 0.97 C ATOM 171 OG SER A 12 0.552 -7.623 -4.124 1.00 1.61 O ATOM 0 H SER A 12 1.197 -9.072 -6.254 1.00 0.81 H new ATOM 0 HA SER A 12 -0.867 -7.345 -7.137 1.00 0.89 H new ATOM 0 HB2 SER A 12 -1.271 -6.966 -4.796 1.00 0.97 H new ATOM 0 HB3 SER A 12 -0.946 -8.668 -5.057 1.00 0.97 H new ATOM 0 HG SER A 12 1.391 -7.904 -4.545 1.00 1.61 H new ATOM 177 N ILE A 13 1.892 -5.783 -6.164 1.00 0.73 N ATOM 178 CA ILE A 13 2.518 -4.470 -6.252 1.00 0.78 C ATOM 179 C ILE A 13 2.660 -4.048 -7.713 1.00 0.88 C ATOM 180 O ILE A 13 2.510 -2.865 -8.013 1.00 1.10 O ATOM 181 CB ILE A 13 3.780 -4.314 -5.374 1.00 0.75 C ATOM 182 CG1 ILE A 13 4.938 -5.281 -5.650 1.00 0.70 C ATOM 183 CG2 ILE A 13 3.359 -4.466 -3.905 1.00 0.72 C ATOM 184 CD1 ILE A 13 5.780 -4.908 -6.866 1.00 0.65 C ATOM 0 H ILE A 13 2.475 -6.512 -5.752 1.00 0.73 H new ATOM 0 HA ILE A 13 1.849 -3.740 -5.795 1.00 0.78 H new ATOM 0 HB ILE A 13 4.178 -3.330 -5.621 1.00 0.75 H new ATOM 0 HG12 ILE A 13 5.583 -5.320 -4.772 1.00 0.70 H new ATOM 0 HG13 ILE A 13 4.535 -6.283 -5.794 1.00 0.70 H new ATOM 0 HG21 ILE A 13 4.233 -4.360 -3.263 1.00 0.72 H new ATOM 0 HG22 ILE A 13 2.629 -3.696 -3.654 1.00 0.72 H new ATOM 0 HG23 ILE A 13 2.915 -5.450 -3.754 1.00 0.72 H new ATOM 0 HD11 ILE A 13 6.578 -5.640 -6.994 1.00 0.65 H new ATOM 0 HD12 ILE A 13 5.150 -4.898 -7.756 1.00 0.65 H new ATOM 0 HD13 ILE A 13 6.215 -3.919 -6.718 1.00 0.65 H new ATOM 196 N GLU A 14 2.850 -4.997 -8.639 1.00 0.78 N ATOM 197 CA GLU A 14 2.757 -4.665 -10.049 1.00 0.83 C ATOM 198 C GLU A 14 1.317 -4.261 -10.383 1.00 0.93 C ATOM 199 O GLU A 14 1.104 -3.143 -10.835 1.00 1.05 O ATOM 200 CB GLU A 14 3.291 -5.788 -10.949 1.00 0.82 C ATOM 201 CG GLU A 14 3.892 -5.192 -12.235 1.00 0.89 C ATOM 202 CD GLU A 14 2.894 -4.369 -13.044 1.00 2.02 C ATOM 203 OE1 GLU A 14 1.854 -4.946 -13.424 1.00 2.54 O ATOM 204 OE2 GLU A 14 3.175 -3.166 -13.243 1.00 3.14 O ATOM 0 H GLU A 14 3.063 -5.974 -8.436 1.00 0.78 H new ATOM 0 HA GLU A 14 3.403 -3.812 -10.254 1.00 0.83 H new ATOM 0 HB2 GLU A 14 4.049 -6.363 -10.416 1.00 0.82 H new ATOM 0 HB3 GLU A 14 2.485 -6.478 -11.200 1.00 0.82 H new ATOM 0 HG2 GLU A 14 4.742 -4.563 -11.972 1.00 0.89 H new ATOM 0 HG3 GLU A 14 4.274 -6.001 -12.858 1.00 0.89 H new ATOM 211 N THR A 15 0.325 -5.122 -10.124 1.00 0.91 N ATOM 212 CA THR A 15 -1.056 -4.908 -10.562 1.00 0.95 C ATOM 213 C THR A 15 -1.544 -3.490 -10.224 1.00 0.99 C ATOM 214 O THR A 15 -2.143 -2.809 -11.058 1.00 1.09 O ATOM 215 CB THR A 15 -2.006 -6.043 -10.114 1.00 1.05 C ATOM 216 OG1 THR A 15 -2.960 -6.286 -11.130 1.00 1.40 O ATOM 217 CG2 THR A 15 -2.787 -5.803 -8.819 1.00 1.24 C ATOM 0 H THR A 15 0.460 -5.989 -9.603 1.00 0.91 H new ATOM 0 HA THR A 15 -1.071 -4.965 -11.650 1.00 0.95 H new ATOM 0 HB THR A 15 -1.339 -6.884 -9.924 1.00 1.05 H new ATOM 0 HG1 THR A 15 -3.562 -7.006 -10.848 1.00 1.40 H new ATOM 0 HG21 THR A 15 -3.418 -6.667 -8.609 1.00 1.24 H new ATOM 0 HG22 THR A 15 -2.089 -5.655 -7.995 1.00 1.24 H new ATOM 0 HG23 THR A 15 -3.411 -4.916 -8.930 1.00 1.24 H new ATOM 225 N VAL A 16 -1.247 -3.007 -9.015 1.00 0.93 N ATOM 226 CA VAL A 16 -1.619 -1.650 -8.623 1.00 0.96 C ATOM 227 C VAL A 16 -0.799 -0.597 -9.385 1.00 0.93 C ATOM 228 O VAL A 16 -1.346 0.429 -9.788 1.00 0.97 O ATOM 229 CB VAL A 16 -1.582 -1.449 -7.096 1.00 0.99 C ATOM 230 CG1 VAL A 16 -2.471 -2.478 -6.389 1.00 1.03 C ATOM 231 CG2 VAL A 16 -0.168 -1.510 -6.512 1.00 0.94 C ATOM 0 H VAL A 16 -0.752 -3.534 -8.295 1.00 0.93 H new ATOM 0 HA VAL A 16 -2.659 -1.505 -8.914 1.00 0.96 H new ATOM 0 HB VAL A 16 -1.964 -0.444 -6.919 1.00 0.99 H new ATOM 0 HG11 VAL A 16 -2.429 -2.316 -5.312 1.00 1.03 H new ATOM 0 HG12 VAL A 16 -3.500 -2.367 -6.733 1.00 1.03 H new ATOM 0 HG13 VAL A 16 -2.118 -3.483 -6.619 1.00 1.03 H new ATOM 0 HG21 VAL A 16 -0.213 -1.361 -5.433 1.00 0.94 H new ATOM 0 HG22 VAL A 16 0.272 -2.484 -6.726 1.00 0.94 H new ATOM 0 HG23 VAL A 16 0.445 -0.728 -6.961 1.00 0.94 H new ATOM 241 N VAL A 17 0.497 -0.836 -9.603 1.00 0.87 N ATOM 242 CA VAL A 17 1.370 0.058 -10.355 1.00 0.84 C ATOM 243 C VAL A 17 0.907 0.162 -11.815 1.00 0.77 C ATOM 244 O VAL A 17 0.757 1.269 -12.330 1.00 0.73 O ATOM 245 CB VAL A 17 2.841 -0.371 -10.187 1.00 0.90 C ATOM 246 CG1 VAL A 17 3.764 0.301 -11.206 1.00 0.87 C ATOM 247 CG2 VAL A 17 3.323 0.019 -8.781 1.00 0.99 C ATOM 0 H VAL A 17 0.972 -1.669 -9.255 1.00 0.87 H new ATOM 0 HA VAL A 17 1.304 1.069 -9.954 1.00 0.84 H new ATOM 0 HB VAL A 17 2.883 -1.449 -10.343 1.00 0.90 H new ATOM 0 HG11 VAL A 17 4.789 -0.034 -11.045 1.00 0.87 H new ATOM 0 HG12 VAL A 17 3.449 0.034 -12.215 1.00 0.87 H new ATOM 0 HG13 VAL A 17 3.713 1.383 -11.085 1.00 0.87 H new ATOM 0 HG21 VAL A 17 4.363 -0.282 -8.656 1.00 0.99 H new ATOM 0 HG22 VAL A 17 3.240 1.098 -8.654 1.00 0.99 H new ATOM 0 HG23 VAL A 17 2.708 -0.482 -8.034 1.00 0.99 H new ATOM 257 N THR A 18 0.634 -0.953 -12.493 1.00 0.79 N ATOM 258 CA THR A 18 0.077 -0.901 -13.839 1.00 0.74 C ATOM 259 C THR A 18 -1.285 -0.191 -13.837 1.00 0.67 C ATOM 260 O THR A 18 -1.508 0.681 -14.680 1.00 0.61 O ATOM 261 CB THR A 18 0.074 -2.282 -14.514 1.00 0.81 C ATOM 262 OG1 THR A 18 -0.388 -2.184 -15.845 1.00 0.80 O ATOM 263 CG2 THR A 18 -0.779 -3.304 -13.770 1.00 0.85 C ATOM 0 H THR A 18 0.789 -1.895 -12.133 1.00 0.79 H new ATOM 0 HA THR A 18 0.730 -0.293 -14.465 1.00 0.74 H new ATOM 0 HB THR A 18 1.107 -2.630 -14.496 1.00 0.81 H new ATOM 0 HG1 THR A 18 -0.382 -3.072 -16.260 1.00 0.80 H new ATOM 0 HG21 THR A 18 -0.742 -4.259 -14.294 1.00 0.85 H new ATOM 0 HG22 THR A 18 -0.395 -3.430 -12.758 1.00 0.85 H new ATOM 0 HG23 THR A 18 -1.810 -2.954 -13.726 1.00 0.85 H new ATOM 271 N THR A 19 -2.179 -0.485 -12.878 1.00 0.69 N ATOM 272 CA THR A 19 -3.458 0.219 -12.788 1.00 0.67 C ATOM 273 C THR A 19 -3.224 1.734 -12.649 1.00 0.65 C ATOM 274 O THR A 19 -3.847 2.529 -13.350 1.00 0.64 O ATOM 275 CB THR A 19 -4.334 -0.377 -11.674 1.00 0.70 C ATOM 276 OG1 THR A 19 -4.505 -1.757 -11.910 1.00 0.71 O ATOM 277 CG2 THR A 19 -5.744 0.222 -11.650 1.00 0.77 C ATOM 0 H THR A 19 -2.037 -1.199 -12.163 1.00 0.69 H new ATOM 0 HA THR A 19 -4.018 0.078 -13.712 1.00 0.67 H new ATOM 0 HB THR A 19 -3.827 -0.162 -10.733 1.00 0.70 H new ATOM 0 HG1 THR A 19 -3.731 -2.247 -11.562 1.00 0.71 H new ATOM 0 HG21 THR A 19 -6.320 -0.234 -10.845 1.00 0.77 H new ATOM 0 HG22 THR A 19 -5.680 1.298 -11.486 1.00 0.77 H new ATOM 0 HG23 THR A 19 -6.237 0.029 -12.603 1.00 0.77 H new ATOM 285 N PHE A 20 -2.286 2.136 -11.783 1.00 0.73 N ATOM 286 CA PHE A 20 -1.849 3.521 -11.667 1.00 0.76 C ATOM 287 C PHE A 20 -1.426 4.060 -13.038 1.00 0.70 C ATOM 288 O PHE A 20 -2.022 5.015 -13.530 1.00 0.70 O ATOM 289 CB PHE A 20 -0.740 3.633 -10.604 1.00 0.90 C ATOM 290 CG PHE A 20 -0.033 4.974 -10.520 1.00 1.54 C ATOM 291 CD1 PHE A 20 1.072 5.243 -11.353 1.00 2.59 C ATOM 292 CD2 PHE A 20 -0.426 5.925 -9.560 1.00 2.62 C ATOM 293 CE1 PHE A 20 1.713 6.492 -11.296 1.00 3.32 C ATOM 294 CE2 PHE A 20 0.267 7.143 -9.452 1.00 3.37 C ATOM 295 CZ PHE A 20 1.313 7.442 -10.343 1.00 3.35 C ATOM 0 H PHE A 20 -1.810 1.501 -11.142 1.00 0.73 H new ATOM 0 HA PHE A 20 -2.676 4.146 -11.330 1.00 0.76 H new ATOM 0 HB2 PHE A 20 -1.175 3.412 -9.629 1.00 0.90 H new ATOM 0 HB3 PHE A 20 0.006 2.863 -10.803 1.00 0.90 H new ATOM 0 HD1 PHE A 20 1.427 4.487 -12.037 1.00 2.59 H new ATOM 0 HD2 PHE A 20 -1.260 5.719 -8.906 1.00 2.62 H new ATOM 0 HE1 PHE A 20 2.513 6.721 -11.985 1.00 3.32 H new ATOM 0 HE2 PHE A 20 -0.004 7.851 -8.683 1.00 3.37 H new ATOM 0 HZ PHE A 20 1.808 8.401 -10.294 1.00 3.35 H new ATOM 305 N PHE A 21 -0.425 3.451 -13.680 1.00 0.73 N ATOM 306 CA PHE A 21 0.129 3.967 -14.928 1.00 0.75 C ATOM 307 C PHE A 21 -0.928 4.075 -16.028 1.00 0.69 C ATOM 308 O PHE A 21 -1.029 5.110 -16.689 1.00 0.78 O ATOM 309 CB PHE A 21 1.312 3.115 -15.406 1.00 0.90 C ATOM 310 CG PHE A 21 2.600 3.277 -14.617 1.00 1.61 C ATOM 311 CD1 PHE A 21 3.179 4.554 -14.465 1.00 2.77 C ATOM 312 CD2 PHE A 21 3.326 2.138 -14.221 1.00 2.96 C ATOM 313 CE1 PHE A 21 4.444 4.693 -13.869 1.00 3.80 C ATOM 314 CE2 PHE A 21 4.616 2.275 -13.677 1.00 4.17 C ATOM 315 CZ PHE A 21 5.164 3.552 -13.476 1.00 4.25 C ATOM 0 H PHE A 21 0.019 2.594 -13.350 1.00 0.73 H new ATOM 0 HA PHE A 21 0.489 4.974 -14.717 1.00 0.75 H new ATOM 0 HB2 PHE A 21 1.017 2.066 -15.374 1.00 0.90 H new ATOM 0 HB3 PHE A 21 1.513 3.358 -16.449 1.00 0.90 H new ATOM 0 HD1 PHE A 21 2.648 5.429 -14.808 1.00 2.77 H new ATOM 0 HD2 PHE A 21 2.891 1.156 -14.335 1.00 2.96 H new ATOM 0 HE1 PHE A 21 4.863 5.676 -13.713 1.00 3.80 H new ATOM 0 HE2 PHE A 21 5.186 1.396 -13.413 1.00 4.17 H new ATOM 0 HZ PHE A 21 6.137 3.657 -13.020 1.00 4.25 H new ATOM 325 N THR A 22 -1.723 3.022 -16.237 1.00 0.66 N ATOM 326 CA THR A 22 -2.723 3.043 -17.293 1.00 0.78 C ATOM 327 C THR A 22 -3.778 4.124 -17.037 1.00 0.83 C ATOM 328 O THR A 22 -4.400 4.580 -17.996 1.00 1.19 O ATOM 329 CB THR A 22 -3.321 1.654 -17.568 1.00 0.91 C ATOM 330 OG1 THR A 22 -3.943 1.663 -18.837 1.00 1.92 O ATOM 331 CG2 THR A 22 -4.350 1.220 -16.528 1.00 1.65 C ATOM 0 H THR A 22 -1.691 2.159 -15.695 1.00 0.66 H new ATOM 0 HA THR A 22 -2.217 3.318 -18.219 1.00 0.78 H new ATOM 0 HB THR A 22 -2.496 0.943 -17.525 1.00 0.91 H new ATOM 0 HG1 THR A 22 -4.326 0.780 -19.020 1.00 1.92 H new ATOM 0 HG21 THR A 22 -4.731 0.231 -16.784 1.00 1.65 H new ATOM 0 HG22 THR A 22 -3.881 1.185 -15.545 1.00 1.65 H new ATOM 0 HG23 THR A 22 -5.174 1.933 -16.512 1.00 1.65 H new ATOM 339 N PHE A 23 -3.964 4.550 -15.780 1.00 0.74 N ATOM 340 CA PHE A 23 -4.743 5.740 -15.465 1.00 0.81 C ATOM 341 C PHE A 23 -3.920 7.013 -15.680 1.00 0.86 C ATOM 342 O PHE A 23 -4.412 7.982 -16.234 1.00 1.01 O ATOM 343 CB PHE A 23 -5.351 5.653 -14.058 1.00 0.86 C ATOM 344 CG PHE A 23 -6.721 5.002 -14.071 1.00 0.97 C ATOM 345 CD1 PHE A 23 -6.845 3.662 -14.487 1.00 2.33 C ATOM 346 CD2 PHE A 23 -7.874 5.807 -13.980 1.00 2.01 C ATOM 347 CE1 PHE A 23 -8.084 3.169 -14.928 1.00 2.95 C ATOM 348 CE2 PHE A 23 -9.118 5.299 -14.387 1.00 2.46 C ATOM 349 CZ PHE A 23 -9.211 4.006 -14.927 1.00 2.55 C ATOM 0 H PHE A 23 -3.578 4.078 -14.962 1.00 0.74 H new ATOM 0 HA PHE A 23 -5.582 5.792 -16.159 1.00 0.81 H new ATOM 0 HB2 PHE A 23 -4.685 5.084 -13.410 1.00 0.86 H new ATOM 0 HB3 PHE A 23 -5.429 6.654 -13.634 1.00 0.86 H new ATOM 0 HD1 PHE A 23 -5.984 3.011 -14.467 1.00 2.33 H new ATOM 0 HD2 PHE A 23 -7.801 6.814 -13.597 1.00 2.01 H new ATOM 0 HE1 PHE A 23 -8.170 2.147 -15.267 1.00 2.95 H new ATOM 0 HE2 PHE A 23 -10.006 5.905 -14.284 1.00 2.46 H new ATOM 0 HZ PHE A 23 -10.146 3.657 -15.340 1.00 2.55 H new ATOM 359 N ALA A 24 -2.654 7.032 -15.279 1.00 0.85 N ATOM 360 CA ALA A 24 -1.784 8.203 -15.336 1.00 1.02 C ATOM 361 C ALA A 24 -1.661 8.773 -16.745 1.00 1.10 C ATOM 362 O ALA A 24 -1.470 9.985 -16.910 1.00 1.28 O ATOM 363 CB ALA A 24 -0.393 7.836 -14.817 1.00 1.13 C ATOM 0 H ALA A 24 -2.190 6.209 -14.894 1.00 0.85 H new ATOM 0 HA ALA A 24 -2.237 8.971 -14.709 1.00 1.02 H new ATOM 0 HB1 ALA A 24 0.254 8.712 -14.861 1.00 1.13 H new ATOM 0 HB2 ALA A 24 -0.469 7.492 -13.786 1.00 1.13 H new ATOM 0 HB3 ALA A 24 0.028 7.042 -15.434 1.00 1.13 H new ATOM 369 N ARG A 25 -1.734 7.876 -17.734 1.00 1.04 N ATOM 370 CA ARG A 25 -1.654 8.169 -19.155 1.00 1.18 C ATOM 371 C ARG A 25 -2.937 8.754 -19.741 1.00 1.44 C ATOM 372 O ARG A 25 -2.875 9.238 -20.868 1.00 1.79 O ATOM 373 CB ARG A 25 -1.048 7.006 -19.953 1.00 1.19 C ATOM 374 CG ARG A 25 -1.904 5.736 -19.996 1.00 1.69 C ATOM 375 CD ARG A 25 -3.005 5.784 -21.070 1.00 1.85 C ATOM 376 NE ARG A 25 -4.347 5.617 -20.490 1.00 2.42 N ATOM 377 CZ ARG A 25 -5.473 5.450 -21.201 1.00 2.90 C ATOM 378 NH1 ARG A 25 -5.437 5.500 -22.537 1.00 3.08 N ATOM 379 NH2 ARG A 25 -6.625 5.229 -20.567 1.00 3.82 N ATOM 0 H ARG A 25 -1.856 6.881 -17.548 1.00 1.04 H new ATOM 0 HA ARG A 25 -0.943 8.988 -19.261 1.00 1.18 H new ATOM 0 HB2 ARG A 25 -0.869 7.340 -20.975 1.00 1.19 H new ATOM 0 HB3 ARG A 25 -0.077 6.758 -19.524 1.00 1.19 H new ATOM 0 HG2 ARG A 25 -1.259 4.877 -20.184 1.00 1.69 H new ATOM 0 HG3 ARG A 25 -2.364 5.582 -19.020 1.00 1.69 H new ATOM 0 HD2 ARG A 25 -2.954 6.736 -21.599 1.00 1.85 H new ATOM 0 HD3 ARG A 25 -2.828 5.000 -21.806 1.00 1.85 H new ATOM 0 HE ARG A 25 -4.427 5.629 -19.473 1.00 2.42 H new ATOM 0 HH11 ARG A 25 -4.553 5.665 -23.018 1.00 3.08 H new ATOM 0 HH12 ARG A 25 -6.294 5.373 -23.075 1.00 3.08 H new ATOM 0 HH21 ARG A 25 -6.647 5.188 -19.548 1.00 3.82 H new ATOM 0 HH22 ARG A 25 -7.485 5.101 -21.101 1.00 3.82 H new ATOM 393 N GLN A 26 -4.081 8.668 -19.043 1.00 1.33 N ATOM 394 CA GLN A 26 -5.345 9.256 -19.508 1.00 1.41 C ATOM 395 C GLN A 26 -5.133 10.622 -20.178 1.00 1.69 C ATOM 396 O GLN A 26 -5.414 10.793 -21.362 1.00 1.90 O ATOM 397 CB GLN A 26 -6.283 9.478 -18.312 1.00 1.19 C ATOM 398 CG GLN A 26 -7.551 8.647 -18.224 1.00 1.22 C ATOM 399 CD GLN A 26 -7.296 7.188 -17.888 1.00 1.32 C ATOM 400 OE1 GLN A 26 -6.328 6.595 -18.353 1.00 1.81 O ATOM 401 NE2 GLN A 26 -8.174 6.575 -17.110 1.00 1.89 N ATOM 0 H GLN A 26 -4.155 8.191 -18.145 1.00 1.33 H new ATOM 0 HA GLN A 26 -5.770 8.560 -20.231 1.00 1.41 H new ATOM 0 HB2 GLN A 26 -5.708 9.304 -17.403 1.00 1.19 H new ATOM 0 HB3 GLN A 26 -6.574 10.529 -18.309 1.00 1.19 H new ATOM 0 HG2 GLN A 26 -8.206 9.077 -17.466 1.00 1.22 H new ATOM 0 HG3 GLN A 26 -8.081 8.706 -19.175 1.00 1.22 H new ATOM 0 HE21 GLN A 26 -8.971 7.090 -16.736 1.00 1.89 H new ATOM 0 HE22 GLN A 26 -8.054 5.587 -16.885 1.00 1.89 H new ATOM 410 N GLU A 27 -4.680 11.590 -19.377 1.00 1.73 N ATOM 411 CA GLU A 27 -4.576 12.996 -19.722 1.00 2.04 C ATOM 412 C GLU A 27 -3.288 13.567 -19.126 1.00 1.75 C ATOM 413 O GLU A 27 -2.519 12.853 -18.469 1.00 1.97 O ATOM 414 CB GLU A 27 -5.764 13.767 -19.119 1.00 2.58 C ATOM 415 CG GLU A 27 -7.159 13.267 -19.507 1.00 3.00 C ATOM 416 CD GLU A 27 -8.195 14.318 -19.122 1.00 3.85 C ATOM 417 OE1 GLU A 27 -8.113 14.786 -17.964 1.00 3.38 O ATOM 418 OE2 GLU A 27 -9.006 14.671 -20.004 1.00 5.46 O ATOM 0 H GLU A 27 -4.363 11.398 -18.427 1.00 1.73 H new ATOM 0 HA GLU A 27 -4.574 13.097 -20.807 1.00 2.04 H new ATOM 0 HB2 GLU A 27 -5.678 13.735 -18.033 1.00 2.58 H new ATOM 0 HB3 GLU A 27 -5.680 14.813 -19.415 1.00 2.58 H new ATOM 0 HG2 GLU A 27 -7.203 13.071 -20.578 1.00 3.00 H new ATOM 0 HG3 GLU A 27 -7.374 12.325 -19.002 1.00 3.00 H new ATOM 425 N GLY A 28 -3.124 14.888 -19.292 1.00 1.91 N ATOM 426 CA GLY A 28 -2.286 15.779 -18.498 1.00 2.39 C ATOM 427 C GLY A 28 -1.128 15.064 -17.818 1.00 2.22 C ATOM 428 O GLY A 28 -1.313 14.493 -16.736 1.00 2.07 O ATOM 0 H GLY A 28 -3.609 15.389 -20.036 1.00 1.91 H new ATOM 0 HA2 GLY A 28 -1.892 16.566 -19.141 1.00 2.39 H new ATOM 0 HA3 GLY A 28 -2.900 16.265 -17.740 1.00 2.39 H new ATOM 432 N ARG A 29 0.029 15.042 -18.490 1.00 2.39 N ATOM 433 CA ARG A 29 1.256 14.431 -18.001 1.00 2.41 C ATOM 434 C ARG A 29 1.058 12.918 -17.802 1.00 2.31 C ATOM 435 O ARG A 29 0.335 12.455 -16.912 1.00 2.13 O ATOM 436 CB ARG A 29 1.803 15.236 -16.810 1.00 2.38 C ATOM 437 CG ARG A 29 2.430 16.532 -17.348 1.00 3.14 C ATOM 438 CD ARG A 29 2.849 17.501 -16.238 1.00 3.13 C ATOM 439 NE ARG A 29 3.659 18.599 -16.790 1.00 3.93 N ATOM 440 CZ ARG A 29 4.147 19.642 -16.099 1.00 4.54 C ATOM 441 NH1 ARG A 29 3.825 19.831 -14.818 1.00 4.88 N ATOM 442 NH2 ARG A 29 4.969 20.506 -16.705 1.00 5.45 N ATOM 0 H ARG A 29 0.133 15.462 -19.414 1.00 2.39 H new ATOM 0 HA ARG A 29 2.057 14.483 -18.739 1.00 2.41 H new ATOM 0 HB2 ARG A 29 1.002 15.465 -16.107 1.00 2.38 H new ATOM 0 HB3 ARG A 29 2.546 14.652 -16.267 1.00 2.38 H new ATOM 0 HG2 ARG A 29 3.302 16.283 -17.953 1.00 3.14 H new ATOM 0 HG3 ARG A 29 1.716 17.028 -18.006 1.00 3.14 H new ATOM 0 HD2 ARG A 29 1.964 17.906 -15.747 1.00 3.13 H new ATOM 0 HD3 ARG A 29 3.419 16.967 -15.478 1.00 3.13 H new ATOM 0 HE ARG A 29 3.869 18.565 -17.788 1.00 3.93 H new ATOM 0 HH11 ARG A 29 3.199 19.178 -14.348 1.00 4.88 H new ATOM 0 HH12 ARG A 29 4.205 20.629 -14.309 1.00 4.88 H new ATOM 0 HH21 ARG A 29 5.220 20.370 -17.684 1.00 5.45 H new ATOM 0 HH22 ARG A 29 5.344 21.301 -16.188 1.00 5.45 H new ATOM 456 N LYS A 30 1.566 12.136 -18.756 1.00 2.64 N ATOM 457 CA LYS A 30 1.264 10.720 -18.929 1.00 2.96 C ATOM 458 C LYS A 30 2.045 9.840 -17.946 1.00 2.93 C ATOM 459 O LYS A 30 2.703 8.879 -18.342 1.00 3.32 O ATOM 460 CB LYS A 30 1.488 10.325 -20.399 1.00 3.49 C ATOM 461 CG LYS A 30 2.947 10.495 -20.862 1.00 3.62 C ATOM 462 CD LYS A 30 3.000 10.847 -22.355 1.00 4.84 C ATOM 463 CE LYS A 30 4.457 11.042 -22.802 1.00 5.08 C ATOM 464 NZ LYS A 30 4.554 11.457 -24.217 1.00 6.49 N ATOM 0 H LYS A 30 2.223 12.487 -19.453 1.00 2.64 H new ATOM 0 HA LYS A 30 0.214 10.549 -18.691 1.00 2.96 H new ATOM 0 HB2 LYS A 30 1.189 9.286 -20.538 1.00 3.49 H new ATOM 0 HB3 LYS A 30 0.840 10.931 -21.033 1.00 3.49 H new ATOM 0 HG2 LYS A 30 3.430 11.280 -20.280 1.00 3.62 H new ATOM 0 HG3 LYS A 30 3.502 9.575 -20.679 1.00 3.62 H new ATOM 0 HD2 LYS A 30 2.535 10.053 -22.940 1.00 4.84 H new ATOM 0 HD3 LYS A 30 2.429 11.757 -22.542 1.00 4.84 H new ATOM 0 HE2 LYS A 30 4.932 11.793 -22.171 1.00 5.08 H new ATOM 0 HE3 LYS A 30 5.007 10.112 -22.659 1.00 5.08 H new ATOM 0 HZ1 LYS A 30 5.554 11.577 -24.476 1.00 6.49 H new ATOM 0 HZ2 LYS A 30 4.125 10.729 -24.823 1.00 6.49 H new ATOM 0 HZ3 LYS A 30 4.052 12.358 -24.350 1.00 6.49 H new ATOM 478 N ASP A 31 1.973 10.192 -16.664 1.00 2.63 N ATOM 479 CA ASP A 31 2.964 9.836 -15.663 1.00 2.72 C ATOM 480 C ASP A 31 2.418 10.253 -14.294 1.00 2.35 C ATOM 481 O ASP A 31 2.266 9.414 -13.406 1.00 2.58 O ATOM 482 CB ASP A 31 4.315 10.495 -16.010 1.00 3.08 C ATOM 483 CG ASP A 31 4.169 11.934 -16.490 1.00 4.54 C ATOM 484 OD1 ASP A 31 3.855 12.775 -15.626 1.00 5.24 O ATOM 485 OD2 ASP A 31 4.285 12.161 -17.716 1.00 5.60 O ATOM 0 H ASP A 31 1.203 10.746 -16.288 1.00 2.63 H new ATOM 0 HA ASP A 31 3.149 8.762 -15.640 1.00 2.72 H new ATOM 0 HB2 ASP A 31 4.959 10.474 -15.131 1.00 3.08 H new ATOM 0 HB3 ASP A 31 4.811 9.908 -16.783 1.00 3.08 H new ATOM 490 N SER A 32 2.053 11.526 -14.144 1.00 1.94 N ATOM 491 CA SER A 32 1.338 12.036 -12.988 1.00 1.64 C ATOM 492 C SER A 32 -0.171 11.828 -13.144 1.00 1.45 C ATOM 493 O SER A 32 -0.716 11.771 -14.261 1.00 1.44 O ATOM 494 CB SER A 32 1.666 13.520 -12.806 1.00 1.50 C ATOM 495 OG SER A 32 1.153 14.266 -13.888 1.00 2.42 O ATOM 0 H SER A 32 2.254 12.242 -14.842 1.00 1.94 H new ATOM 0 HA SER A 32 1.655 11.487 -12.101 1.00 1.64 H new ATOM 0 HB2 SER A 32 1.241 13.882 -11.870 1.00 1.50 H new ATOM 0 HB3 SER A 32 2.745 13.656 -12.739 1.00 1.50 H new ATOM 0 HG SER A 32 1.587 15.144 -13.915 1.00 2.42 H new ATOM 501 N LEU A 33 -0.855 11.738 -12.000 1.00 1.34 N ATOM 502 CA LEU A 33 -2.306 11.691 -11.932 1.00 1.18 C ATOM 503 C LEU A 33 -2.816 13.111 -11.704 1.00 1.24 C ATOM 504 O LEU A 33 -2.514 13.712 -10.676 1.00 1.25 O ATOM 505 CB LEU A 33 -2.745 10.778 -10.779 1.00 1.07 C ATOM 506 CG LEU A 33 -2.874 9.293 -11.121 1.00 0.99 C ATOM 507 CD1 LEU A 33 -4.077 9.026 -12.024 1.00 2.06 C ATOM 508 CD2 LEU A 33 -1.567 8.771 -11.708 1.00 2.03 C ATOM 0 H LEU A 33 -0.404 11.696 -11.086 1.00 1.34 H new ATOM 0 HA LEU A 33 -2.717 11.291 -12.859 1.00 1.18 H new ATOM 0 HB2 LEU A 33 -2.029 10.883 -9.964 1.00 1.07 H new ATOM 0 HB3 LEU A 33 -3.707 11.131 -10.406 1.00 1.07 H new ATOM 0 HG LEU A 33 -3.062 8.738 -10.202 1.00 0.99 H new ATOM 0 HD11 LEU A 33 -4.136 7.960 -12.246 1.00 2.06 H new ATOM 0 HD12 LEU A 33 -4.989 9.343 -11.518 1.00 2.06 H new ATOM 0 HD13 LEU A 33 -3.965 9.584 -12.954 1.00 2.06 H new ATOM 0 HD21 LEU A 33 -1.672 7.713 -11.947 1.00 2.03 H new ATOM 0 HD22 LEU A 33 -1.328 9.326 -12.615 1.00 2.03 H new ATOM 0 HD23 LEU A 33 -0.765 8.901 -10.982 1.00 2.03 H new ATOM 520 N SER A 34 -3.614 13.642 -12.626 1.00 1.42 N ATOM 521 CA SER A 34 -4.292 14.913 -12.423 1.00 1.47 C ATOM 522 C SER A 34 -5.566 14.656 -11.604 1.00 1.26 C ATOM 523 O SER A 34 -5.977 13.510 -11.432 1.00 1.25 O ATOM 524 CB SER A 34 -4.586 15.535 -13.794 1.00 1.70 C ATOM 525 OG SER A 34 -3.448 15.422 -14.632 1.00 3.07 O ATOM 0 H SER A 34 -3.806 13.205 -13.527 1.00 1.42 H new ATOM 0 HA SER A 34 -3.675 15.619 -11.867 1.00 1.47 H new ATOM 0 HB2 SER A 34 -5.438 15.035 -14.254 1.00 1.70 H new ATOM 0 HB3 SER A 34 -4.858 16.584 -13.676 1.00 1.70 H new ATOM 0 HG SER A 34 -3.644 15.820 -15.506 1.00 3.07 H new ATOM 531 N VAL A 35 -6.195 15.704 -11.064 1.00 1.19 N ATOM 532 CA VAL A 35 -7.303 15.531 -10.125 1.00 1.08 C ATOM 533 C VAL A 35 -8.474 14.782 -10.777 1.00 0.98 C ATOM 534 O VAL A 35 -8.884 13.730 -10.292 1.00 1.04 O ATOM 535 CB VAL A 35 -7.720 16.887 -9.525 1.00 1.11 C ATOM 536 CG1 VAL A 35 -8.882 16.719 -8.536 1.00 1.81 C ATOM 537 CG2 VAL A 35 -6.542 17.530 -8.780 1.00 2.29 C ATOM 0 H VAL A 35 -5.956 16.676 -11.261 1.00 1.19 H new ATOM 0 HA VAL A 35 -6.966 14.907 -9.297 1.00 1.08 H new ATOM 0 HB VAL A 35 -8.034 17.525 -10.351 1.00 1.11 H new ATOM 0 HG11 VAL A 35 -9.156 17.692 -8.128 1.00 1.81 H new ATOM 0 HG12 VAL A 35 -9.740 16.288 -9.052 1.00 1.81 H new ATOM 0 HG13 VAL A 35 -8.577 16.058 -7.725 1.00 1.81 H new ATOM 0 HG21 VAL A 35 -6.854 18.487 -8.363 1.00 2.29 H new ATOM 0 HG22 VAL A 35 -6.218 16.871 -7.974 1.00 2.29 H new ATOM 0 HG23 VAL A 35 -5.716 17.689 -9.473 1.00 2.29 H new ATOM 547 N ASN A 36 -9.015 15.313 -11.878 1.00 1.02 N ATOM 548 CA ASN A 36 -10.139 14.684 -12.573 1.00 1.09 C ATOM 549 C ASN A 36 -9.757 13.290 -13.079 1.00 1.27 C ATOM 550 O ASN A 36 -10.510 12.330 -12.925 1.00 1.43 O ATOM 551 CB ASN A 36 -10.610 15.564 -13.734 1.00 1.36 C ATOM 552 CG ASN A 36 -11.837 14.947 -14.400 1.00 1.65 C ATOM 553 OD1 ASN A 36 -11.727 14.252 -15.400 1.00 1.84 O ATOM 554 ND2 ASN A 36 -13.022 15.192 -13.848 1.00 3.40 N ATOM 0 H ASN A 36 -8.690 16.180 -12.307 1.00 1.02 H new ATOM 0 HA ASN A 36 -10.959 14.575 -11.864 1.00 1.09 H new ATOM 0 HB2 ASN A 36 -10.849 16.563 -13.369 1.00 1.36 H new ATOM 0 HB3 ASN A 36 -9.808 15.675 -14.464 1.00 1.36 H new ATOM 0 HD21 ASN A 36 -13.868 14.796 -14.259 1.00 3.40 H new ATOM 0 HD22 ASN A 36 -13.085 15.775 -13.014 1.00 3.40 H new ATOM 561 N GLU A 37 -8.554 13.195 -13.645 1.00 1.39 N ATOM 562 CA GLU A 37 -7.960 11.958 -14.120 1.00 1.75 C ATOM 563 C GLU A 37 -8.023 10.886 -13.031 1.00 1.73 C ATOM 564 O GLU A 37 -8.494 9.773 -13.253 1.00 1.94 O ATOM 565 CB GLU A 37 -6.516 12.277 -14.521 1.00 2.01 C ATOM 566 CG GLU A 37 -5.878 11.169 -15.347 1.00 1.24 C ATOM 567 CD GLU A 37 -4.441 11.527 -15.693 1.00 1.30 C ATOM 568 OE1 GLU A 37 -3.720 12.162 -14.894 1.00 1.42 O ATOM 569 OE2 GLU A 37 -3.937 11.235 -16.792 1.00 2.52 O ATOM 0 H GLU A 37 -7.952 14.006 -13.787 1.00 1.39 H new ATOM 0 HA GLU A 37 -8.503 11.562 -14.978 1.00 1.75 H new ATOM 0 HB2 GLU A 37 -6.498 13.206 -15.091 1.00 2.01 H new ATOM 0 HB3 GLU A 37 -5.922 12.443 -13.622 1.00 2.01 H new ATOM 0 HG2 GLU A 37 -5.902 10.232 -14.791 1.00 1.24 H new ATOM 0 HG3 GLU A 37 -6.451 11.012 -16.261 1.00 1.24 H new ATOM 576 N PHE A 38 -7.568 11.230 -11.824 1.00 1.56 N ATOM 577 CA PHE A 38 -7.700 10.346 -10.683 1.00 1.70 C ATOM 578 C PHE A 38 -9.167 10.097 -10.354 1.00 1.51 C ATOM 579 O PHE A 38 -9.539 8.960 -10.072 1.00 1.52 O ATOM 580 CB PHE A 38 -6.984 10.911 -9.459 1.00 1.70 C ATOM 581 CG PHE A 38 -7.260 10.079 -8.223 1.00 1.89 C ATOM 582 CD1 PHE A 38 -6.867 8.727 -8.193 1.00 3.33 C ATOM 583 CD2 PHE A 38 -8.065 10.593 -7.188 1.00 2.14 C ATOM 584 CE1 PHE A 38 -7.210 7.917 -7.099 1.00 3.65 C ATOM 585 CE2 PHE A 38 -8.353 9.799 -6.064 1.00 2.63 C ATOM 586 CZ PHE A 38 -7.914 8.466 -6.014 1.00 2.86 C ATOM 0 H PHE A 38 -7.106 12.116 -11.620 1.00 1.56 H new ATOM 0 HA PHE A 38 -7.233 9.398 -10.951 1.00 1.70 H new ATOM 0 HB2 PHE A 38 -5.911 10.942 -9.646 1.00 1.70 H new ATOM 0 HB3 PHE A 38 -7.308 11.938 -9.288 1.00 1.70 H new ATOM 0 HD1 PHE A 38 -6.300 8.312 -9.014 1.00 3.33 H new ATOM 0 HD2 PHE A 38 -8.460 11.596 -7.258 1.00 2.14 H new ATOM 0 HE1 PHE A 38 -6.933 6.873 -7.091 1.00 3.65 H new ATOM 0 HE2 PHE A 38 -8.912 10.214 -5.239 1.00 2.63 H new ATOM 0 HZ PHE A 38 -8.118 7.863 -5.142 1.00 2.86 H new ATOM 596 N LYS A 39 -9.997 11.146 -10.360 1.00 1.35 N ATOM 597 CA LYS A 39 -11.403 11.003 -10.022 1.00 1.24 C ATOM 598 C LYS A 39 -12.044 9.847 -10.794 1.00 1.17 C ATOM 599 O LYS A 39 -12.848 9.119 -10.208 1.00 1.09 O ATOM 600 CB LYS A 39 -12.199 12.311 -10.147 1.00 1.25 C ATOM 601 CG LYS A 39 -13.639 12.033 -9.691 1.00 1.35 C ATOM 602 CD LYS A 39 -14.475 13.291 -9.445 1.00 1.46 C ATOM 603 CE LYS A 39 -15.782 12.916 -8.724 1.00 2.03 C ATOM 604 NZ LYS A 39 -16.569 11.886 -9.445 1.00 3.72 N ATOM 0 H LYS A 39 -9.713 12.097 -10.595 1.00 1.35 H new ATOM 0 HA LYS A 39 -11.443 10.751 -8.962 1.00 1.24 H new ATOM 0 HB2 LYS A 39 -11.749 13.092 -9.534 1.00 1.25 H new ATOM 0 HB3 LYS A 39 -12.187 12.668 -11.177 1.00 1.25 H new ATOM 0 HG2 LYS A 39 -14.135 11.423 -10.446 1.00 1.35 H new ATOM 0 HG3 LYS A 39 -13.610 11.445 -8.774 1.00 1.35 H new ATOM 0 HD2 LYS A 39 -13.909 14.003 -8.844 1.00 1.46 H new ATOM 0 HD3 LYS A 39 -14.699 13.781 -10.393 1.00 1.46 H new ATOM 0 HE2 LYS A 39 -15.547 12.551 -7.724 1.00 2.03 H new ATOM 0 HE3 LYS A 39 -16.392 13.811 -8.601 1.00 2.03 H new ATOM 0 HZ1 LYS A 39 -17.514 11.809 -9.018 1.00 3.72 H new ATOM 0 HZ2 LYS A 39 -16.662 12.157 -10.445 1.00 3.72 H new ATOM 0 HZ3 LYS A 39 -16.084 10.969 -9.378 1.00 3.72 H new ATOM 618 N GLU A 40 -11.692 9.650 -12.069 1.00 1.22 N ATOM 619 CA GLU A 40 -12.148 8.477 -12.805 1.00 1.16 C ATOM 620 C GLU A 40 -11.990 7.189 -11.991 1.00 1.05 C ATOM 621 O GLU A 40 -12.933 6.415 -11.894 1.00 1.02 O ATOM 622 CB GLU A 40 -11.409 8.304 -14.133 1.00 1.24 C ATOM 623 CG GLU A 40 -11.697 9.404 -15.159 1.00 1.44 C ATOM 624 CD GLU A 40 -11.171 8.996 -16.530 1.00 2.19 C ATOM 625 OE1 GLU A 40 -10.308 8.089 -16.563 1.00 2.87 O ATOM 626 OE2 GLU A 40 -11.656 9.570 -17.525 1.00 2.81 O ATOM 0 H GLU A 40 -11.098 10.284 -12.604 1.00 1.22 H new ATOM 0 HA GLU A 40 -13.205 8.653 -13.003 1.00 1.16 H new ATOM 0 HB2 GLU A 40 -10.337 8.276 -13.938 1.00 1.24 H new ATOM 0 HB3 GLU A 40 -11.680 7.340 -14.564 1.00 1.24 H new ATOM 0 HG2 GLU A 40 -12.770 9.589 -15.213 1.00 1.44 H new ATOM 0 HG3 GLU A 40 -11.228 10.337 -14.844 1.00 1.44 H new ATOM 633 N LEU A 41 -10.821 6.952 -11.394 1.00 1.12 N ATOM 634 CA LEU A 41 -10.505 5.702 -10.717 1.00 1.05 C ATOM 635 C LEU A 41 -11.513 5.478 -9.595 1.00 0.92 C ATOM 636 O LEU A 41 -12.141 4.424 -9.501 1.00 0.89 O ATOM 637 CB LEU A 41 -9.063 5.768 -10.177 1.00 1.13 C ATOM 638 CG LEU A 41 -8.469 4.447 -9.648 1.00 1.16 C ATOM 639 CD1 LEU A 41 -9.205 3.869 -8.439 1.00 2.10 C ATOM 640 CD2 LEU A 41 -8.337 3.405 -10.764 1.00 2.47 C ATOM 0 H LEU A 41 -10.062 7.632 -11.369 1.00 1.12 H new ATOM 0 HA LEU A 41 -10.569 4.862 -11.409 1.00 1.05 H new ATOM 0 HB2 LEU A 41 -8.417 6.139 -10.972 1.00 1.13 H new ATOM 0 HB3 LEU A 41 -9.032 6.503 -9.373 1.00 1.13 H new ATOM 0 HG LEU A 41 -7.472 4.704 -9.290 1.00 1.16 H new ATOM 0 HD11 LEU A 41 -8.724 2.941 -8.130 1.00 2.10 H new ATOM 0 HD12 LEU A 41 -9.174 4.585 -7.618 1.00 2.10 H new ATOM 0 HD13 LEU A 41 -10.242 3.668 -8.706 1.00 2.10 H new ATOM 0 HD21 LEU A 41 -7.915 2.486 -10.356 1.00 2.47 H new ATOM 0 HD22 LEU A 41 -9.320 3.197 -11.186 1.00 2.47 H new ATOM 0 HD23 LEU A 41 -7.681 3.790 -11.545 1.00 2.47 H new ATOM 652 N VAL A 42 -11.681 6.496 -8.753 1.00 0.92 N ATOM 653 CA VAL A 42 -12.502 6.401 -7.557 1.00 0.90 C ATOM 654 C VAL A 42 -13.977 6.356 -7.939 1.00 0.93 C ATOM 655 O VAL A 42 -14.769 5.682 -7.292 1.00 1.09 O ATOM 656 CB VAL A 42 -12.158 7.516 -6.550 1.00 1.01 C ATOM 657 CG1 VAL A 42 -10.977 7.087 -5.669 1.00 0.91 C ATOM 658 CG2 VAL A 42 -11.852 8.874 -7.173 1.00 1.34 C ATOM 0 H VAL A 42 -11.249 7.410 -8.885 1.00 0.92 H new ATOM 0 HA VAL A 42 -12.281 5.467 -7.040 1.00 0.90 H new ATOM 0 HB VAL A 42 -13.064 7.652 -5.959 1.00 1.01 H new ATOM 0 HG11 VAL A 42 -10.743 7.883 -4.962 1.00 0.91 H new ATOM 0 HG12 VAL A 42 -11.241 6.181 -5.123 1.00 0.91 H new ATOM 0 HG13 VAL A 42 -10.107 6.892 -6.296 1.00 0.91 H new ATOM 0 HG21 VAL A 42 -11.622 9.592 -6.386 1.00 1.34 H new ATOM 0 HG22 VAL A 42 -10.996 8.783 -7.842 1.00 1.34 H new ATOM 0 HG23 VAL A 42 -12.719 9.219 -7.737 1.00 1.34 H new ATOM 668 N THR A 43 -14.339 7.054 -9.013 1.00 0.94 N ATOM 669 CA THR A 43 -15.674 7.022 -9.589 1.00 1.01 C ATOM 670 C THR A 43 -15.965 5.657 -10.240 1.00 0.99 C ATOM 671 O THR A 43 -17.113 5.223 -10.266 1.00 1.21 O ATOM 672 CB THR A 43 -15.775 8.200 -10.569 1.00 1.09 C ATOM 673 OG1 THR A 43 -15.506 9.409 -9.871 1.00 1.16 O ATOM 674 CG2 THR A 43 -17.150 8.316 -11.231 1.00 1.23 C ATOM 0 H THR A 43 -13.697 7.668 -9.514 1.00 0.94 H new ATOM 0 HA THR A 43 -16.440 7.134 -8.821 1.00 1.01 H new ATOM 0 HB THR A 43 -15.046 8.020 -11.359 1.00 1.09 H new ATOM 0 HG1 THR A 43 -14.540 9.496 -9.728 1.00 1.16 H new ATOM 0 HG21 THR A 43 -17.156 9.168 -11.911 1.00 1.23 H new ATOM 0 HG22 THR A 43 -17.363 7.404 -11.789 1.00 1.23 H new ATOM 0 HG23 THR A 43 -17.912 8.459 -10.465 1.00 1.23 H new ATOM 682 N GLN A 44 -14.942 5.003 -10.799 1.00 0.86 N ATOM 683 CA GLN A 44 -15.056 3.765 -11.555 1.00 0.93 C ATOM 684 C GLN A 44 -15.139 2.578 -10.598 1.00 1.02 C ATOM 685 O GLN A 44 -16.087 1.799 -10.657 1.00 1.17 O ATOM 686 CB GLN A 44 -13.851 3.666 -12.505 1.00 1.03 C ATOM 687 CG GLN A 44 -13.789 2.362 -13.311 1.00 1.38 C ATOM 688 CD GLN A 44 -12.462 2.261 -14.055 1.00 1.67 C ATOM 689 OE1 GLN A 44 -12.422 2.227 -15.279 1.00 1.95 O ATOM 690 NE2 GLN A 44 -11.356 2.228 -13.315 1.00 2.57 N ATOM 0 H GLN A 44 -13.981 5.338 -10.732 1.00 0.86 H new ATOM 0 HA GLN A 44 -15.968 3.755 -12.152 1.00 0.93 H new ATOM 0 HB2 GLN A 44 -13.879 4.507 -13.198 1.00 1.03 H new ATOM 0 HB3 GLN A 44 -12.935 3.764 -11.923 1.00 1.03 H new ATOM 0 HG2 GLN A 44 -13.905 1.508 -12.643 1.00 1.38 H new ATOM 0 HG3 GLN A 44 -14.615 2.326 -14.021 1.00 1.38 H new ATOM 0 HE21 GLN A 44 -11.422 2.258 -12.298 1.00 2.57 H new ATOM 0 HE22 GLN A 44 -10.442 2.173 -13.765 1.00 2.57 H new ATOM 699 N GLN A 45 -14.113 2.413 -9.756 1.00 1.04 N ATOM 700 CA GLN A 45 -14.073 1.382 -8.733 1.00 1.42 C ATOM 701 C GLN A 45 -14.450 2.006 -7.384 1.00 1.75 C ATOM 702 O GLN A 45 -15.442 2.721 -7.298 1.00 3.47 O ATOM 703 CB GLN A 45 -12.718 0.652 -8.738 1.00 1.76 C ATOM 704 CG GLN A 45 -12.445 -0.025 -10.088 1.00 1.87 C ATOM 705 CD GLN A 45 -11.332 -1.073 -10.022 1.00 2.57 C ATOM 706 OE1 GLN A 45 -10.928 -1.521 -8.948 1.00 3.85 O ATOM 707 NE2 GLN A 45 -10.851 -1.484 -11.189 1.00 2.63 N ATOM 0 H GLN A 45 -13.281 3.003 -9.772 1.00 1.04 H new ATOM 0 HA GLN A 45 -14.808 0.604 -8.942 1.00 1.42 H new ATOM 0 HB2 GLN A 45 -11.921 1.362 -8.519 1.00 1.76 H new ATOM 0 HB3 GLN A 45 -12.705 -0.097 -7.946 1.00 1.76 H new ATOM 0 HG2 GLN A 45 -13.361 -0.499 -10.441 1.00 1.87 H new ATOM 0 HG3 GLN A 45 -12.176 0.736 -10.821 1.00 1.87 H new ATOM 0 HE21 GLN A 45 -11.212 -1.088 -12.057 1.00 2.63 H new ATOM 0 HE22 GLN A 45 -10.121 -2.195 -11.218 1.00 2.63 H new ATOM 716 N LEU A 46 -13.693 1.672 -6.334 1.00 1.11 N ATOM 717 CA LEU A 46 -13.948 1.972 -4.928 1.00 1.13 C ATOM 718 C LEU A 46 -15.447 2.071 -4.570 1.00 1.18 C ATOM 719 O LEU A 46 -15.856 3.048 -3.943 1.00 1.50 O ATOM 720 CB LEU A 46 -13.181 3.250 -4.537 1.00 1.10 C ATOM 721 CG LEU A 46 -11.645 3.140 -4.484 1.00 1.16 C ATOM 722 CD1 LEU A 46 -11.178 2.146 -3.419 1.00 1.91 C ATOM 723 CD2 LEU A 46 -10.952 2.838 -5.822 1.00 2.08 C ATOM 0 H LEU A 46 -12.826 1.148 -6.457 1.00 1.11 H new ATOM 0 HA LEU A 46 -13.582 1.128 -4.343 1.00 1.13 H new ATOM 0 HB2 LEU A 46 -13.443 4.035 -5.246 1.00 1.10 H new ATOM 0 HB3 LEU A 46 -13.534 3.574 -3.558 1.00 1.10 H new ATOM 0 HG LEU A 46 -11.332 4.148 -4.212 1.00 1.16 H new ATOM 0 HD11 LEU A 46 -10.089 2.100 -3.417 1.00 1.91 H new ATOM 0 HD12 LEU A 46 -11.530 2.470 -2.440 1.00 1.91 H new ATOM 0 HD13 LEU A 46 -11.582 1.158 -3.641 1.00 1.91 H new ATOM 0 HD21 LEU A 46 -9.874 2.782 -5.669 1.00 2.08 H new ATOM 0 HD22 LEU A 46 -11.313 1.886 -6.212 1.00 2.08 H new ATOM 0 HD23 LEU A 46 -11.177 3.631 -6.535 1.00 2.08 H new ATOM 735 N PRO A 47 -16.287 1.076 -4.912 1.00 1.03 N ATOM 736 CA PRO A 47 -17.693 1.108 -4.569 1.00 1.21 C ATOM 737 C PRO A 47 -17.895 1.004 -3.058 1.00 1.30 C ATOM 738 O PRO A 47 -18.797 1.650 -2.529 1.00 1.73 O ATOM 739 CB PRO A 47 -18.324 -0.088 -5.289 1.00 1.22 C ATOM 740 CG PRO A 47 -17.173 -1.088 -5.377 1.00 1.10 C ATOM 741 CD PRO A 47 -15.972 -0.168 -5.595 1.00 0.96 C ATOM 0 HA PRO A 47 -18.154 2.048 -4.873 1.00 1.21 H new ATOM 0 HB2 PRO A 47 -19.168 -0.494 -4.732 1.00 1.22 H new ATOM 0 HB3 PRO A 47 -18.696 0.186 -6.276 1.00 1.22 H new ATOM 0 HG2 PRO A 47 -17.075 -1.679 -4.466 1.00 1.10 H new ATOM 0 HG3 PRO A 47 -17.304 -1.790 -6.200 1.00 1.10 H new ATOM 0 HD2 PRO A 47 -15.062 -0.613 -5.193 1.00 0.96 H new ATOM 0 HD3 PRO A 47 -15.800 0.004 -6.658 1.00 0.96 H new ATOM 749 N HIS A 48 -17.112 0.156 -2.375 1.00 1.21 N ATOM 750 CA HIS A 48 -17.424 -0.252 -1.013 1.00 1.37 C ATOM 751 C HIS A 48 -16.351 0.205 -0.029 1.00 1.31 C ATOM 752 O HIS A 48 -16.659 0.406 1.144 1.00 1.81 O ATOM 753 CB HIS A 48 -17.659 -1.770 -0.974 1.00 1.66 C ATOM 754 CG HIS A 48 -18.254 -2.304 0.312 1.00 2.38 C ATOM 755 ND1 HIS A 48 -18.267 -3.626 0.697 1.00 3.67 N ATOM 756 CD2 HIS A 48 -18.948 -1.601 1.267 1.00 2.61 C ATOM 757 CE1 HIS A 48 -18.917 -3.709 1.872 1.00 4.13 C ATOM 758 NE2 HIS A 48 -19.349 -2.498 2.259 1.00 3.40 N ATOM 0 H HIS A 48 -16.259 -0.257 -2.751 1.00 1.21 H new ATOM 0 HA HIS A 48 -18.343 0.239 -0.694 1.00 1.37 H new ATOM 0 HB2 HIS A 48 -18.319 -2.039 -1.799 1.00 1.66 H new ATOM 0 HB3 HIS A 48 -16.708 -2.272 -1.150 1.00 1.66 H new ATOM 0 HD2 HIS A 48 -19.148 -0.540 1.253 1.00 2.61 H new ATOM 0 HE1 HIS A 48 -19.070 -4.623 2.427 1.00 4.13 H new ATOM 0 HE2 HIS A 48 -19.867 -2.277 3.109 1.00 3.40 H new ATOM 766 N LEU A 49 -15.094 0.365 -0.454 1.00 1.14 N ATOM 767 CA LEU A 49 -14.033 0.801 0.443 1.00 1.12 C ATOM 768 C LEU A 49 -14.295 2.216 0.945 1.00 1.00 C ATOM 769 O LEU A 49 -14.673 2.396 2.104 1.00 1.18 O ATOM 770 CB LEU A 49 -12.656 0.676 -0.230 1.00 1.28 C ATOM 771 CG LEU A 49 -11.712 -0.192 0.603 1.00 1.12 C ATOM 772 CD1 LEU A 49 -12.176 -1.644 0.679 1.00 0.90 C ATOM 773 CD2 LEU A 49 -10.338 -0.219 -0.051 1.00 1.40 C ATOM 0 H LEU A 49 -14.792 0.198 -1.414 1.00 1.14 H new ATOM 0 HA LEU A 49 -14.027 0.144 1.312 1.00 1.12 H new ATOM 0 HB2 LEU A 49 -12.772 0.243 -1.224 1.00 1.28 H new ATOM 0 HB3 LEU A 49 -12.222 1.667 -0.363 1.00 1.28 H new ATOM 0 HG LEU A 49 -11.692 0.242 1.603 1.00 1.12 H new ATOM 0 HD11 LEU A 49 -11.473 -2.220 1.281 1.00 0.90 H new ATOM 0 HD12 LEU A 49 -13.165 -1.687 1.136 1.00 0.90 H new ATOM 0 HD13 LEU A 49 -12.222 -2.064 -0.326 1.00 0.90 H new ATOM 0 HD21 LEU A 49 -9.665 -0.838 0.542 1.00 1.40 H new ATOM 0 HD22 LEU A 49 -10.421 -0.634 -1.056 1.00 1.40 H new ATOM 0 HD23 LEU A 49 -9.943 0.795 -0.109 1.00 1.40 H new ATOM 785 N LEU A 50 -14.076 3.196 0.068 1.00 0.91 N ATOM 786 CA LEU A 50 -14.148 4.614 0.360 1.00 0.98 C ATOM 787 C LEU A 50 -15.223 5.205 -0.530 1.00 1.24 C ATOM 788 O LEU A 50 -14.940 5.759 -1.590 1.00 2.31 O ATOM 789 CB LEU A 50 -12.792 5.283 0.110 1.00 1.08 C ATOM 790 CG LEU A 50 -11.746 4.876 1.156 1.00 1.31 C ATOM 791 CD1 LEU A 50 -10.390 5.452 0.732 1.00 1.74 C ATOM 792 CD2 LEU A 50 -12.090 5.425 2.546 1.00 1.56 C ATOM 0 H LEU A 50 -13.834 3.007 -0.905 1.00 0.91 H new ATOM 0 HA LEU A 50 -14.396 4.781 1.408 1.00 0.98 H new ATOM 0 HB2 LEU A 50 -12.434 5.015 -0.884 1.00 1.08 H new ATOM 0 HB3 LEU A 50 -12.915 6.366 0.123 1.00 1.08 H new ATOM 0 HG LEU A 50 -11.722 3.788 1.213 1.00 1.31 H new ATOM 0 HD11 LEU A 50 -9.632 5.174 1.464 1.00 1.74 H new ATOM 0 HD12 LEU A 50 -10.115 5.054 -0.245 1.00 1.74 H new ATOM 0 HD13 LEU A 50 -10.458 6.538 0.675 1.00 1.74 H new ATOM 0 HD21 LEU A 50 -11.326 5.115 3.259 1.00 1.56 H new ATOM 0 HD22 LEU A 50 -12.131 6.514 2.507 1.00 1.56 H new ATOM 0 HD23 LEU A 50 -13.059 5.037 2.861 1.00 1.56 H new ATOM 804 N LYS A 51 -16.466 5.087 -0.065 1.00 1.08 N ATOM 805 CA LYS A 51 -17.561 5.828 -0.664 1.00 1.32 C ATOM 806 C LYS A 51 -17.326 7.335 -0.469 1.00 1.38 C ATOM 807 O LYS A 51 -16.329 7.753 0.121 1.00 2.09 O ATOM 808 CB LYS A 51 -18.925 5.290 -0.172 1.00 1.72 C ATOM 809 CG LYS A 51 -19.392 5.639 1.258 1.00 2.19 C ATOM 810 CD LYS A 51 -19.967 7.064 1.344 1.00 3.60 C ATOM 811 CE LYS A 51 -20.768 7.393 2.608 1.00 4.57 C ATOM 812 NZ LYS A 51 -21.239 8.799 2.577 1.00 5.78 N ATOM 0 H LYS A 51 -16.733 4.490 0.718 1.00 1.08 H new ATOM 0 HA LYS A 51 -17.593 5.675 -1.743 1.00 1.32 H new ATOM 0 HB2 LYS A 51 -19.689 5.645 -0.864 1.00 1.72 H new ATOM 0 HB3 LYS A 51 -18.900 4.203 -0.255 1.00 1.72 H new ATOM 0 HG2 LYS A 51 -20.149 4.923 1.577 1.00 2.19 H new ATOM 0 HG3 LYS A 51 -18.553 5.544 1.947 1.00 2.19 H new ATOM 0 HD2 LYS A 51 -19.142 7.772 1.267 1.00 3.60 H new ATOM 0 HD3 LYS A 51 -20.609 7.228 0.479 1.00 3.60 H new ATOM 0 HE2 LYS A 51 -21.621 6.720 2.690 1.00 4.57 H new ATOM 0 HE3 LYS A 51 -20.148 7.231 3.490 1.00 4.57 H new ATOM 0 HZ1 LYS A 51 -21.197 9.200 3.536 1.00 5.78 H new ATOM 0 HZ2 LYS A 51 -20.631 9.355 1.942 1.00 5.78 H new ATOM 0 HZ3 LYS A 51 -22.220 8.829 2.232 1.00 5.78 H new ATOM 826 N ASP A 52 -18.271 8.149 -0.939 1.00 1.68 N ATOM 827 CA ASP A 52 -18.241 9.607 -0.861 1.00 1.77 C ATOM 828 C ASP A 52 -17.365 10.173 -1.976 1.00 1.67 C ATOM 829 O ASP A 52 -16.578 11.100 -1.796 1.00 1.85 O ATOM 830 CB ASP A 52 -17.880 10.143 0.541 1.00 2.01 C ATOM 831 CG ASP A 52 -18.885 11.191 0.960 1.00 3.03 C ATOM 832 OD1 ASP A 52 -18.715 12.339 0.500 1.00 3.86 O ATOM 833 OD2 ASP A 52 -19.824 10.789 1.688 1.00 4.00 O ATOM 0 H ASP A 52 -19.109 7.797 -1.401 1.00 1.68 H new ATOM 0 HA ASP A 52 -19.257 9.969 -1.022 1.00 1.77 H new ATOM 0 HB2 ASP A 52 -17.870 9.326 1.262 1.00 2.01 H new ATOM 0 HB3 ASP A 52 -16.877 10.570 0.530 1.00 2.01 H new ATOM 838 N VAL A 53 -17.555 9.616 -3.172 1.00 1.55 N ATOM 839 CA VAL A 53 -16.906 10.041 -4.395 1.00 1.51 C ATOM 840 C VAL A 53 -17.240 11.502 -4.721 1.00 1.54 C ATOM 841 O VAL A 53 -16.505 12.157 -5.455 1.00 1.63 O ATOM 842 CB VAL A 53 -17.298 9.030 -5.494 1.00 1.54 C ATOM 843 CG1 VAL A 53 -18.079 9.623 -6.666 1.00 3.47 C ATOM 844 CG2 VAL A 53 -16.055 8.285 -5.964 1.00 2.41 C ATOM 0 H VAL A 53 -18.189 8.829 -3.312 1.00 1.55 H new ATOM 0 HA VAL A 53 -15.820 10.036 -4.301 1.00 1.51 H new ATOM 0 HB VAL A 53 -18.001 8.333 -5.037 1.00 1.54 H new ATOM 0 HG11 VAL A 53 -18.308 8.837 -7.385 1.00 3.47 H new ATOM 0 HG12 VAL A 53 -19.007 10.062 -6.300 1.00 3.47 H new ATOM 0 HG13 VAL A 53 -17.479 10.394 -7.150 1.00 3.47 H new ATOM 0 HG21 VAL A 53 -16.331 7.571 -6.740 1.00 2.41 H new ATOM 0 HG22 VAL A 53 -15.334 8.997 -6.366 1.00 2.41 H new ATOM 0 HG23 VAL A 53 -15.610 7.753 -5.123 1.00 2.41 H new ATOM 854 N GLY A 54 -18.345 12.021 -4.172 1.00 1.62 N ATOM 855 CA GLY A 54 -18.657 13.437 -4.214 1.00 1.66 C ATOM 856 C GLY A 54 -17.519 14.260 -3.611 1.00 1.52 C ATOM 857 O GLY A 54 -16.996 15.161 -4.263 1.00 1.62 O ATOM 0 H GLY A 54 -19.045 11.460 -3.686 1.00 1.62 H new ATOM 0 HA2 GLY A 54 -18.829 13.746 -5.245 1.00 1.66 H new ATOM 0 HA3 GLY A 54 -19.580 13.627 -3.666 1.00 1.66 H new ATOM 861 N SER A 55 -17.104 13.951 -2.377 1.00 1.42 N ATOM 862 CA SER A 55 -16.147 14.772 -1.646 1.00 1.37 C ATOM 863 C SER A 55 -14.708 14.498 -2.092 1.00 1.43 C ATOM 864 O SER A 55 -13.804 14.444 -1.265 1.00 1.54 O ATOM 865 CB SER A 55 -16.326 14.530 -0.140 1.00 1.42 C ATOM 866 OG SER A 55 -16.210 13.151 0.160 1.00 2.88 O ATOM 0 H SER A 55 -17.423 13.129 -1.864 1.00 1.42 H new ATOM 0 HA SER A 55 -16.341 15.822 -1.865 1.00 1.37 H new ATOM 0 HB2 SER A 55 -15.576 15.093 0.416 1.00 1.42 H new ATOM 0 HB3 SER A 55 -17.302 14.896 0.179 1.00 1.42 H new ATOM 0 HG SER A 55 -17.089 12.724 0.082 1.00 2.88 H new ATOM 872 N LEU A 56 -14.457 14.326 -3.391 1.00 1.51 N ATOM 873 CA LEU A 56 -13.166 13.906 -3.888 1.00 1.51 C ATOM 874 C LEU A 56 -12.072 14.879 -3.431 1.00 1.33 C ATOM 875 O LEU A 56 -10.990 14.443 -3.048 1.00 1.26 O ATOM 876 CB LEU A 56 -13.310 13.712 -5.405 1.00 1.62 C ATOM 877 CG LEU A 56 -12.101 13.135 -6.148 1.00 1.60 C ATOM 878 CD1 LEU A 56 -11.192 14.273 -6.609 1.00 1.58 C ATOM 879 CD2 LEU A 56 -11.335 12.091 -5.338 1.00 1.62 C ATOM 0 H LEU A 56 -15.152 14.477 -4.122 1.00 1.51 H new ATOM 0 HA LEU A 56 -12.839 12.952 -3.475 1.00 1.51 H new ATOM 0 HB2 LEU A 56 -14.162 13.057 -5.584 1.00 1.62 H new ATOM 0 HB3 LEU A 56 -13.552 14.678 -5.849 1.00 1.62 H new ATOM 0 HG LEU A 56 -12.477 12.600 -7.020 1.00 1.60 H new ATOM 0 HD11 LEU A 56 -10.332 13.861 -7.137 1.00 1.58 H new ATOM 0 HD12 LEU A 56 -11.746 14.933 -7.276 1.00 1.58 H new ATOM 0 HD13 LEU A 56 -10.848 14.838 -5.743 1.00 1.58 H new ATOM 0 HD21 LEU A 56 -10.492 11.724 -5.923 1.00 1.62 H new ATOM 0 HD22 LEU A 56 -10.968 12.543 -4.416 1.00 1.62 H new ATOM 0 HD23 LEU A 56 -11.998 11.260 -5.096 1.00 1.62 H new ATOM 891 N ASP A 57 -12.359 16.182 -3.374 1.00 1.31 N ATOM 892 CA ASP A 57 -11.401 17.177 -2.900 1.00 1.25 C ATOM 893 C ASP A 57 -10.810 16.856 -1.516 1.00 1.16 C ATOM 894 O ASP A 57 -9.634 17.134 -1.276 1.00 1.18 O ATOM 895 CB ASP A 57 -12.003 18.589 -2.951 1.00 1.54 C ATOM 896 CG ASP A 57 -11.405 19.377 -4.108 1.00 3.28 C ATOM 897 OD1 ASP A 57 -10.284 19.899 -3.914 1.00 4.57 O ATOM 898 OD2 ASP A 57 -12.053 19.407 -5.172 1.00 4.22 O ATOM 0 H ASP A 57 -13.258 16.573 -3.654 1.00 1.31 H new ATOM 0 HA ASP A 57 -10.557 17.140 -3.589 1.00 1.25 H new ATOM 0 HB2 ASP A 57 -13.085 18.526 -3.066 1.00 1.54 H new ATOM 0 HB3 ASP A 57 -11.811 19.107 -2.012 1.00 1.54 H new ATOM 903 N GLU A 58 -11.595 16.259 -0.609 1.00 1.22 N ATOM 904 CA GLU A 58 -11.091 15.805 0.688 1.00 1.34 C ATOM 905 C GLU A 58 -9.951 14.811 0.465 1.00 1.25 C ATOM 906 O GLU A 58 -8.859 14.947 1.019 1.00 1.27 O ATOM 907 CB GLU A 58 -12.243 15.186 1.507 1.00 1.60 C ATOM 908 CG GLU A 58 -11.805 14.220 2.614 1.00 1.85 C ATOM 909 CD GLU A 58 -13.010 13.606 3.310 1.00 2.30 C ATOM 910 OE1 GLU A 58 -13.568 14.276 4.200 1.00 2.66 O ATOM 911 OE2 GLU A 58 -13.372 12.482 2.894 1.00 3.15 O ATOM 0 H GLU A 58 -12.589 16.080 -0.754 1.00 1.22 H new ATOM 0 HA GLU A 58 -10.699 16.647 1.258 1.00 1.34 H new ATOM 0 HB2 GLU A 58 -12.823 15.992 1.957 1.00 1.60 H new ATOM 0 HB3 GLU A 58 -12.909 14.656 0.826 1.00 1.60 H new ATOM 0 HG2 GLU A 58 -11.185 13.431 2.189 1.00 1.85 H new ATOM 0 HG3 GLU A 58 -11.191 14.750 3.342 1.00 1.85 H new ATOM 918 N LYS A 59 -10.222 13.799 -0.359 1.00 1.26 N ATOM 919 CA LYS A 59 -9.275 12.745 -0.669 1.00 1.33 C ATOM 920 C LYS A 59 -8.054 13.398 -1.322 1.00 1.18 C ATOM 921 O LYS A 59 -6.931 13.191 -0.868 1.00 1.16 O ATOM 922 CB LYS A 59 -9.937 11.683 -1.566 1.00 1.55 C ATOM 923 CG LYS A 59 -10.544 10.480 -0.820 1.00 1.81 C ATOM 924 CD LYS A 59 -11.652 10.754 0.214 1.00 1.79 C ATOM 925 CE LYS A 59 -12.814 11.618 -0.318 1.00 3.38 C ATOM 926 NZ LYS A 59 -14.038 11.574 0.516 1.00 3.68 N ATOM 0 H LYS A 59 -11.119 13.693 -0.833 1.00 1.26 H new ATOM 0 HA LYS A 59 -8.952 12.221 0.231 1.00 1.33 H new ATOM 0 HB2 LYS A 59 -10.723 12.162 -2.150 1.00 1.55 H new ATOM 0 HB3 LYS A 59 -9.194 11.314 -2.274 1.00 1.55 H new ATOM 0 HG2 LYS A 59 -10.945 9.793 -1.565 1.00 1.81 H new ATOM 0 HG3 LYS A 59 -9.733 9.959 -0.310 1.00 1.81 H new ATOM 0 HD2 LYS A 59 -12.052 9.802 0.562 1.00 1.79 H new ATOM 0 HD3 LYS A 59 -11.212 11.250 1.079 1.00 1.79 H new ATOM 0 HE2 LYS A 59 -12.477 12.652 -0.394 1.00 3.38 H new ATOM 0 HE3 LYS A 59 -13.064 11.289 -1.327 1.00 3.38 H new ATOM 0 HZ1 LYS A 59 -14.781 12.152 0.073 1.00 3.68 H new ATOM 0 HZ2 LYS A 59 -14.367 10.591 0.598 1.00 3.68 H new ATOM 0 HZ3 LYS A 59 -13.826 11.948 1.463 1.00 3.68 H new ATOM 940 N MET A 60 -8.284 14.224 -2.349 1.00 1.13 N ATOM 941 CA MET A 60 -7.244 14.973 -3.037 1.00 1.08 C ATOM 942 C MET A 60 -6.319 15.636 -2.020 1.00 0.96 C ATOM 943 O MET A 60 -5.138 15.322 -1.992 1.00 0.91 O ATOM 944 CB MET A 60 -7.876 15.990 -4.000 1.00 1.18 C ATOM 945 CG MET A 60 -6.858 16.774 -4.838 1.00 1.21 C ATOM 946 SD MET A 60 -5.928 18.059 -3.957 1.00 1.38 S ATOM 947 CE MET A 60 -4.922 18.695 -5.310 1.00 1.44 C ATOM 0 H MET A 60 -9.217 14.389 -2.727 1.00 1.13 H new ATOM 0 HA MET A 60 -6.637 14.294 -3.636 1.00 1.08 H new ATOM 0 HB2 MET A 60 -8.556 15.465 -4.671 1.00 1.18 H new ATOM 0 HB3 MET A 60 -8.477 16.695 -3.425 1.00 1.18 H new ATOM 0 HG2 MET A 60 -6.147 16.067 -5.266 1.00 1.21 H new ATOM 0 HG3 MET A 60 -7.384 17.240 -5.671 1.00 1.21 H new ATOM 0 HE1 MET A 60 -4.783 19.769 -5.187 1.00 1.44 H new ATOM 0 HE2 MET A 60 -3.951 18.201 -5.305 1.00 1.44 H new ATOM 0 HE3 MET A 60 -5.423 18.500 -6.258 1.00 1.44 H new ATOM 957 N LYS A 61 -6.828 16.524 -1.163 1.00 0.98 N ATOM 958 CA LYS A 61 -5.961 17.232 -0.225 1.00 0.99 C ATOM 959 C LYS A 61 -5.357 16.299 0.830 1.00 1.02 C ATOM 960 O LYS A 61 -4.246 16.548 1.295 1.00 1.08 O ATOM 961 CB LYS A 61 -6.687 18.452 0.363 1.00 1.09 C ATOM 962 CG LYS A 61 -6.244 19.726 -0.376 1.00 1.59 C ATOM 963 CD LYS A 61 -7.332 20.804 -0.451 1.00 1.86 C ATOM 964 CE LYS A 61 -8.448 20.480 -1.459 1.00 2.39 C ATOM 965 NZ LYS A 61 -7.948 20.245 -2.832 1.00 4.17 N ATOM 0 H LYS A 61 -7.817 16.765 -1.100 1.00 0.98 H new ATOM 0 HA LYS A 61 -5.101 17.616 -0.774 1.00 0.99 H new ATOM 0 HB2 LYS A 61 -7.766 18.324 0.272 1.00 1.09 H new ATOM 0 HB3 LYS A 61 -6.465 18.541 1.426 1.00 1.09 H new ATOM 0 HG2 LYS A 61 -5.369 20.140 0.124 1.00 1.59 H new ATOM 0 HG3 LYS A 61 -5.937 19.461 -1.388 1.00 1.59 H new ATOM 0 HD2 LYS A 61 -7.773 20.934 0.538 1.00 1.86 H new ATOM 0 HD3 LYS A 61 -6.873 21.754 -0.723 1.00 1.86 H new ATOM 0 HE2 LYS A 61 -8.988 19.596 -1.120 1.00 2.39 H new ATOM 0 HE3 LYS A 61 -9.163 21.303 -1.476 1.00 2.39 H new ATOM 0 HZ1 LYS A 61 -8.747 20.251 -3.498 1.00 4.17 H new ATOM 0 HZ2 LYS A 61 -7.276 20.996 -3.090 1.00 4.17 H new ATOM 0 HZ3 LYS A 61 -7.469 19.323 -2.874 1.00 4.17 H new ATOM 979 N SER A 62 -6.035 15.204 1.179 1.00 1.09 N ATOM 980 CA SER A 62 -5.421 14.168 2.000 1.00 1.22 C ATOM 981 C SER A 62 -4.202 13.538 1.307 1.00 1.16 C ATOM 982 O SER A 62 -3.278 13.093 1.991 1.00 1.34 O ATOM 983 CB SER A 62 -6.456 13.102 2.375 1.00 1.41 C ATOM 984 OG SER A 62 -7.523 13.692 3.085 1.00 2.24 O ATOM 0 H SER A 62 -7.000 15.016 0.907 1.00 1.09 H new ATOM 0 HA SER A 62 -5.060 14.637 2.915 1.00 1.22 H new ATOM 0 HB2 SER A 62 -6.832 12.616 1.475 1.00 1.41 H new ATOM 0 HB3 SER A 62 -5.988 12.328 2.983 1.00 1.41 H new ATOM 0 HG SER A 62 -8.096 14.186 2.463 1.00 2.24 H new ATOM 990 N LEU A 63 -4.216 13.455 -0.027 1.00 1.10 N ATOM 991 CA LEU A 63 -3.186 12.804 -0.830 1.00 1.16 C ATOM 992 C LEU A 63 -2.098 13.793 -1.245 1.00 1.17 C ATOM 993 O LEU A 63 -0.933 13.647 -0.875 1.00 1.17 O ATOM 994 CB LEU A 63 -3.848 12.186 -2.071 1.00 1.21 C ATOM 995 CG LEU A 63 -4.744 11.001 -1.693 1.00 1.24 C ATOM 996 CD1 LEU A 63 -5.892 10.829 -2.690 1.00 1.72 C ATOM 997 CD2 LEU A 63 -3.896 9.731 -1.675 1.00 1.20 C ATOM 0 H LEU A 63 -4.968 13.852 -0.591 1.00 1.10 H new ATOM 0 HA LEU A 63 -2.708 12.026 -0.234 1.00 1.16 H new ATOM 0 HB2 LEU A 63 -4.440 12.943 -2.585 1.00 1.21 H new ATOM 0 HB3 LEU A 63 -3.079 11.855 -2.769 1.00 1.21 H new ATOM 0 HG LEU A 63 -5.176 11.191 -0.710 1.00 1.24 H new ATOM 0 HD11 LEU A 63 -6.508 9.980 -2.393 1.00 1.72 H new ATOM 0 HD12 LEU A 63 -6.501 11.733 -2.703 1.00 1.72 H new ATOM 0 HD13 LEU A 63 -5.486 10.651 -3.686 1.00 1.72 H new ATOM 0 HD21 LEU A 63 -4.522 8.880 -1.407 1.00 1.20 H new ATOM 0 HD22 LEU A 63 -3.464 9.568 -2.662 1.00 1.20 H new ATOM 0 HD23 LEU A 63 -3.096 9.838 -0.942 1.00 1.20 H new ATOM 1009 N ASP A 64 -2.472 14.787 -2.051 1.00 1.22 N ATOM 1010 CA ASP A 64 -1.578 15.751 -2.660 1.00 1.29 C ATOM 1011 C ASP A 64 -1.108 16.758 -1.615 1.00 1.48 C ATOM 1012 O ASP A 64 -1.507 17.920 -1.631 1.00 1.70 O ATOM 1013 CB ASP A 64 -2.277 16.439 -3.846 1.00 1.37 C ATOM 1014 CG ASP A 64 -1.257 17.090 -4.761 1.00 1.51 C ATOM 1015 OD1 ASP A 64 -0.355 16.346 -5.201 1.00 2.15 O ATOM 1016 OD2 ASP A 64 -1.347 18.306 -5.030 1.00 1.69 O ATOM 0 H ASP A 64 -3.448 14.942 -2.303 1.00 1.22 H new ATOM 0 HA ASP A 64 -0.696 15.240 -3.047 1.00 1.29 H new ATOM 0 HB2 ASP A 64 -2.861 15.708 -4.405 1.00 1.37 H new ATOM 0 HB3 ASP A 64 -2.975 17.190 -3.478 1.00 1.37 H new ATOM 1021 N VAL A 65 -0.246 16.310 -0.701 1.00 1.47 N ATOM 1022 CA VAL A 65 0.278 17.095 0.404 1.00 1.68 C ATOM 1023 C VAL A 65 0.827 18.458 -0.043 1.00 1.75 C ATOM 1024 O VAL A 65 0.758 19.431 0.702 1.00 1.95 O ATOM 1025 CB VAL A 65 1.308 16.232 1.168 1.00 1.73 C ATOM 1026 CG1 VAL A 65 2.774 16.624 0.944 1.00 3.39 C ATOM 1027 CG2 VAL A 65 0.968 16.240 2.656 1.00 3.07 C ATOM 0 H VAL A 65 0.116 15.356 -0.715 1.00 1.47 H new ATOM 0 HA VAL A 65 -0.533 17.353 1.085 1.00 1.68 H new ATOM 0 HB VAL A 65 1.226 15.226 0.757 1.00 1.73 H new ATOM 0 HG11 VAL A 65 3.420 15.962 1.521 1.00 3.39 H new ATOM 0 HG12 VAL A 65 3.017 16.535 -0.115 1.00 3.39 H new ATOM 0 HG13 VAL A 65 2.929 17.654 1.267 1.00 3.39 H new ATOM 0 HG21 VAL A 65 1.692 15.632 3.198 1.00 3.07 H new ATOM 0 HG22 VAL A 65 1.000 17.263 3.031 1.00 3.07 H new ATOM 0 HG23 VAL A 65 -0.031 15.831 2.803 1.00 3.07 H new ATOM 1037 N ASN A 66 1.391 18.518 -1.255 1.00 1.65 N ATOM 1038 CA ASN A 66 1.977 19.726 -1.829 1.00 1.76 C ATOM 1039 C ASN A 66 0.946 20.621 -2.529 1.00 1.83 C ATOM 1040 O ASN A 66 1.274 21.758 -2.858 1.00 2.05 O ATOM 1041 CB ASN A 66 3.186 19.391 -2.726 1.00 1.73 C ATOM 1042 CG ASN A 66 3.097 18.078 -3.507 1.00 1.57 C ATOM 1043 OD1 ASN A 66 2.025 17.615 -3.906 1.00 1.62 O ATOM 1044 ND2 ASN A 66 4.230 17.412 -3.701 1.00 2.13 N ATOM 0 H ASN A 66 1.452 17.709 -1.874 1.00 1.65 H new ATOM 0 HA ASN A 66 2.351 20.322 -0.996 1.00 1.76 H new ATOM 0 HB2 ASN A 66 3.322 20.206 -3.437 1.00 1.73 H new ATOM 0 HB3 ASN A 66 4.079 19.360 -2.102 1.00 1.73 H new ATOM 0 HD21 ASN A 66 4.217 16.513 -4.182 1.00 2.13 H new ATOM 0 HD22 ASN A 66 5.113 17.800 -3.369 1.00 2.13 H new ATOM 1051 N GLN A 67 -0.288 20.148 -2.734 1.00 1.71 N ATOM 1052 CA GLN A 67 -1.372 20.891 -3.374 1.00 1.75 C ATOM 1053 C GLN A 67 -0.915 21.463 -4.722 1.00 1.78 C ATOM 1054 O GLN A 67 -1.291 22.575 -5.094 1.00 2.04 O ATOM 1055 CB GLN A 67 -1.962 21.942 -2.408 1.00 1.89 C ATOM 1056 CG GLN A 67 -3.455 21.710 -2.106 1.00 2.19 C ATOM 1057 CD GLN A 67 -4.419 21.842 -3.291 1.00 3.63 C ATOM 1058 OE1 GLN A 67 -5.580 21.446 -3.185 1.00 4.20 O ATOM 1059 NE2 GLN A 67 -3.989 22.386 -4.426 1.00 5.10 N ATOM 0 H GLN A 67 -0.565 19.209 -2.449 1.00 1.71 H new ATOM 0 HA GLN A 67 -2.192 20.211 -3.604 1.00 1.75 H new ATOM 0 HB2 GLN A 67 -1.401 21.924 -1.474 1.00 1.89 H new ATOM 0 HB3 GLN A 67 -1.834 22.935 -2.838 1.00 1.89 H new ATOM 0 HG2 GLN A 67 -3.567 20.711 -1.684 1.00 2.19 H new ATOM 0 HG3 GLN A 67 -3.762 22.418 -1.336 1.00 2.19 H new ATOM 0 HE21 GLN A 67 -3.025 22.711 -4.503 1.00 5.10 H new ATOM 0 HE22 GLN A 67 -4.623 22.478 -5.220 1.00 5.10 H new ATOM 1068 N ASP A 68 -0.141 20.672 -5.464 1.00 1.60 N ATOM 1069 CA ASP A 68 0.303 20.999 -6.814 1.00 1.60 C ATOM 1070 C ASP A 68 -0.728 20.506 -7.837 1.00 1.65 C ATOM 1071 O ASP A 68 -0.698 20.933 -8.988 1.00 2.16 O ATOM 1072 CB ASP A 68 1.725 20.465 -7.072 1.00 1.51 C ATOM 1073 CG ASP A 68 1.828 18.960 -6.970 1.00 1.41 C ATOM 1074 OD1 ASP A 68 0.833 18.248 -7.190 1.00 1.53 O ATOM 1075 OD2 ASP A 68 2.849 18.391 -6.528 1.00 1.35 O ATOM 0 H ASP A 68 0.200 19.769 -5.135 1.00 1.60 H new ATOM 0 HA ASP A 68 0.368 22.081 -6.925 1.00 1.60 H new ATOM 0 HB2 ASP A 68 2.048 20.778 -8.065 1.00 1.51 H new ATOM 0 HB3 ASP A 68 2.411 20.918 -6.356 1.00 1.51 H new ATOM 1080 N SER A 69 -1.659 19.636 -7.419 1.00 1.36 N ATOM 1081 CA SER A 69 -2.709 19.070 -8.257 1.00 1.38 C ATOM 1082 C SER A 69 -2.173 18.092 -9.309 1.00 1.39 C ATOM 1083 O SER A 69 -2.913 17.712 -10.218 1.00 1.44 O ATOM 1084 CB SER A 69 -3.600 20.172 -8.844 1.00 1.47 C ATOM 1085 OG SER A 69 -4.043 21.019 -7.798 1.00 1.59 O ATOM 0 H SER A 69 -1.697 19.301 -6.456 1.00 1.36 H new ATOM 0 HA SER A 69 -3.345 18.461 -7.615 1.00 1.38 H new ATOM 0 HB2 SER A 69 -3.046 20.748 -9.585 1.00 1.47 H new ATOM 0 HB3 SER A 69 -4.454 19.731 -9.357 1.00 1.47 H new ATOM 0 HG SER A 69 -4.612 21.726 -8.168 1.00 1.59 H new ATOM 1091 N GLU A 70 -0.930 17.634 -9.135 1.00 1.41 N ATOM 1092 CA GLU A 70 -0.332 16.522 -9.849 1.00 1.45 C ATOM 1093 C GLU A 70 0.096 15.489 -8.812 1.00 1.41 C ATOM 1094 O GLU A 70 1.085 15.663 -8.094 1.00 1.57 O ATOM 1095 CB GLU A 70 0.858 16.991 -10.689 1.00 1.76 C ATOM 1096 CG GLU A 70 0.382 17.765 -11.924 1.00 2.10 C ATOM 1097 CD GLU A 70 1.468 17.824 -12.984 1.00 2.94 C ATOM 1098 OE1 GLU A 70 1.933 16.737 -13.387 1.00 3.42 O ATOM 1099 OE2 GLU A 70 1.824 18.946 -13.400 1.00 3.96 O ATOM 0 H GLU A 70 -0.291 18.053 -8.460 1.00 1.41 H new ATOM 0 HA GLU A 70 -1.050 16.082 -10.542 1.00 1.45 H new ATOM 0 HB2 GLU A 70 1.508 17.625 -10.085 1.00 1.76 H new ATOM 0 HB3 GLU A 70 1.451 16.131 -11.000 1.00 1.76 H new ATOM 0 HG2 GLU A 70 -0.507 17.288 -12.336 1.00 2.10 H new ATOM 0 HG3 GLU A 70 0.096 18.776 -11.635 1.00 2.10 H new ATOM 1106 N LEU A 71 -0.658 14.402 -8.727 1.00 1.25 N ATOM 1107 CA LEU A 71 -0.467 13.366 -7.738 1.00 1.15 C ATOM 1108 C LEU A 71 0.647 12.469 -8.278 1.00 1.03 C ATOM 1109 O LEU A 71 0.467 11.770 -9.279 1.00 1.16 O ATOM 1110 CB LEU A 71 -1.766 12.571 -7.581 1.00 1.12 C ATOM 1111 CG LEU A 71 -2.951 13.229 -6.858 1.00 1.22 C ATOM 1112 CD1 LEU A 71 -2.818 13.042 -5.344 1.00 1.23 C ATOM 1113 CD2 LEU A 71 -3.185 14.704 -7.208 1.00 1.26 C ATOM 0 H LEU A 71 -1.435 14.218 -9.361 1.00 1.25 H new ATOM 0 HA LEU A 71 -0.204 13.772 -6.761 1.00 1.15 H new ATOM 0 HB2 LEU A 71 -2.103 12.288 -8.578 1.00 1.12 H new ATOM 0 HB3 LEU A 71 -1.527 11.648 -7.052 1.00 1.12 H new ATOM 0 HG LEU A 71 -3.839 12.712 -7.223 1.00 1.22 H new ATOM 0 HD11 LEU A 71 -3.664 13.513 -4.844 1.00 1.23 H new ATOM 0 HD12 LEU A 71 -2.804 11.978 -5.109 1.00 1.23 H new ATOM 0 HD13 LEU A 71 -1.891 13.502 -5.001 1.00 1.23 H new ATOM 0 HD21 LEU A 71 -4.042 15.079 -6.648 1.00 1.26 H new ATOM 0 HD22 LEU A 71 -2.300 15.284 -6.948 1.00 1.26 H new ATOM 0 HD23 LEU A 71 -3.380 14.798 -8.276 1.00 1.26 H new ATOM 1125 N LYS A 72 1.815 12.540 -7.637 1.00 0.86 N ATOM 1126 CA LYS A 72 2.978 11.726 -7.954 1.00 0.81 C ATOM 1127 C LYS A 72 2.843 10.393 -7.214 1.00 0.63 C ATOM 1128 O LYS A 72 2.277 10.350 -6.127 1.00 0.61 O ATOM 1129 CB LYS A 72 4.234 12.509 -7.543 1.00 1.05 C ATOM 1130 CG LYS A 72 5.551 11.857 -7.969 1.00 1.22 C ATOM 1131 CD LYS A 72 6.747 12.807 -7.789 1.00 1.73 C ATOM 1132 CE LYS A 72 6.955 13.341 -6.357 1.00 2.96 C ATOM 1133 NZ LYS A 72 6.238 14.609 -6.075 1.00 3.46 N ATOM 0 H LYS A 72 1.977 13.184 -6.863 1.00 0.86 H new ATOM 0 HA LYS A 72 3.055 11.508 -9.019 1.00 0.81 H new ATOM 0 HB2 LYS A 72 4.181 13.509 -7.974 1.00 1.05 H new ATOM 0 HB3 LYS A 72 4.235 12.628 -6.460 1.00 1.05 H new ATOM 0 HG2 LYS A 72 5.714 10.953 -7.383 1.00 1.22 H new ATOM 0 HG3 LYS A 72 5.484 11.552 -9.013 1.00 1.22 H new ATOM 0 HD2 LYS A 72 7.653 12.287 -8.100 1.00 1.73 H new ATOM 0 HD3 LYS A 72 6.620 13.656 -8.461 1.00 1.73 H new ATOM 0 HE2 LYS A 72 6.625 12.583 -5.646 1.00 2.96 H new ATOM 0 HE3 LYS A 72 8.021 13.493 -6.188 1.00 2.96 H new ATOM 0 HZ1 LYS A 72 6.825 15.211 -5.462 1.00 3.46 H new ATOM 0 HZ2 LYS A 72 6.048 15.106 -6.968 1.00 3.46 H new ATOM 0 HZ3 LYS A 72 5.338 14.400 -5.597 1.00 3.46 H new ATOM 1147 N PHE A 73 3.365 9.304 -7.784 1.00 0.73 N ATOM 1148 CA PHE A 73 3.208 7.937 -7.284 1.00 0.75 C ATOM 1149 C PHE A 73 3.285 7.814 -5.752 1.00 0.62 C ATOM 1150 O PHE A 73 2.352 7.314 -5.128 1.00 0.77 O ATOM 1151 CB PHE A 73 4.188 6.999 -8.011 1.00 0.96 C ATOM 1152 CG PHE A 73 5.586 7.559 -8.218 1.00 1.62 C ATOM 1153 CD1 PHE A 73 6.559 7.414 -7.213 1.00 3.07 C ATOM 1154 CD2 PHE A 73 5.906 8.251 -9.402 1.00 3.04 C ATOM 1155 CE1 PHE A 73 7.813 8.036 -7.348 1.00 4.65 C ATOM 1156 CE2 PHE A 73 7.168 8.857 -9.546 1.00 4.57 C ATOM 1157 CZ PHE A 73 8.115 8.764 -8.512 1.00 5.15 C ATOM 0 H PHE A 73 3.927 9.352 -8.634 1.00 0.73 H new ATOM 0 HA PHE A 73 2.190 7.624 -7.517 1.00 0.75 H new ATOM 0 HB2 PHE A 73 4.266 6.071 -7.445 1.00 0.96 H new ATOM 0 HB3 PHE A 73 3.768 6.744 -8.984 1.00 0.96 H new ATOM 0 HD1 PHE A 73 6.343 6.823 -6.335 1.00 3.07 H new ATOM 0 HD2 PHE A 73 5.182 8.317 -10.201 1.00 3.04 H new ATOM 0 HE1 PHE A 73 8.544 7.954 -6.557 1.00 4.65 H new ATOM 0 HE2 PHE A 73 7.409 9.394 -10.452 1.00 4.57 H new ATOM 0 HZ PHE A 73 9.074 9.251 -8.611 1.00 5.15 H new ATOM 1167 N ASN A 74 4.374 8.272 -5.129 1.00 0.56 N ATOM 1168 CA ASN A 74 4.537 8.165 -3.677 1.00 0.66 C ATOM 1169 C ASN A 74 3.547 9.059 -2.915 1.00 0.85 C ATOM 1170 O ASN A 74 3.171 8.718 -1.797 1.00 1.11 O ATOM 1171 CB ASN A 74 6.007 8.391 -3.278 1.00 0.71 C ATOM 1172 CG ASN A 74 6.214 8.674 -1.788 1.00 1.15 C ATOM 1173 OD1 ASN A 74 6.714 7.809 -1.069 1.00 1.53 O ATOM 1174 ND2 ASN A 74 5.934 9.888 -1.327 1.00 2.05 N ATOM 0 H ASN A 74 5.156 8.720 -5.607 1.00 0.56 H new ATOM 0 HA ASN A 74 4.285 7.148 -3.378 1.00 0.66 H new ATOM 0 HB2 ASN A 74 6.587 7.510 -3.553 1.00 0.71 H new ATOM 0 HB3 ASN A 74 6.404 9.227 -3.854 1.00 0.71 H new ATOM 0 HD21 ASN A 74 6.133 10.123 -0.355 1.00 2.05 H new ATOM 0 HD22 ASN A 74 5.520 10.585 -1.945 1.00 2.05 H new ATOM 1181 N GLU A 75 3.114 10.186 -3.492 1.00 0.77 N ATOM 1182 CA GLU A 75 2.065 11.004 -2.892 1.00 0.89 C ATOM 1183 C GLU A 75 0.763 10.194 -2.913 1.00 0.89 C ATOM 1184 O GLU A 75 0.100 10.020 -1.891 1.00 1.12 O ATOM 1185 CB GLU A 75 1.888 12.322 -3.668 1.00 0.86 C ATOM 1186 CG GLU A 75 3.182 13.138 -3.853 1.00 1.13 C ATOM 1187 CD GLU A 75 3.000 14.260 -4.865 1.00 1.36 C ATOM 1188 OE1 GLU A 75 1.954 14.332 -5.540 1.00 2.08 O ATOM 1189 OE2 GLU A 75 3.908 15.097 -5.045 1.00 2.19 O ATOM 0 H GLU A 75 3.477 10.549 -4.374 1.00 0.77 H new ATOM 0 HA GLU A 75 2.335 11.261 -1.868 1.00 0.89 H new ATOM 0 HB2 GLU A 75 1.473 12.097 -4.650 1.00 0.86 H new ATOM 0 HB3 GLU A 75 1.156 12.939 -3.147 1.00 0.86 H new ATOM 0 HG2 GLU A 75 3.487 13.558 -2.895 1.00 1.13 H new ATOM 0 HG3 GLU A 75 3.985 12.478 -4.182 1.00 1.13 H new ATOM 1196 N TYR A 76 0.429 9.672 -4.100 1.00 0.75 N ATOM 1197 CA TYR A 76 -0.740 8.837 -4.329 1.00 0.85 C ATOM 1198 C TYR A 76 -0.774 7.688 -3.333 1.00 1.10 C ATOM 1199 O TYR A 76 -1.828 7.381 -2.776 1.00 1.17 O ATOM 1200 CB TYR A 76 -0.755 8.299 -5.776 1.00 0.86 C ATOM 1201 CG TYR A 76 -2.147 8.261 -6.377 1.00 1.21 C ATOM 1202 CD1 TYR A 76 -3.214 7.813 -5.577 1.00 2.29 C ATOM 1203 CD2 TYR A 76 -2.432 9.138 -7.439 1.00 2.58 C ATOM 1204 CE1 TYR A 76 -4.363 8.612 -5.480 1.00 3.65 C ATOM 1205 CE2 TYR A 76 -3.648 9.838 -7.440 1.00 4.01 C ATOM 1206 CZ TYR A 76 -4.511 9.706 -6.345 1.00 4.43 C ATOM 1207 OH TYR A 76 -5.366 10.716 -6.033 1.00 6.40 O ATOM 0 H TYR A 76 0.982 9.827 -4.943 1.00 0.75 H new ATOM 0 HA TYR A 76 -1.631 9.449 -4.185 1.00 0.85 H new ATOM 0 HB2 TYR A 76 -0.113 8.924 -6.397 1.00 0.86 H new ATOM 0 HB3 TYR A 76 -0.331 7.295 -5.789 1.00 0.86 H new ATOM 0 HD1 TYR A 76 -3.150 6.873 -5.048 1.00 2.29 H new ATOM 0 HD2 TYR A 76 -1.724 9.271 -8.244 1.00 2.58 H new ATOM 0 HE1 TYR A 76 -5.125 8.387 -4.748 1.00 3.65 H new ATOM 0 HE2 TYR A 76 -3.915 10.470 -8.274 1.00 4.01 H new ATOM 0 HH TYR A 76 -6.290 10.410 -6.150 1.00 6.40 H new ATOM 1217 N TRP A 77 0.390 7.059 -3.135 1.00 1.24 N ATOM 1218 CA TRP A 77 0.544 5.840 -2.369 1.00 1.33 C ATOM 1219 C TRP A 77 -0.308 5.821 -1.090 1.00 1.22 C ATOM 1220 O TRP A 77 -0.888 4.775 -0.805 1.00 1.17 O ATOM 1221 CB TRP A 77 2.029 5.521 -2.122 1.00 1.49 C ATOM 1222 CG TRP A 77 2.235 4.192 -1.467 1.00 1.06 C ATOM 1223 CD1 TRP A 77 1.878 3.003 -2.006 1.00 1.46 C ATOM 1224 CD2 TRP A 77 2.702 3.892 -0.119 1.00 2.22 C ATOM 1225 NE1 TRP A 77 2.004 2.010 -1.066 1.00 1.68 N ATOM 1226 CE2 TRP A 77 2.513 2.497 0.103 1.00 1.50 C ATOM 1227 CE3 TRP A 77 3.223 4.639 0.962 1.00 4.23 C ATOM 1228 CZ2 TRP A 77 2.816 1.873 1.309 1.00 2.33 C ATOM 1229 CZ3 TRP A 77 3.458 4.015 2.204 1.00 5.01 C ATOM 1230 CH2 TRP A 77 3.275 2.644 2.369 1.00 3.99 C ATOM 0 H TRP A 77 1.270 7.403 -3.519 1.00 1.24 H new ATOM 0 HA TRP A 77 0.146 5.026 -2.975 1.00 1.33 H new ATOM 0 HB2 TRP A 77 2.563 5.539 -3.072 1.00 1.49 H new ATOM 0 HB3 TRP A 77 2.464 6.301 -1.497 1.00 1.49 H new ATOM 0 HD1 TRP A 77 1.544 2.857 -3.023 1.00 1.46 H new ATOM 0 HE1 TRP A 77 1.750 1.034 -1.221 1.00 1.68 H new ATOM 0 HE3 TRP A 77 3.441 5.689 0.836 1.00 4.23 H new ATOM 0 HZ2 TRP A 77 2.696 0.805 1.419 1.00 2.33 H new ATOM 0 HZ3 TRP A 77 3.786 4.611 3.043 1.00 5.01 H new ATOM 0 HH2 TRP A 77 3.490 2.181 3.321 1.00 3.99 H new ATOM 1241 N ARG A 78 -0.446 6.950 -0.364 1.00 1.21 N ATOM 1242 CA ARG A 78 -1.309 7.061 0.824 1.00 1.17 C ATOM 1243 C ARG A 78 -2.616 6.299 0.624 1.00 0.97 C ATOM 1244 O ARG A 78 -2.996 5.504 1.481 1.00 0.96 O ATOM 1245 CB ARG A 78 -1.667 8.514 1.161 1.00 1.20 C ATOM 1246 CG ARG A 78 -2.133 8.693 2.607 1.00 2.65 C ATOM 1247 CD ARG A 78 -2.770 10.078 2.803 1.00 3.16 C ATOM 1248 NE ARG A 78 -3.694 10.053 3.944 1.00 4.43 N ATOM 1249 CZ ARG A 78 -4.063 11.069 4.733 1.00 4.95 C ATOM 1250 NH1 ARG A 78 -3.632 12.313 4.508 1.00 4.66 N ATOM 1251 NH2 ARG A 78 -4.900 10.801 5.737 1.00 6.39 N ATOM 0 H ARG A 78 0.044 7.816 -0.590 1.00 1.21 H new ATOM 0 HA ARG A 78 -0.733 6.635 1.645 1.00 1.17 H new ATOM 0 HB2 ARG A 78 -0.798 9.147 0.984 1.00 1.20 H new ATOM 0 HB3 ARG A 78 -2.453 8.855 0.487 1.00 1.20 H new ATOM 0 HG2 ARG A 78 -2.854 7.916 2.861 1.00 2.65 H new ATOM 0 HG3 ARG A 78 -1.287 8.577 3.284 1.00 2.65 H new ATOM 0 HD2 ARG A 78 -1.993 10.824 2.971 1.00 3.16 H new ATOM 0 HD3 ARG A 78 -3.304 10.372 1.899 1.00 3.16 H new ATOM 0 HE ARG A 78 -4.107 9.146 4.163 1.00 4.43 H new ATOM 0 HH11 ARG A 78 -3.010 12.503 3.723 1.00 4.66 H new ATOM 0 HH12 ARG A 78 -3.925 13.073 5.122 1.00 4.66 H new ATOM 0 HH21 ARG A 78 -5.235 9.848 5.881 1.00 6.39 H new ATOM 0 HH22 ARG A 78 -5.205 11.549 6.360 1.00 6.39 H new ATOM 1265 N LEU A 79 -3.284 6.533 -0.513 1.00 0.87 N ATOM 1266 CA LEU A 79 -4.561 5.924 -0.827 1.00 0.76 C ATOM 1267 C LEU A 79 -4.516 4.428 -0.544 1.00 0.85 C ATOM 1268 O LEU A 79 -5.418 3.915 0.100 1.00 0.83 O ATOM 1269 CB LEU A 79 -4.941 6.178 -2.295 1.00 0.72 C ATOM 1270 CG LEU A 79 -6.425 5.872 -2.562 1.00 0.68 C ATOM 1271 CD1 LEU A 79 -7.323 7.054 -2.160 1.00 0.59 C ATOM 1272 CD2 LEU A 79 -6.628 5.540 -4.044 1.00 0.82 C ATOM 0 H LEU A 79 -2.940 7.159 -1.241 1.00 0.87 H new ATOM 0 HA LEU A 79 -5.322 6.379 -0.193 1.00 0.76 H new ATOM 0 HB2 LEU A 79 -4.733 7.217 -2.550 1.00 0.72 H new ATOM 0 HB3 LEU A 79 -4.320 5.560 -2.943 1.00 0.72 H new ATOM 0 HG LEU A 79 -6.709 5.013 -1.953 1.00 0.68 H new ATOM 0 HD11 LEU A 79 -8.365 6.805 -2.362 1.00 0.59 H new ATOM 0 HD12 LEU A 79 -7.199 7.260 -1.097 1.00 0.59 H new ATOM 0 HD13 LEU A 79 -7.043 7.936 -2.736 1.00 0.59 H new ATOM 0 HD21 LEU A 79 -7.681 5.324 -4.228 1.00 0.82 H new ATOM 0 HD22 LEU A 79 -6.320 6.390 -4.653 1.00 0.82 H new ATOM 0 HD23 LEU A 79 -6.028 4.669 -4.307 1.00 0.82 H new ATOM 1284 N ILE A 80 -3.463 3.733 -0.982 1.00 1.01 N ATOM 1285 CA ILE A 80 -3.388 2.276 -0.872 1.00 1.12 C ATOM 1286 C ILE A 80 -3.312 1.882 0.609 1.00 1.17 C ATOM 1287 O ILE A 80 -3.846 0.862 1.036 1.00 1.16 O ATOM 1288 CB ILE A 80 -2.222 1.747 -1.733 1.00 1.33 C ATOM 1289 CG1 ILE A 80 -2.504 2.089 -3.211 1.00 1.34 C ATOM 1290 CG2 ILE A 80 -2.028 0.234 -1.556 1.00 1.56 C ATOM 1291 CD1 ILE A 80 -1.447 1.560 -4.185 1.00 1.94 C ATOM 0 H ILE A 80 -2.646 4.160 -1.419 1.00 1.01 H new ATOM 0 HA ILE A 80 -4.287 1.804 -1.268 1.00 1.12 H new ATOM 0 HB ILE A 80 -1.298 2.226 -1.409 1.00 1.33 H new ATOM 0 HG12 ILE A 80 -3.476 1.681 -3.489 1.00 1.34 H new ATOM 0 HG13 ILE A 80 -2.571 3.172 -3.316 1.00 1.34 H new ATOM 0 HG21 ILE A 80 -1.198 -0.102 -2.178 1.00 1.56 H new ATOM 0 HG22 ILE A 80 -1.810 0.015 -0.511 1.00 1.56 H new ATOM 0 HG23 ILE A 80 -2.938 -0.287 -1.853 1.00 1.56 H new ATOM 0 HD11 ILE A 80 -1.717 1.841 -5.203 1.00 1.94 H new ATOM 0 HD12 ILE A 80 -0.476 1.988 -3.936 1.00 1.94 H new ATOM 0 HD13 ILE A 80 -1.395 0.474 -4.111 1.00 1.94 H new ATOM 1303 N GLY A 81 -2.671 2.732 1.402 1.00 1.29 N ATOM 1304 CA GLY A 81 -2.515 2.632 2.837 1.00 1.41 C ATOM 1305 C GLY A 81 -3.847 2.716 3.504 1.00 1.31 C ATOM 1306 O GLY A 81 -4.189 1.917 4.371 1.00 1.43 O ATOM 0 H GLY A 81 -2.217 3.565 1.027 1.00 1.29 H new ATOM 0 HA2 GLY A 81 -2.030 1.690 3.093 1.00 1.41 H new ATOM 0 HA3 GLY A 81 -1.868 3.432 3.197 1.00 1.41 H new ATOM 1310 N GLU A 82 -4.583 3.726 3.083 1.00 1.15 N ATOM 1311 CA GLU A 82 -5.841 4.061 3.682 1.00 1.14 C ATOM 1312 C GLU A 82 -6.800 2.941 3.299 1.00 1.12 C ATOM 1313 O GLU A 82 -7.299 2.281 4.196 1.00 1.20 O ATOM 1314 CB GLU A 82 -6.215 5.490 3.286 1.00 1.06 C ATOM 1315 CG GLU A 82 -5.032 6.443 3.620 1.00 1.06 C ATOM 1316 CD GLU A 82 -5.180 7.066 5.002 1.00 1.37 C ATOM 1317 OE1 GLU A 82 -5.098 6.295 5.986 1.00 2.42 O ATOM 1318 OE2 GLU A 82 -5.321 8.307 5.072 1.00 1.94 O ATOM 0 H GLU A 82 -4.315 4.335 2.310 1.00 1.15 H new ATOM 0 HA GLU A 82 -5.845 4.102 4.771 1.00 1.14 H new ATOM 0 HB2 GLU A 82 -6.445 5.536 2.221 1.00 1.06 H new ATOM 0 HB3 GLU A 82 -7.112 5.804 3.820 1.00 1.06 H new ATOM 0 HG2 GLU A 82 -4.094 5.890 3.569 1.00 1.06 H new ATOM 0 HG3 GLU A 82 -4.978 7.232 2.870 1.00 1.06 H new ATOM 1325 N LEU A 83 -6.933 2.618 2.009 1.00 1.05 N ATOM 1326 CA LEU A 83 -7.625 1.431 1.511 1.00 0.95 C ATOM 1327 C LEU A 83 -7.329 0.199 2.388 1.00 0.95 C ATOM 1328 O LEU A 83 -8.237 -0.417 2.946 1.00 0.95 O ATOM 1329 CB LEU A 83 -7.185 1.090 0.074 1.00 1.17 C ATOM 1330 CG LEU A 83 -7.468 2.018 -1.125 1.00 1.10 C ATOM 1331 CD1 LEU A 83 -7.806 1.160 -2.350 1.00 1.31 C ATOM 1332 CD2 LEU A 83 -8.490 3.136 -0.889 1.00 2.52 C ATOM 0 H LEU A 83 -6.549 3.195 1.261 1.00 1.05 H new ATOM 0 HA LEU A 83 -8.689 1.664 1.536 1.00 0.95 H new ATOM 0 HB2 LEU A 83 -6.105 0.943 0.106 1.00 1.17 H new ATOM 0 HB3 LEU A 83 -7.631 0.125 -0.167 1.00 1.17 H new ATOM 0 HG LEU A 83 -6.551 2.581 -1.298 1.00 1.10 H new ATOM 0 HD11 LEU A 83 -8.008 1.808 -3.203 1.00 1.31 H new ATOM 0 HD12 LEU A 83 -6.964 0.507 -2.581 1.00 1.31 H new ATOM 0 HD13 LEU A 83 -8.687 0.554 -2.138 1.00 1.31 H new ATOM 0 HD21 LEU A 83 -8.606 3.722 -1.801 1.00 2.52 H new ATOM 0 HD22 LEU A 83 -9.450 2.699 -0.614 1.00 2.52 H new ATOM 0 HD23 LEU A 83 -8.142 3.783 -0.084 1.00 2.52 H new ATOM 1344 N ALA A 84 -6.046 -0.167 2.498 1.00 0.98 N ATOM 1345 CA ALA A 84 -5.603 -1.313 3.279 1.00 1.02 C ATOM 1346 C ALA A 84 -6.062 -1.194 4.733 1.00 1.03 C ATOM 1347 O ALA A 84 -6.498 -2.170 5.334 1.00 1.16 O ATOM 1348 CB ALA A 84 -4.079 -1.442 3.190 1.00 1.11 C ATOM 0 H ALA A 84 -5.284 0.333 2.040 1.00 0.98 H new ATOM 0 HA ALA A 84 -6.054 -2.216 2.867 1.00 1.02 H new ATOM 0 HB1 ALA A 84 -3.752 -2.301 3.776 1.00 1.11 H new ATOM 0 HB2 ALA A 84 -3.786 -1.580 2.149 1.00 1.11 H new ATOM 0 HB3 ALA A 84 -3.614 -0.537 3.581 1.00 1.11 H new ATOM 1354 N LYS A 85 -5.976 0.006 5.307 1.00 1.02 N ATOM 1355 CA LYS A 85 -6.497 0.266 6.636 1.00 1.04 C ATOM 1356 C LYS A 85 -7.993 -0.033 6.683 1.00 1.00 C ATOM 1357 O LYS A 85 -8.444 -0.731 7.583 1.00 1.07 O ATOM 1358 CB LYS A 85 -6.264 1.732 7.036 1.00 1.24 C ATOM 1359 CG LYS A 85 -5.770 1.875 8.480 1.00 1.15 C ATOM 1360 CD LYS A 85 -4.262 2.128 8.585 1.00 1.97 C ATOM 1361 CE LYS A 85 -3.758 3.291 7.718 1.00 1.16 C ATOM 1362 NZ LYS A 85 -4.692 4.436 7.668 1.00 1.48 N ATOM 0 H LYS A 85 -5.545 0.816 4.862 1.00 1.02 H new ATOM 0 HA LYS A 85 -5.971 -0.382 7.337 1.00 1.04 H new ATOM 0 HB2 LYS A 85 -5.535 2.178 6.360 1.00 1.24 H new ATOM 0 HB3 LYS A 85 -7.193 2.290 6.916 1.00 1.24 H new ATOM 0 HG2 LYS A 85 -6.303 2.696 8.959 1.00 1.15 H new ATOM 0 HG3 LYS A 85 -6.018 0.969 9.033 1.00 1.15 H new ATOM 0 HD2 LYS A 85 -4.010 2.330 9.626 1.00 1.97 H new ATOM 0 HD3 LYS A 85 -3.732 1.220 8.299 1.00 1.97 H new ATOM 0 HE2 LYS A 85 -2.798 3.632 8.104 1.00 1.16 H new ATOM 0 HE3 LYS A 85 -3.584 2.930 6.705 1.00 1.16 H new ATOM 0 HZ1 LYS A 85 -4.284 5.191 7.081 1.00 1.48 H new ATOM 0 HZ2 LYS A 85 -5.597 4.128 7.257 1.00 1.48 H new ATOM 0 HZ3 LYS A 85 -4.853 4.795 8.631 1.00 1.48 H new ATOM 1376 N GLU A 86 -8.753 0.545 5.752 1.00 0.99 N ATOM 1377 CA GLU A 86 -10.204 0.605 5.739 1.00 1.03 C ATOM 1378 C GLU A 86 -10.791 -0.788 5.908 1.00 1.14 C ATOM 1379 O GLU A 86 -11.665 -0.979 6.751 1.00 1.36 O ATOM 1380 CB GLU A 86 -10.685 1.327 4.469 1.00 1.05 C ATOM 1381 CG GLU A 86 -10.315 2.820 4.552 1.00 1.11 C ATOM 1382 CD GLU A 86 -11.254 3.613 5.453 1.00 1.52 C ATOM 1383 OE1 GLU A 86 -12.458 3.282 5.481 1.00 2.31 O ATOM 1384 OE2 GLU A 86 -10.739 4.520 6.146 1.00 1.85 O ATOM 0 H GLU A 86 -8.342 1.009 4.942 1.00 0.99 H new ATOM 0 HA GLU A 86 -10.564 1.190 6.585 1.00 1.03 H new ATOM 0 HB2 GLU A 86 -10.228 0.877 3.588 1.00 1.05 H new ATOM 0 HB3 GLU A 86 -11.764 1.215 4.361 1.00 1.05 H new ATOM 0 HG2 GLU A 86 -9.295 2.916 4.924 1.00 1.11 H new ATOM 0 HG3 GLU A 86 -10.331 3.250 3.550 1.00 1.11 H new ATOM 1391 N ILE A 87 -10.274 -1.773 5.170 1.00 1.08 N ATOM 1392 CA ILE A 87 -10.743 -3.147 5.288 1.00 1.16 C ATOM 1393 C ILE A 87 -10.699 -3.664 6.742 1.00 1.27 C ATOM 1394 O ILE A 87 -11.522 -4.491 7.137 1.00 1.48 O ATOM 1395 CB ILE A 87 -9.995 -4.039 4.273 1.00 1.02 C ATOM 1396 CG1 ILE A 87 -10.968 -5.092 3.720 1.00 1.07 C ATOM 1397 CG2 ILE A 87 -8.757 -4.711 4.886 1.00 1.16 C ATOM 1398 CD1 ILE A 87 -10.429 -5.692 2.427 1.00 0.92 C ATOM 0 H ILE A 87 -9.530 -1.640 4.485 1.00 1.08 H new ATOM 0 HA ILE A 87 -11.801 -3.186 5.030 1.00 1.16 H new ATOM 0 HB ILE A 87 -9.633 -3.405 3.464 1.00 1.02 H new ATOM 0 HG12 ILE A 87 -11.118 -5.880 4.458 1.00 1.07 H new ATOM 0 HG13 ILE A 87 -11.941 -4.636 3.538 1.00 1.07 H new ATOM 0 HG21 ILE A 87 -8.267 -5.327 4.132 1.00 1.16 H new ATOM 0 HG22 ILE A 87 -8.064 -3.946 5.237 1.00 1.16 H new ATOM 0 HG23 ILE A 87 -9.061 -5.337 5.725 1.00 1.16 H new ATOM 0 HD11 ILE A 87 -11.131 -6.436 2.050 1.00 0.92 H new ATOM 0 HD12 ILE A 87 -10.303 -4.904 1.685 1.00 0.92 H new ATOM 0 HD13 ILE A 87 -9.467 -6.167 2.620 1.00 0.92 H new ATOM 1410 N ARG A 88 -9.758 -3.162 7.553 1.00 1.24 N ATOM 1411 CA ARG A 88 -9.665 -3.456 8.976 1.00 1.41 C ATOM 1412 C ARG A 88 -10.498 -2.471 9.802 1.00 1.38 C ATOM 1413 O ARG A 88 -11.182 -2.900 10.734 1.00 1.79 O ATOM 1414 CB ARG A 88 -8.184 -3.487 9.398 1.00 1.73 C ATOM 1415 CG ARG A 88 -7.936 -3.784 10.890 1.00 2.16 C ATOM 1416 CD ARG A 88 -7.860 -2.552 11.800 1.00 2.83 C ATOM 1417 NE ARG A 88 -6.826 -1.602 11.366 1.00 3.81 N ATOM 1418 CZ ARG A 88 -5.520 -1.677 11.676 1.00 4.88 C ATOM 1419 NH1 ARG A 88 -5.057 -2.737 12.343 1.00 5.37 N ATOM 1420 NH2 ARG A 88 -4.720 -0.667 11.319 1.00 6.12 N ATOM 0 H ARG A 88 -9.029 -2.528 7.225 1.00 1.24 H new ATOM 0 HA ARG A 88 -10.088 -4.441 9.172 1.00 1.41 H new ATOM 0 HB2 ARG A 88 -7.668 -4.241 8.803 1.00 1.73 H new ATOM 0 HB3 ARG A 88 -7.733 -2.525 9.155 1.00 1.73 H new ATOM 0 HG2 ARG A 88 -8.733 -4.434 11.252 1.00 2.16 H new ATOM 0 HG3 ARG A 88 -7.004 -4.342 10.982 1.00 2.16 H new ATOM 0 HD2 ARG A 88 -8.828 -2.052 11.812 1.00 2.83 H new ATOM 0 HD3 ARG A 88 -7.653 -2.870 12.822 1.00 2.83 H new ATOM 0 HE ARG A 88 -7.124 -0.821 10.781 1.00 3.81 H new ATOM 0 HH11 ARG A 88 -5.694 -3.486 12.615 1.00 5.37 H new ATOM 0 HH12 ARG A 88 -4.067 -2.798 12.580 1.00 5.37 H new ATOM 0 HH21 ARG A 88 -5.104 0.137 10.823 1.00 6.12 H new ATOM 0 HH22 ARG A 88 -3.725 -0.701 11.543 1.00 6.12 H new ATOM 1434 N LYS A 89 -10.387 -1.177 9.488 1.00 1.13 N ATOM 1435 CA LYS A 89 -10.811 -0.020 10.267 1.00 1.22 C ATOM 1436 C LYS A 89 -12.307 0.306 10.151 1.00 1.71 C ATOM 1437 O LYS A 89 -12.853 0.857 11.105 1.00 2.66 O ATOM 1438 CB LYS A 89 -9.952 1.174 9.794 1.00 1.02 C ATOM 1439 CG LYS A 89 -10.368 2.571 10.293 1.00 1.22 C ATOM 1440 CD LYS A 89 -9.763 3.643 9.375 1.00 1.42 C ATOM 1441 CE LYS A 89 -10.476 4.997 9.536 1.00 2.26 C ATOM 1442 NZ LYS A 89 -10.287 5.856 8.348 1.00 3.48 N ATOM 0 H LYS A 89 -9.961 -0.893 8.606 1.00 1.13 H new ATOM 0 HA LYS A 89 -10.664 -0.241 11.324 1.00 1.22 H new ATOM 0 HB2 LYS A 89 -8.922 0.995 10.104 1.00 1.02 H new ATOM 0 HB3 LYS A 89 -9.959 1.187 8.704 1.00 1.02 H new ATOM 0 HG2 LYS A 89 -11.455 2.657 10.303 1.00 1.22 H new ATOM 0 HG3 LYS A 89 -10.027 2.720 11.318 1.00 1.22 H new ATOM 0 HD2 LYS A 89 -8.703 3.760 9.601 1.00 1.42 H new ATOM 0 HD3 LYS A 89 -9.833 3.316 8.338 1.00 1.42 H new ATOM 0 HE2 LYS A 89 -11.541 4.831 9.700 1.00 2.26 H new ATOM 0 HE3 LYS A 89 -10.093 5.508 10.420 1.00 2.26 H new ATOM 0 HZ1 LYS A 89 -10.949 6.657 8.390 1.00 3.48 H new ATOM 0 HZ2 LYS A 89 -9.311 6.214 8.330 1.00 3.48 H new ATOM 0 HZ3 LYS A 89 -10.468 5.302 7.487 1.00 3.48 H new ATOM 1456 N LYS A 90 -12.969 0.062 9.010 1.00 1.93 N ATOM 1457 CA LYS A 90 -13.577 1.147 8.225 1.00 2.57 C ATOM 1458 C LYS A 90 -14.083 2.334 9.056 1.00 2.73 C ATOM 1459 O LYS A 90 -13.576 3.446 8.921 1.00 3.79 O ATOM 1460 CB LYS A 90 -14.823 0.600 7.503 1.00 3.46 C ATOM 1461 CG LYS A 90 -14.580 -0.435 6.406 1.00 4.53 C ATOM 1462 CD LYS A 90 -15.951 -0.881 5.875 1.00 5.54 C ATOM 1463 CE LYS A 90 -15.934 -1.214 4.382 1.00 6.72 C ATOM 1464 NZ LYS A 90 -15.792 0.013 3.566 1.00 7.33 N ATOM 0 H LYS A 90 -13.096 -0.869 8.613 1.00 1.93 H new ATOM 0 HA LYS A 90 -12.785 1.496 7.562 1.00 2.57 H new ATOM 0 HB2 LYS A 90 -15.482 0.157 8.250 1.00 3.46 H new ATOM 0 HB3 LYS A 90 -15.359 1.442 7.064 1.00 3.46 H new ATOM 0 HG2 LYS A 90 -13.979 -0.008 5.603 1.00 4.53 H new ATOM 0 HG3 LYS A 90 -14.026 -1.287 6.800 1.00 4.53 H new ATOM 0 HD2 LYS A 90 -16.283 -1.756 6.433 1.00 5.54 H new ATOM 0 HD3 LYS A 90 -16.680 -0.091 6.057 1.00 5.54 H new ATOM 0 HE2 LYS A 90 -15.111 -1.895 4.167 1.00 6.72 H new ATOM 0 HE3 LYS A 90 -16.854 -1.731 4.111 1.00 6.72 H new ATOM 0 HZ1 LYS A 90 -16.223 -0.139 2.632 1.00 7.33 H new ATOM 0 HZ2 LYS A 90 -16.269 0.804 4.043 1.00 7.33 H new ATOM 0 HZ3 LYS A 90 -14.783 0.237 3.449 1.00 7.33 H new ATOM 1478 N LYS A 91 -15.061 2.104 9.933 1.00 2.69 N ATOM 1479 CA LYS A 91 -15.565 3.114 10.842 1.00 3.41 C ATOM 1480 C LYS A 91 -15.972 2.409 12.132 1.00 3.42 C ATOM 1481 O LYS A 91 -17.138 2.419 12.528 1.00 4.16 O ATOM 1482 CB LYS A 91 -16.676 3.931 10.159 1.00 4.67 C ATOM 1483 CG LYS A 91 -17.014 5.201 10.957 1.00 5.88 C ATOM 1484 CD LYS A 91 -17.842 6.219 10.156 1.00 6.97 C ATOM 1485 CE LYS A 91 -17.023 6.869 9.025 1.00 7.72 C ATOM 1486 NZ LYS A 91 -17.699 8.048 8.443 1.00 8.93 N ATOM 0 H LYS A 91 -15.525 1.200 10.027 1.00 2.69 H new ATOM 0 HA LYS A 91 -14.810 3.854 11.107 1.00 3.41 H new ATOM 0 HB2 LYS A 91 -16.360 4.206 9.153 1.00 4.67 H new ATOM 0 HB3 LYS A 91 -17.570 3.316 10.056 1.00 4.67 H new ATOM 0 HG2 LYS A 91 -17.564 4.922 11.855 1.00 5.88 H new ATOM 0 HG3 LYS A 91 -16.088 5.673 11.285 1.00 5.88 H new ATOM 0 HD2 LYS A 91 -18.715 5.722 9.732 1.00 6.97 H new ATOM 0 HD3 LYS A 91 -18.211 6.994 10.828 1.00 6.97 H new ATOM 0 HE2 LYS A 91 -16.048 7.167 9.411 1.00 7.72 H new ATOM 0 HE3 LYS A 91 -16.844 6.133 8.241 1.00 7.72 H new ATOM 0 HZ1 LYS A 91 -17.108 8.449 7.687 1.00 8.93 H new ATOM 0 HZ2 LYS A 91 -18.618 7.762 8.049 1.00 8.93 H new ATOM 0 HZ3 LYS A 91 -17.847 8.764 9.183 1.00 8.93 H new ATOM 1500 N ASP A 92 -14.974 1.777 12.755 1.00 3.24 N ATOM 1501 CA ASP A 92 -15.060 1.156 14.065 1.00 3.95 C ATOM 1502 C ASP A 92 -15.588 2.175 15.084 1.00 4.65 C ATOM 1503 O ASP A 92 -14.851 3.027 15.573 1.00 5.11 O ATOM 1504 CB ASP A 92 -13.674 0.617 14.437 1.00 4.07 C ATOM 1505 CG ASP A 92 -13.762 -0.285 15.650 1.00 5.34 C ATOM 1506 OD1 ASP A 92 -13.731 0.235 16.783 1.00 6.65 O ATOM 1507 OD2 ASP A 92 -13.936 -1.505 15.451 1.00 5.60 O ATOM 0 H ASP A 92 -14.048 1.684 12.337 1.00 3.24 H new ATOM 0 HA ASP A 92 -15.760 0.320 14.060 1.00 3.95 H new ATOM 0 HB2 ASP A 92 -13.255 0.065 13.596 1.00 4.07 H new ATOM 0 HB3 ASP A 92 -12.998 1.447 14.642 1.00 4.07 H new ATOM 1512 N LEU A 93 -16.902 2.141 15.317 1.00 5.16 N ATOM 1513 CA LEU A 93 -17.667 3.136 16.041 1.00 5.94 C ATOM 1514 C LEU A 93 -19.069 2.542 16.163 1.00 6.17 C ATOM 1515 O LEU A 93 -19.570 2.316 17.262 1.00 6.93 O ATOM 1516 CB LEU A 93 -17.643 4.462 15.256 1.00 6.42 C ATOM 1517 CG LEU A 93 -18.800 5.405 15.602 1.00 7.41 C ATOM 1518 CD1 LEU A 93 -18.752 5.856 17.065 1.00 8.13 C ATOM 1519 CD2 LEU A 93 -18.765 6.632 14.684 1.00 8.13 C ATOM 0 H LEU A 93 -17.485 1.373 14.984 1.00 5.16 H new ATOM 0 HA LEU A 93 -17.269 3.365 17.030 1.00 5.94 H new ATOM 0 HB2 LEU A 93 -16.700 4.972 15.451 1.00 6.42 H new ATOM 0 HB3 LEU A 93 -17.672 4.242 14.189 1.00 6.42 H new ATOM 0 HG LEU A 93 -19.729 4.855 15.452 1.00 7.41 H new ATOM 0 HD11 LEU A 93 -19.590 6.523 17.268 1.00 8.13 H new ATOM 0 HD12 LEU A 93 -18.816 4.985 17.717 1.00 8.13 H new ATOM 0 HD13 LEU A 93 -17.816 6.382 17.253 1.00 8.13 H new ATOM 0 HD21 LEU A 93 -19.590 7.298 14.935 1.00 8.13 H new ATOM 0 HD22 LEU A 93 -17.820 7.159 14.817 1.00 8.13 H new ATOM 0 HD23 LEU A 93 -18.860 6.313 13.646 1.00 8.13 H new ATOM 1531 N LYS A 94 -19.683 2.239 15.013 1.00 5.77 N ATOM 1532 CA LYS A 94 -20.821 1.335 14.968 1.00 6.12 C ATOM 1533 C LYS A 94 -20.323 -0.097 15.197 1.00 5.87 C ATOM 1534 O LYS A 94 -19.116 -0.344 15.241 1.00 5.78 O ATOM 1535 CB LYS A 94 -21.553 1.476 13.624 1.00 6.71 C ATOM 1536 CG LYS A 94 -22.198 2.856 13.412 1.00 7.49 C ATOM 1537 CD LYS A 94 -23.356 3.116 14.391 1.00 8.50 C ATOM 1538 CE LYS A 94 -24.136 4.379 13.992 1.00 9.28 C ATOM 1539 NZ LYS A 94 -25.261 4.657 14.913 1.00 10.48 N ATOM 0 H LYS A 94 -19.405 2.611 14.105 1.00 5.77 H new ATOM 0 HA LYS A 94 -21.535 1.584 15.753 1.00 6.12 H new ATOM 0 HB2 LYS A 94 -20.848 1.286 12.815 1.00 6.71 H new ATOM 0 HB3 LYS A 94 -22.326 0.710 13.559 1.00 6.71 H new ATOM 0 HG2 LYS A 94 -21.441 3.631 13.534 1.00 7.49 H new ATOM 0 HG3 LYS A 94 -22.567 2.929 12.389 1.00 7.49 H new ATOM 0 HD2 LYS A 94 -24.027 2.257 14.403 1.00 8.50 H new ATOM 0 HD3 LYS A 94 -22.965 3.229 15.402 1.00 8.50 H new ATOM 0 HE2 LYS A 94 -23.459 5.233 13.980 1.00 9.28 H new ATOM 0 HE3 LYS A 94 -24.519 4.262 12.978 1.00 9.28 H new ATOM 0 HZ1 LYS A 94 -25.758 5.517 14.605 1.00 10.48 H new ATOM 0 HZ2 LYS A 94 -25.922 3.854 14.906 1.00 10.48 H new ATOM 0 HZ3 LYS A 94 -24.895 4.795 15.877 1.00 10.48 H new ATOM 1553 N ILE A 95 -21.260 -1.036 15.356 1.00 6.46 N ATOM 1554 CA ILE A 95 -20.945 -2.441 15.571 1.00 6.94 C ATOM 1555 C ILE A 95 -20.086 -2.980 14.420 1.00 6.42 C ATOM 1556 O ILE A 95 -20.239 -2.573 13.270 1.00 6.24 O ATOM 1557 CB ILE A 95 -22.237 -3.248 15.802 1.00 8.36 C ATOM 1558 CG1 ILE A 95 -21.901 -4.656 16.326 1.00 9.73 C ATOM 1559 CG2 ILE A 95 -23.107 -3.313 14.537 1.00 8.38 C ATOM 1560 CD1 ILE A 95 -23.133 -5.390 16.863 1.00 11.33 C ATOM 0 H ILE A 95 -22.260 -0.837 15.338 1.00 6.46 H new ATOM 0 HA ILE A 95 -20.347 -2.550 16.475 1.00 6.94 H new ATOM 0 HB ILE A 95 -22.824 -2.729 16.560 1.00 8.36 H new ATOM 0 HG12 ILE A 95 -21.454 -5.242 15.523 1.00 9.73 H new ATOM 0 HG13 ILE A 95 -21.155 -4.578 17.117 1.00 9.73 H new ATOM 0 HG21 ILE A 95 -24.008 -3.891 14.744 1.00 8.38 H new ATOM 0 HG22 ILE A 95 -23.385 -2.303 14.235 1.00 8.38 H new ATOM 0 HG23 ILE A 95 -22.546 -3.791 13.734 1.00 8.38 H new ATOM 0 HD11 ILE A 95 -22.841 -6.378 17.220 1.00 11.33 H new ATOM 0 HD12 ILE A 95 -23.566 -4.820 17.685 1.00 11.33 H new ATOM 0 HD13 ILE A 95 -23.870 -5.495 16.067 1.00 11.33 H new ATOM 1572 N ARG A 96 -19.150 -3.873 14.749 1.00 6.74 N ATOM 1573 CA ARG A 96 -18.176 -4.384 13.802 1.00 6.96 C ATOM 1574 C ARG A 96 -18.833 -5.443 12.912 1.00 6.89 C ATOM 1575 O ARG A 96 -19.765 -6.120 13.341 1.00 7.63 O ATOM 1576 CB ARG A 96 -16.957 -4.937 14.559 1.00 8.27 C ATOM 1577 CG ARG A 96 -16.123 -3.846 15.257 1.00 9.26 C ATOM 1578 CD ARG A 96 -16.693 -3.341 16.593 1.00 10.02 C ATOM 1579 NE ARG A 96 -15.782 -2.357 17.198 1.00 11.35 N ATOM 1580 CZ ARG A 96 -15.939 -1.762 18.391 1.00 12.68 C ATOM 1581 NH1 ARG A 96 -16.929 -2.151 19.201 1.00 12.91 N ATOM 1582 NH2 ARG A 96 -15.117 -0.783 18.773 1.00 14.03 N ATOM 0 H ARG A 96 -19.052 -4.260 15.688 1.00 6.74 H new ATOM 0 HA ARG A 96 -17.823 -3.581 13.155 1.00 6.96 H new ATOM 0 HB2 ARG A 96 -17.297 -5.656 15.304 1.00 8.27 H new ATOM 0 HB3 ARG A 96 -16.320 -5.479 13.860 1.00 8.27 H new ATOM 0 HG2 ARG A 96 -15.120 -4.234 15.432 1.00 9.26 H new ATOM 0 HG3 ARG A 96 -16.023 -2.998 14.579 1.00 9.26 H new ATOM 0 HD2 ARG A 96 -17.672 -2.889 16.431 1.00 10.02 H new ATOM 0 HD3 ARG A 96 -16.838 -4.179 17.274 1.00 10.02 H new ATOM 0 HE ARG A 96 -14.953 -2.103 16.660 1.00 11.35 H new ATOM 0 HH11 ARG A 96 -17.561 -2.897 18.912 1.00 12.91 H new ATOM 0 HH12 ARG A 96 -17.052 -1.702 20.108 1.00 12.91 H new ATOM 0 HH21 ARG A 96 -14.362 -0.481 18.157 1.00 14.03 H new ATOM 0 HH22 ARG A 96 -15.243 -0.336 19.681 1.00 14.03 H new ATOM 1596 N LYS A 97 -18.329 -5.590 11.681 1.00 6.48 N ATOM 1597 CA LYS A 97 -18.922 -6.403 10.614 1.00 6.69 C ATOM 1598 C LYS A 97 -18.041 -6.388 9.352 1.00 6.57 C ATOM 1599 O LYS A 97 -18.046 -7.371 8.610 1.00 6.80 O ATOM 1600 CB LYS A 97 -20.359 -5.935 10.301 1.00 6.96 C ATOM 1601 CG LYS A 97 -21.044 -6.765 9.196 1.00 8.04 C ATOM 1602 CD LYS A 97 -21.305 -5.949 7.917 1.00 8.82 C ATOM 1603 CE LYS A 97 -21.058 -6.744 6.624 1.00 9.80 C ATOM 1604 NZ LYS A 97 -19.621 -6.833 6.300 1.00 10.40 N ATOM 0 H LYS A 97 -17.466 -5.130 11.391 1.00 6.48 H new ATOM 0 HA LYS A 97 -18.976 -7.434 10.965 1.00 6.69 H new ATOM 0 HB2 LYS A 97 -20.958 -5.989 11.210 1.00 6.96 H new ATOM 0 HB3 LYS A 97 -20.335 -4.888 9.997 1.00 6.96 H new ATOM 0 HG2 LYS A 97 -20.419 -7.625 8.953 1.00 8.04 H new ATOM 0 HG3 LYS A 97 -21.990 -7.155 9.573 1.00 8.04 H new ATOM 0 HD2 LYS A 97 -22.336 -5.594 7.925 1.00 8.82 H new ATOM 0 HD3 LYS A 97 -20.664 -5.067 7.920 1.00 8.82 H new ATOM 0 HE2 LYS A 97 -21.469 -7.748 6.731 1.00 9.80 H new ATOM 0 HE3 LYS A 97 -21.588 -6.269 5.798 1.00 9.80 H new ATOM 0 HZ1 LYS A 97 -19.505 -6.994 5.279 1.00 10.40 H new ATOM 0 HZ2 LYS A 97 -19.149 -5.945 6.566 1.00 10.40 H new ATOM 0 HZ3 LYS A 97 -19.195 -7.622 6.826 1.00 10.40 H new ATOM 1618 N LYS A 98 -17.260 -5.319 9.150 1.00 6.89 N ATOM 1619 CA LYS A 98 -16.399 -5.069 7.992 1.00 7.52 C ATOM 1620 C LYS A 98 -17.220 -4.525 6.820 1.00 7.76 C ATOM 1621 O LYS A 98 -16.594 -4.081 5.837 1.00 8.62 O ATOM 1622 CB LYS A 98 -15.536 -6.273 7.564 1.00 8.24 C ATOM 1623 CG LYS A 98 -14.580 -6.787 8.654 1.00 8.90 C ATOM 1624 CD LYS A 98 -15.015 -8.078 9.372 1.00 9.27 C ATOM 1625 CE LYS A 98 -15.187 -9.267 8.411 1.00 9.71 C ATOM 1626 NZ LYS A 98 -16.600 -9.633 8.203 1.00 9.46 N ATOM 1627 OXT LYS A 98 -18.466 -4.561 6.925 1.00 7.75 O ATOM 0 H LYS A 98 -17.211 -4.562 9.832 1.00 6.89 H new ATOM 0 HA LYS A 98 -15.683 -4.312 8.312 1.00 7.52 H new ATOM 0 HB2 LYS A 98 -16.194 -7.087 7.261 1.00 8.24 H new ATOM 0 HB3 LYS A 98 -14.952 -5.993 6.688 1.00 8.24 H new ATOM 0 HG2 LYS A 98 -13.602 -6.956 8.203 1.00 8.90 H new ATOM 0 HG3 LYS A 98 -14.455 -6.003 9.401 1.00 8.90 H new ATOM 0 HD2 LYS A 98 -14.274 -8.334 10.130 1.00 9.27 H new ATOM 0 HD3 LYS A 98 -15.956 -7.899 9.893 1.00 9.27 H new ATOM 0 HE2 LYS A 98 -14.735 -9.020 7.450 1.00 9.71 H new ATOM 0 HE3 LYS A 98 -14.647 -10.128 8.805 1.00 9.71 H new ATOM 0 HZ1 LYS A 98 -16.768 -10.592 8.570 1.00 9.46 H new ATOM 0 HZ2 LYS A 98 -17.211 -8.958 8.706 1.00 9.46 H new ATOM 0 HZ3 LYS A 98 -16.819 -9.608 7.187 1.00 9.46 H new TER 1641 LYS A 98 ATOM 1642 N MET B 1 -11.826 -5.399 11.463 1.00 4.96 N ATOM 1643 CA MET B 1 -10.984 -6.603 11.616 1.00 5.61 C ATOM 1644 C MET B 1 -10.250 -6.946 10.312 1.00 6.02 C ATOM 1645 O MET B 1 -9.132 -6.481 10.131 1.00 6.96 O ATOM 1646 CB MET B 1 -11.763 -7.796 12.201 1.00 5.67 C ATOM 1647 CG MET B 1 -12.593 -7.442 13.447 1.00 5.51 C ATOM 1648 SD MET B 1 -11.790 -6.395 14.687 1.00 5.77 S ATOM 1649 CE MET B 1 -10.421 -7.461 15.197 1.00 7.21 C ATOM 0 H1 MET B 1 -12.200 -5.116 12.391 1.00 4.96 H new ATOM 0 H2 MET B 1 -11.255 -4.624 11.069 1.00 4.96 H new ATOM 0 H3 MET B 1 -12.617 -5.608 10.821 1.00 4.96 H new ATOM 0 HA MET B 1 -10.216 -6.368 12.353 1.00 5.61 H new ATOM 0 HB2 MET B 1 -12.427 -8.196 11.435 1.00 5.67 H new ATOM 0 HB3 MET B 1 -11.059 -8.588 12.457 1.00 5.67 H new ATOM 0 HG2 MET B 1 -13.504 -6.943 13.118 1.00 5.51 H new ATOM 0 HG3 MET B 1 -12.895 -8.371 13.930 1.00 5.51 H new ATOM 0 HE1 MET B 1 -9.831 -6.955 15.961 1.00 7.21 H new ATOM 0 HE2 MET B 1 -10.817 -8.392 15.602 1.00 7.21 H new ATOM 0 HE3 MET B 1 -9.790 -7.679 14.336 1.00 7.21 H new ATOM 1661 N ALA B 2 -10.854 -7.711 9.396 1.00 5.65 N ATOM 1662 CA ALA B 2 -10.274 -8.036 8.095 1.00 6.00 C ATOM 1663 C ALA B 2 -11.284 -8.853 7.296 1.00 5.34 C ATOM 1664 O ALA B 2 -12.236 -9.372 7.876 1.00 5.30 O ATOM 1665 CB ALA B 2 -8.981 -8.853 8.261 1.00 7.33 C ATOM 0 H ALA B 2 -11.774 -8.127 9.543 1.00 5.65 H new ATOM 0 HA ALA B 2 -10.034 -7.109 7.574 1.00 6.00 H new ATOM 0 HB1 ALA B 2 -8.567 -9.083 7.279 1.00 7.33 H new ATOM 0 HB2 ALA B 2 -8.256 -8.274 8.834 1.00 7.33 H new ATOM 0 HB3 ALA B 2 -9.202 -9.781 8.788 1.00 7.33 H new ATOM 1671 N ALA B 3 -11.022 -8.982 5.993 1.00 5.35 N ATOM 1672 CA ALA B 3 -11.486 -10.058 5.128 1.00 5.28 C ATOM 1673 C ALA B 3 -13.003 -10.116 4.897 1.00 4.18 C ATOM 1674 O ALA B 3 -13.711 -10.850 5.586 1.00 4.50 O ATOM 1675 CB ALA B 3 -10.932 -11.401 5.619 1.00 6.46 C ATOM 0 H ALA B 3 -10.451 -8.302 5.492 1.00 5.35 H new ATOM 0 HA ALA B 3 -11.087 -9.832 4.139 1.00 5.28 H new ATOM 0 HB1 ALA B 3 -11.284 -12.200 4.967 1.00 6.46 H new ATOM 0 HB2 ALA B 3 -9.842 -11.373 5.603 1.00 6.46 H new ATOM 0 HB3 ALA B 3 -11.275 -11.586 6.637 1.00 6.46 H new ATOM 1681 N GLU B 4 -13.470 -9.414 3.859 1.00 3.42 N ATOM 1682 CA GLU B 4 -14.636 -9.771 3.052 1.00 2.78 C ATOM 1683 C GLU B 4 -14.232 -9.479 1.598 1.00 2.52 C ATOM 1684 O GLU B 4 -13.377 -8.614 1.405 1.00 2.29 O ATOM 1685 CB GLU B 4 -15.881 -8.962 3.461 1.00 2.86 C ATOM 1686 CG GLU B 4 -16.565 -9.586 4.684 1.00 3.65 C ATOM 1687 CD GLU B 4 -17.798 -8.827 5.145 1.00 4.51 C ATOM 1688 OE1 GLU B 4 -18.433 -8.106 4.346 1.00 4.90 O ATOM 1689 OE2 GLU B 4 -18.112 -8.930 6.351 1.00 5.29 O ATOM 0 H GLU B 4 -13.028 -8.549 3.548 1.00 3.42 H new ATOM 0 HA GLU B 4 -14.910 -10.817 3.192 1.00 2.78 H new ATOM 0 HB2 GLU B 4 -15.594 -7.935 3.685 1.00 2.86 H new ATOM 0 HB3 GLU B 4 -16.583 -8.922 2.628 1.00 2.86 H new ATOM 0 HG2 GLU B 4 -16.847 -10.612 4.448 1.00 3.65 H new ATOM 0 HG3 GLU B 4 -15.850 -9.633 5.505 1.00 3.65 H new ATOM 1696 N PRO B 5 -14.783 -10.192 0.600 1.00 2.74 N ATOM 1697 CA PRO B 5 -14.456 -9.991 -0.808 1.00 2.54 C ATOM 1698 C PRO B 5 -15.155 -8.739 -1.354 1.00 1.86 C ATOM 1699 O PRO B 5 -16.247 -8.392 -0.903 1.00 2.03 O ATOM 1700 CB PRO B 5 -14.944 -11.257 -1.515 1.00 3.20 C ATOM 1701 CG PRO B 5 -16.144 -11.679 -0.664 1.00 3.56 C ATOM 1702 CD PRO B 5 -15.710 -11.301 0.755 1.00 3.39 C ATOM 0 HA PRO B 5 -13.389 -9.832 -0.965 1.00 2.54 H new ATOM 0 HB2 PRO B 5 -15.230 -11.059 -2.548 1.00 3.20 H new ATOM 0 HB3 PRO B 5 -14.174 -12.029 -1.540 1.00 3.20 H new ATOM 0 HG2 PRO B 5 -17.053 -11.156 -0.961 1.00 3.56 H new ATOM 0 HG3 PRO B 5 -16.347 -12.746 -0.753 1.00 3.56 H new ATOM 0 HD2 PRO B 5 -16.567 -11.013 1.363 1.00 3.39 H new ATOM 0 HD3 PRO B 5 -15.233 -12.143 1.256 1.00 3.39 H new ATOM 1710 N LEU B 6 -14.506 -8.049 -2.296 1.00 1.50 N ATOM 1711 CA LEU B 6 -14.826 -6.702 -2.756 1.00 1.08 C ATOM 1712 C LEU B 6 -14.548 -6.586 -4.274 1.00 1.09 C ATOM 1713 O LEU B 6 -14.561 -7.602 -4.964 1.00 1.54 O ATOM 1714 CB LEU B 6 -14.005 -5.721 -1.905 1.00 1.45 C ATOM 1715 CG LEU B 6 -14.267 -5.786 -0.389 1.00 1.83 C ATOM 1716 CD1 LEU B 6 -13.257 -4.912 0.351 1.00 3.06 C ATOM 1717 CD2 LEU B 6 -15.670 -5.293 -0.026 1.00 2.69 C ATOM 0 H LEU B 6 -13.699 -8.440 -2.783 1.00 1.50 H new ATOM 0 HA LEU B 6 -15.882 -6.465 -2.630 1.00 1.08 H new ATOM 0 HB2 LEU B 6 -12.946 -5.910 -2.082 1.00 1.45 H new ATOM 0 HB3 LEU B 6 -14.210 -4.707 -2.249 1.00 1.45 H new ATOM 0 HG LEU B 6 -14.172 -6.832 -0.096 1.00 1.83 H new ATOM 0 HD11 LEU B 6 -13.448 -4.963 1.423 1.00 3.06 H new ATOM 0 HD12 LEU B 6 -12.248 -5.268 0.145 1.00 3.06 H new ATOM 0 HD13 LEU B 6 -13.353 -3.880 0.014 1.00 3.06 H new ATOM 0 HD21 LEU B 6 -15.810 -5.357 1.053 1.00 2.69 H new ATOM 0 HD22 LEU B 6 -15.786 -4.258 -0.346 1.00 2.69 H new ATOM 0 HD23 LEU B 6 -16.414 -5.913 -0.526 1.00 2.69 H new ATOM 1729 N THR B 7 -14.362 -5.376 -4.834 1.00 0.98 N ATOM 1730 CA THR B 7 -14.401 -5.176 -6.290 1.00 1.01 C ATOM 1731 C THR B 7 -13.225 -5.799 -7.071 1.00 1.09 C ATOM 1732 O THR B 7 -13.424 -6.738 -7.838 1.00 2.36 O ATOM 1733 CB THR B 7 -14.654 -3.688 -6.622 1.00 1.08 C ATOM 1734 OG1 THR B 7 -15.126 -3.546 -7.945 1.00 1.39 O ATOM 1735 CG2 THR B 7 -13.437 -2.768 -6.448 1.00 1.09 C ATOM 0 H THR B 7 -14.184 -4.526 -4.300 1.00 0.98 H new ATOM 0 HA THR B 7 -15.251 -5.751 -6.656 1.00 1.01 H new ATOM 0 HB THR B 7 -15.400 -3.373 -5.892 1.00 1.08 H new ATOM 0 HG1 THR B 7 -15.282 -2.598 -8.137 1.00 1.39 H new ATOM 0 HG21 THR B 7 -13.714 -1.746 -6.705 1.00 1.09 H new ATOM 0 HG22 THR B 7 -13.099 -2.803 -5.412 1.00 1.09 H new ATOM 0 HG23 THR B 7 -12.632 -3.101 -7.103 1.00 1.09 H new ATOM 1743 N GLU B 8 -12.015 -5.239 -6.937 1.00 1.08 N ATOM 1744 CA GLU B 8 -10.851 -5.528 -7.772 1.00 0.90 C ATOM 1745 C GLU B 8 -9.633 -4.832 -7.158 1.00 0.80 C ATOM 1746 O GLU B 8 -8.821 -5.493 -6.518 1.00 0.83 O ATOM 1747 CB GLU B 8 -11.078 -5.108 -9.234 1.00 1.11 C ATOM 1748 CG GLU B 8 -9.901 -5.549 -10.115 1.00 1.23 C ATOM 1749 CD GLU B 8 -9.945 -4.869 -11.473 1.00 1.64 C ATOM 1750 OE1 GLU B 8 -9.446 -3.724 -11.533 1.00 2.04 O ATOM 1751 OE2 GLU B 8 -10.491 -5.483 -12.412 1.00 2.39 O ATOM 0 H GLU B 8 -11.817 -4.546 -6.215 1.00 1.08 H new ATOM 0 HA GLU B 8 -10.678 -6.604 -7.797 1.00 0.90 H new ATOM 0 HB2 GLU B 8 -12.002 -5.551 -9.605 1.00 1.11 H new ATOM 0 HB3 GLU B 8 -11.197 -4.026 -9.292 1.00 1.11 H new ATOM 0 HG2 GLU B 8 -8.961 -5.311 -9.617 1.00 1.23 H new ATOM 0 HG3 GLU B 8 -9.927 -6.631 -10.246 1.00 1.23 H new ATOM 1758 N LEU B 9 -9.503 -3.500 -7.256 1.00 0.77 N ATOM 1759 CA LEU B 9 -8.490 -2.826 -6.443 1.00 0.76 C ATOM 1760 C LEU B 9 -8.712 -3.140 -4.960 1.00 0.79 C ATOM 1761 O LEU B 9 -7.758 -3.432 -4.238 1.00 0.82 O ATOM 1762 CB LEU B 9 -8.465 -1.314 -6.709 1.00 0.79 C ATOM 1763 CG LEU B 9 -7.596 -0.966 -7.929 1.00 0.78 C ATOM 1764 CD1 LEU B 9 -7.862 0.476 -8.357 1.00 1.05 C ATOM 1765 CD2 LEU B 9 -6.098 -1.065 -7.605 1.00 1.00 C ATOM 0 H LEU B 9 -10.059 -2.896 -7.861 1.00 0.77 H new ATOM 0 HA LEU B 9 -7.510 -3.207 -6.729 1.00 0.76 H new ATOM 0 HB2 LEU B 9 -9.482 -0.956 -6.872 1.00 0.79 H new ATOM 0 HB3 LEU B 9 -8.082 -0.796 -5.830 1.00 0.79 H new ATOM 0 HG LEU B 9 -7.852 -1.676 -8.716 1.00 0.78 H new ATOM 0 HD11 LEU B 9 -7.244 0.719 -9.222 1.00 1.05 H new ATOM 0 HD12 LEU B 9 -8.914 0.590 -8.619 1.00 1.05 H new ATOM 0 HD13 LEU B 9 -7.618 1.150 -7.536 1.00 1.05 H new ATOM 0 HD21 LEU B 9 -5.516 -0.812 -8.492 1.00 1.00 H new ATOM 0 HD22 LEU B 9 -5.853 -0.372 -6.800 1.00 1.00 H new ATOM 0 HD23 LEU B 9 -5.860 -2.082 -7.293 1.00 1.00 H new ATOM 1777 N GLU B 10 -9.976 -3.142 -4.528 1.00 0.81 N ATOM 1778 CA GLU B 10 -10.370 -3.583 -3.199 1.00 0.89 C ATOM 1779 C GLU B 10 -9.860 -5.016 -2.907 1.00 1.00 C ATOM 1780 O GLU B 10 -9.339 -5.278 -1.825 1.00 1.34 O ATOM 1781 CB GLU B 10 -11.887 -3.442 -3.030 1.00 0.98 C ATOM 1782 CG GLU B 10 -12.424 -2.004 -3.231 1.00 1.84 C ATOM 1783 CD GLU B 10 -13.957 -1.918 -3.194 1.00 2.41 C ATOM 1784 OE1 GLU B 10 -14.586 -2.897 -3.651 1.00 2.83 O ATOM 1785 OE2 GLU B 10 -14.490 -0.860 -2.779 1.00 3.51 O ATOM 0 H GLU B 10 -10.760 -2.832 -5.103 1.00 0.81 H new ATOM 0 HA GLU B 10 -9.898 -2.941 -2.455 1.00 0.89 H new ATOM 0 HB2 GLU B 10 -12.382 -4.104 -3.741 1.00 0.98 H new ATOM 0 HB3 GLU B 10 -12.162 -3.783 -2.032 1.00 0.98 H new ATOM 0 HG2 GLU B 10 -12.012 -1.358 -2.456 1.00 1.84 H new ATOM 0 HG3 GLU B 10 -12.068 -1.621 -4.188 1.00 1.84 H new ATOM 1792 N GLU B 11 -9.942 -5.941 -3.873 1.00 0.92 N ATOM 1793 CA GLU B 11 -9.368 -7.280 -3.727 1.00 0.90 C ATOM 1794 C GLU B 11 -7.844 -7.196 -3.581 1.00 0.90 C ATOM 1795 O GLU B 11 -7.244 -7.884 -2.756 1.00 0.94 O ATOM 1796 CB GLU B 11 -9.717 -8.163 -4.938 1.00 0.98 C ATOM 1797 CG GLU B 11 -11.223 -8.350 -5.152 1.00 1.80 C ATOM 1798 CD GLU B 11 -11.793 -9.365 -4.173 1.00 3.01 C ATOM 1799 OE1 GLU B 11 -12.090 -8.944 -3.036 1.00 4.31 O ATOM 1800 OE2 GLU B 11 -11.897 -10.547 -4.566 1.00 3.37 O ATOM 0 H GLU B 11 -10.404 -5.782 -4.768 1.00 0.92 H new ATOM 0 HA GLU B 11 -9.793 -7.729 -2.829 1.00 0.90 H new ATOM 0 HB2 GLU B 11 -9.284 -7.721 -5.835 1.00 0.98 H new ATOM 0 HB3 GLU B 11 -9.253 -9.141 -4.809 1.00 0.98 H new ATOM 0 HG2 GLU B 11 -11.733 -7.394 -5.028 1.00 1.80 H new ATOM 0 HG3 GLU B 11 -11.410 -8.681 -6.174 1.00 1.80 H new ATOM 1807 N SER B 12 -7.209 -6.356 -4.401 1.00 0.90 N ATOM 1808 CA SER B 12 -5.763 -6.190 -4.412 1.00 0.94 C ATOM 1809 C SER B 12 -5.264 -5.724 -3.044 1.00 0.90 C ATOM 1810 O SER B 12 -4.273 -6.251 -2.544 1.00 0.94 O ATOM 1811 CB SER B 12 -5.338 -5.236 -5.536 1.00 1.10 C ATOM 1812 OG SER B 12 -3.945 -5.334 -5.767 1.00 1.83 O ATOM 0 H SER B 12 -7.693 -5.769 -5.080 1.00 0.90 H new ATOM 0 HA SER B 12 -5.299 -7.156 -4.614 1.00 0.94 H new ATOM 0 HB2 SER B 12 -5.882 -5.475 -6.450 1.00 1.10 H new ATOM 0 HB3 SER B 12 -5.598 -4.211 -5.269 1.00 1.10 H new ATOM 0 HG SER B 12 -3.473 -4.689 -5.199 1.00 1.83 H new ATOM 1818 N ILE B 13 -5.929 -4.737 -2.432 1.00 0.89 N ATOM 1819 CA ILE B 13 -5.602 -4.350 -1.062 1.00 0.91 C ATOM 1820 C ILE B 13 -5.948 -5.480 -0.092 1.00 0.92 C ATOM 1821 O ILE B 13 -5.179 -5.731 0.841 1.00 0.97 O ATOM 1822 CB ILE B 13 -6.160 -2.963 -0.670 1.00 0.93 C ATOM 1823 CG1 ILE B 13 -7.658 -2.779 -0.909 1.00 0.86 C ATOM 1824 CG2 ILE B 13 -5.379 -1.915 -1.475 1.00 1.00 C ATOM 1825 CD1 ILE B 13 -8.500 -3.200 0.295 1.00 0.86 C ATOM 0 H ILE B 13 -6.685 -4.201 -2.859 1.00 0.89 H new ATOM 0 HA ILE B 13 -4.523 -4.208 -0.996 1.00 0.91 H new ATOM 0 HB ILE B 13 -6.033 -2.854 0.407 1.00 0.93 H new ATOM 0 HG12 ILE B 13 -7.860 -1.733 -1.141 1.00 0.86 H new ATOM 0 HG13 ILE B 13 -7.958 -3.362 -1.780 1.00 0.86 H new ATOM 0 HG21 ILE B 13 -5.744 -0.919 -1.226 1.00 1.00 H new ATOM 0 HG22 ILE B 13 -4.319 -1.984 -1.231 1.00 1.00 H new ATOM 0 HG23 ILE B 13 -5.518 -2.097 -2.541 1.00 1.00 H new ATOM 0 HD11 ILE B 13 -9.556 -3.049 0.071 1.00 0.86 H new ATOM 0 HD12 ILE B 13 -8.323 -4.253 0.513 1.00 0.86 H new ATOM 0 HD13 ILE B 13 -8.223 -2.599 1.161 1.00 0.86 H new ATOM 1837 N GLU B 14 -7.061 -6.192 -0.321 1.00 0.91 N ATOM 1838 CA GLU B 14 -7.435 -7.294 0.549 1.00 0.96 C ATOM 1839 C GLU B 14 -6.297 -8.303 0.620 1.00 0.97 C ATOM 1840 O GLU B 14 -5.734 -8.454 1.692 1.00 1.10 O ATOM 1841 CB GLU B 14 -8.785 -7.923 0.176 1.00 1.04 C ATOM 1842 CG GLU B 14 -9.351 -8.771 1.334 1.00 1.08 C ATOM 1843 CD GLU B 14 -9.000 -10.253 1.299 1.00 1.72 C ATOM 1844 OE1 GLU B 14 -8.093 -10.627 0.526 1.00 2.73 O ATOM 1845 OE2 GLU B 14 -9.631 -10.982 2.095 1.00 2.33 O ATOM 0 H GLU B 14 -7.705 -6.020 -1.094 1.00 0.91 H new ATOM 0 HA GLU B 14 -7.593 -6.898 1.552 1.00 0.96 H new ATOM 0 HB2 GLU B 14 -9.495 -7.137 -0.082 1.00 1.04 H new ATOM 0 HB3 GLU B 14 -8.665 -8.548 -0.709 1.00 1.04 H new ATOM 0 HG2 GLU B 14 -8.993 -8.353 2.275 1.00 1.08 H new ATOM 0 HG3 GLU B 14 -10.437 -8.673 1.335 1.00 1.08 H new ATOM 1852 N THR B 15 -5.871 -8.913 -0.488 1.00 0.90 N ATOM 1853 CA THR B 15 -4.926 -10.032 -0.438 1.00 0.94 C ATOM 1854 C THR B 15 -3.606 -9.689 0.282 1.00 0.91 C ATOM 1855 O THR B 15 -2.985 -10.555 0.904 1.00 0.91 O ATOM 1856 CB THR B 15 -4.711 -10.616 -1.848 1.00 0.93 C ATOM 1857 OG1 THR B 15 -3.926 -11.790 -1.797 1.00 1.24 O ATOM 1858 CG2 THR B 15 -4.013 -9.651 -2.809 1.00 0.96 C ATOM 0 H THR B 15 -6.164 -8.652 -1.429 1.00 0.90 H new ATOM 0 HA THR B 15 -5.375 -10.810 0.180 1.00 0.94 H new ATOM 0 HB THR B 15 -5.715 -10.822 -2.220 1.00 0.93 H new ATOM 0 HG1 THR B 15 -3.805 -12.142 -2.703 1.00 1.24 H new ATOM 0 HG21 THR B 15 -3.895 -10.128 -3.782 1.00 0.96 H new ATOM 0 HG22 THR B 15 -4.614 -8.748 -2.918 1.00 0.96 H new ATOM 0 HG23 THR B 15 -3.032 -9.388 -2.412 1.00 0.96 H new ATOM 1866 N VAL B 16 -3.188 -8.418 0.250 1.00 0.89 N ATOM 1867 CA VAL B 16 -1.935 -7.993 0.877 1.00 0.82 C ATOM 1868 C VAL B 16 -2.152 -7.796 2.372 1.00 0.85 C ATOM 1869 O VAL B 16 -1.363 -8.293 3.178 1.00 0.77 O ATOM 1870 CB VAL B 16 -1.251 -6.785 0.206 1.00 0.79 C ATOM 1871 CG1 VAL B 16 -0.812 -7.111 -1.225 1.00 0.82 C ATOM 1872 CG2 VAL B 16 -2.090 -5.510 0.188 1.00 0.80 C ATOM 0 H VAL B 16 -3.703 -7.665 -0.206 1.00 0.89 H new ATOM 0 HA VAL B 16 -1.217 -8.799 0.724 1.00 0.82 H new ATOM 0 HB VAL B 16 -0.382 -6.587 0.834 1.00 0.79 H new ATOM 0 HG11 VAL B 16 -0.334 -6.237 -1.667 1.00 0.82 H new ATOM 0 HG12 VAL B 16 -0.106 -7.941 -1.209 1.00 0.82 H new ATOM 0 HG13 VAL B 16 -1.683 -7.387 -1.819 1.00 0.82 H new ATOM 0 HG21 VAL B 16 -1.531 -4.713 -0.302 1.00 0.80 H new ATOM 0 HG22 VAL B 16 -3.016 -5.692 -0.357 1.00 0.80 H new ATOM 0 HG23 VAL B 16 -2.323 -5.213 1.211 1.00 0.80 H new ATOM 1882 N VAL B 17 -3.252 -7.140 2.761 1.00 0.97 N ATOM 1883 CA VAL B 17 -3.681 -7.183 4.152 1.00 0.92 C ATOM 1884 C VAL B 17 -3.816 -8.649 4.571 1.00 0.83 C ATOM 1885 O VAL B 17 -3.491 -8.999 5.695 1.00 0.80 O ATOM 1886 CB VAL B 17 -4.986 -6.391 4.350 1.00 1.04 C ATOM 1887 CG1 VAL B 17 -5.510 -6.535 5.787 1.00 1.12 C ATOM 1888 CG2 VAL B 17 -4.741 -4.904 4.077 1.00 1.08 C ATOM 0 H VAL B 17 -3.846 -6.586 2.143 1.00 0.97 H new ATOM 0 HA VAL B 17 -2.939 -6.704 4.791 1.00 0.92 H new ATOM 0 HB VAL B 17 -5.723 -6.792 3.655 1.00 1.04 H new ATOM 0 HG11 VAL B 17 -6.432 -5.965 5.897 1.00 1.12 H new ATOM 0 HG12 VAL B 17 -5.706 -7.586 5.999 1.00 1.12 H new ATOM 0 HG13 VAL B 17 -4.764 -6.156 6.486 1.00 1.12 H new ATOM 0 HG21 VAL B 17 -5.669 -4.350 4.219 1.00 1.08 H new ATOM 0 HG22 VAL B 17 -3.985 -4.527 4.766 1.00 1.08 H new ATOM 0 HG23 VAL B 17 -4.395 -4.775 3.052 1.00 1.08 H new ATOM 1898 N THR B 18 -4.254 -9.509 3.657 1.00 0.96 N ATOM 1899 CA THR B 18 -4.479 -10.925 3.845 1.00 1.10 C ATOM 1900 C THR B 18 -3.234 -11.602 4.377 1.00 0.89 C ATOM 1901 O THR B 18 -3.146 -12.088 5.502 1.00 1.02 O ATOM 1902 CB THR B 18 -5.804 -11.189 4.541 1.00 1.72 C ATOM 1903 OG1 THR B 18 -6.089 -12.565 4.428 1.00 1.54 O ATOM 1904 CG2 THR B 18 -6.825 -10.392 3.725 1.00 3.29 C ATOM 0 H THR B 18 -4.473 -9.209 2.707 1.00 0.96 H new ATOM 0 HA THR B 18 -4.628 -11.429 2.890 1.00 1.10 H new ATOM 0 HB THR B 18 -5.807 -10.912 5.595 1.00 1.72 H new ATOM 0 HG1 THR B 18 -6.940 -12.760 4.872 1.00 1.54 H new ATOM 0 HG21 THR B 18 -7.817 -10.523 4.156 1.00 3.29 H new ATOM 0 HG22 THR B 18 -6.559 -9.335 3.742 1.00 3.29 H new ATOM 0 HG23 THR B 18 -6.827 -10.750 2.695 1.00 3.29 H new ATOM 1912 N THR B 19 -2.245 -11.524 3.500 1.00 0.78 N ATOM 1913 CA THR B 19 -0.888 -11.977 3.642 1.00 0.78 C ATOM 1914 C THR B 19 -0.284 -11.435 4.939 1.00 0.77 C ATOM 1915 O THR B 19 0.110 -12.213 5.807 1.00 0.89 O ATOM 1916 CB THR B 19 -0.196 -11.471 2.375 1.00 0.86 C ATOM 1917 OG1 THR B 19 -0.742 -12.138 1.256 1.00 0.85 O ATOM 1918 CG2 THR B 19 1.318 -11.666 2.382 1.00 1.02 C ATOM 0 H THR B 19 -2.398 -11.099 2.585 1.00 0.78 H new ATOM 0 HA THR B 19 -0.783 -13.059 3.728 1.00 0.78 H new ATOM 0 HB THR B 19 -0.373 -10.396 2.328 1.00 0.86 H new ATOM 0 HG1 THR B 19 -1.530 -11.650 0.937 1.00 0.85 H new ATOM 0 HG21 THR B 19 1.738 -11.283 1.452 1.00 1.02 H new ATOM 0 HG22 THR B 19 1.750 -11.126 3.225 1.00 1.02 H new ATOM 0 HG23 THR B 19 1.548 -12.728 2.474 1.00 1.02 H new ATOM 1926 N PHE B 20 -0.223 -10.109 5.093 1.00 0.70 N ATOM 1927 CA PHE B 20 0.358 -9.516 6.288 1.00 0.77 C ATOM 1928 C PHE B 20 -0.385 -9.981 7.542 1.00 0.75 C ATOM 1929 O PHE B 20 0.237 -10.505 8.455 1.00 0.81 O ATOM 1930 CB PHE B 20 0.423 -7.985 6.177 1.00 1.06 C ATOM 1931 CG PHE B 20 1.689 -7.484 5.501 1.00 2.82 C ATOM 1932 CD1 PHE B 20 1.796 -7.474 4.098 1.00 4.51 C ATOM 1933 CD2 PHE B 20 2.794 -7.092 6.283 1.00 3.81 C ATOM 1934 CE1 PHE B 20 2.981 -7.035 3.481 1.00 6.50 C ATOM 1935 CE2 PHE B 20 3.975 -6.646 5.667 1.00 5.66 C ATOM 1936 CZ PHE B 20 4.063 -6.604 4.266 1.00 6.89 C ATOM 0 H PHE B 20 -0.567 -9.436 4.408 1.00 0.70 H new ATOM 0 HA PHE B 20 1.387 -9.864 6.378 1.00 0.77 H new ATOM 0 HB2 PHE B 20 -0.443 -7.631 5.618 1.00 1.06 H new ATOM 0 HB3 PHE B 20 0.357 -7.552 7.175 1.00 1.06 H new ATOM 0 HD1 PHE B 20 0.965 -7.805 3.493 1.00 4.51 H new ATOM 0 HD2 PHE B 20 2.733 -7.135 7.360 1.00 3.81 H new ATOM 0 HE1 PHE B 20 3.059 -7.029 2.404 1.00 6.50 H new ATOM 0 HE2 PHE B 20 4.815 -6.335 6.271 1.00 5.66 H new ATOM 0 HZ PHE B 20 4.963 -6.240 3.792 1.00 6.89 H new ATOM 1946 N PHE B 21 -1.704 -9.807 7.598 1.00 0.89 N ATOM 1947 CA PHE B 21 -2.541 -10.130 8.750 1.00 1.06 C ATOM 1948 C PHE B 21 -2.418 -11.600 9.145 1.00 1.18 C ATOM 1949 O PHE B 21 -2.266 -11.902 10.327 1.00 1.26 O ATOM 1950 CB PHE B 21 -3.995 -9.738 8.446 1.00 1.44 C ATOM 1951 CG PHE B 21 -4.951 -9.739 9.623 1.00 1.61 C ATOM 1952 CD1 PHE B 21 -5.007 -8.612 10.463 1.00 2.80 C ATOM 1953 CD2 PHE B 21 -5.941 -10.736 9.729 1.00 2.06 C ATOM 1954 CE1 PHE B 21 -6.032 -8.485 11.415 1.00 3.17 C ATOM 1955 CE2 PHE B 21 -6.988 -10.592 10.658 1.00 2.47 C ATOM 1956 CZ PHE B 21 -7.028 -9.472 11.509 1.00 2.58 C ATOM 0 H PHE B 21 -2.236 -9.425 6.816 1.00 0.89 H new ATOM 0 HA PHE B 21 -2.195 -9.556 9.610 1.00 1.06 H new ATOM 0 HB2 PHE B 21 -3.996 -8.741 8.006 1.00 1.44 H new ATOM 0 HB3 PHE B 21 -4.383 -10.421 7.690 1.00 1.44 H new ATOM 0 HD1 PHE B 21 -4.257 -7.840 10.375 1.00 2.80 H new ATOM 0 HD2 PHE B 21 -5.896 -11.611 9.097 1.00 2.06 H new ATOM 0 HE1 PHE B 21 -6.055 -7.630 12.074 1.00 3.17 H new ATOM 0 HE2 PHE B 21 -7.762 -11.342 10.718 1.00 2.47 H new ATOM 0 HZ PHE B 21 -7.823 -9.371 12.233 1.00 2.58 H new ATOM 1966 N THR B 22 -2.471 -12.524 8.181 1.00 1.31 N ATOM 1967 CA THR B 22 -2.297 -13.933 8.499 1.00 1.56 C ATOM 1968 C THR B 22 -0.866 -14.161 8.998 1.00 1.46 C ATOM 1969 O THR B 22 -0.678 -14.652 10.109 1.00 1.66 O ATOM 1970 CB THR B 22 -2.758 -14.853 7.349 1.00 1.88 C ATOM 1971 OG1 THR B 22 -3.033 -16.141 7.860 1.00 3.09 O ATOM 1972 CG2 THR B 22 -1.770 -15.019 6.192 1.00 1.65 C ATOM 0 H THR B 22 -2.630 -12.322 7.194 1.00 1.31 H new ATOM 0 HA THR B 22 -2.958 -14.220 9.317 1.00 1.56 H new ATOM 0 HB THR B 22 -3.637 -14.356 6.938 1.00 1.88 H new ATOM 0 HG1 THR B 22 -3.328 -16.726 7.131 1.00 3.09 H new ATOM 0 HG21 THR B 22 -2.197 -15.685 5.442 1.00 1.65 H new ATOM 0 HG22 THR B 22 -1.570 -14.047 5.742 1.00 1.65 H new ATOM 0 HG23 THR B 22 -0.839 -15.444 6.567 1.00 1.65 H new ATOM 1980 N PHE B 23 0.151 -13.730 8.243 1.00 1.33 N ATOM 1981 CA PHE B 23 1.549 -13.920 8.625 1.00 1.45 C ATOM 1982 C PHE B 23 1.824 -13.336 10.015 1.00 1.27 C ATOM 1983 O PHE B 23 2.533 -13.917 10.829 1.00 1.45 O ATOM 1984 CB PHE B 23 2.466 -13.289 7.569 1.00 1.57 C ATOM 1985 CG PHE B 23 3.892 -13.802 7.614 1.00 1.29 C ATOM 1986 CD1 PHE B 23 4.781 -13.368 8.615 1.00 2.47 C ATOM 1987 CD2 PHE B 23 4.307 -14.776 6.687 1.00 2.29 C ATOM 1988 CE1 PHE B 23 6.060 -13.945 8.718 1.00 3.54 C ATOM 1989 CE2 PHE B 23 5.597 -15.320 6.767 1.00 2.81 C ATOM 1990 CZ PHE B 23 6.466 -14.924 7.797 1.00 3.29 C ATOM 0 H PHE B 23 0.026 -13.243 7.356 1.00 1.33 H new ATOM 0 HA PHE B 23 1.757 -14.989 8.674 1.00 1.45 H new ATOM 0 HB2 PHE B 23 2.051 -13.481 6.579 1.00 1.57 H new ATOM 0 HB3 PHE B 23 2.474 -12.208 7.707 1.00 1.57 H new ATOM 0 HD1 PHE B 23 4.481 -12.592 9.304 1.00 2.47 H new ATOM 0 HD2 PHE B 23 3.630 -15.105 5.912 1.00 2.29 H new ATOM 0 HE1 PHE B 23 6.730 -13.635 9.506 1.00 3.54 H new ATOM 0 HE2 PHE B 23 5.923 -16.045 6.035 1.00 2.81 H new ATOM 0 HZ PHE B 23 7.445 -15.372 7.880 1.00 3.29 H new ATOM 2000 N ALA B 24 1.219 -12.187 10.304 1.00 1.03 N ATOM 2001 CA ALA B 24 1.322 -11.430 11.533 1.00 1.01 C ATOM 2002 C ALA B 24 0.943 -12.288 12.720 1.00 1.09 C ATOM 2003 O ALA B 24 1.365 -11.957 13.826 1.00 1.14 O ATOM 2004 CB ALA B 24 0.415 -10.195 11.500 1.00 0.90 C ATOM 0 H ALA B 24 0.600 -11.734 9.631 1.00 1.03 H new ATOM 0 HA ALA B 24 2.359 -11.107 11.631 1.00 1.01 H new ATOM 0 HB1 ALA B 24 0.514 -9.646 12.437 1.00 0.90 H new ATOM 0 HB2 ALA B 24 0.706 -9.552 10.670 1.00 0.90 H new ATOM 0 HB3 ALA B 24 -0.621 -10.508 11.370 1.00 0.90 H new ATOM 2010 N ARG B 25 0.144 -13.340 12.532 1.00 1.12 N ATOM 2011 CA ARG B 25 -0.177 -14.247 13.618 1.00 1.19 C ATOM 2012 C ARG B 25 1.074 -14.876 14.220 1.00 1.29 C ATOM 2013 O ARG B 25 0.961 -15.465 15.293 1.00 1.51 O ATOM 2014 CB ARG B 25 -1.193 -15.314 13.173 1.00 1.29 C ATOM 2015 CG ARG B 25 -0.608 -16.482 12.352 1.00 1.71 C ATOM 2016 CD ARG B 25 -0.561 -17.846 13.066 1.00 1.91 C ATOM 2017 NE ARG B 25 0.398 -17.904 14.188 1.00 2.30 N ATOM 2018 CZ ARG B 25 1.019 -19.011 14.631 1.00 3.10 C ATOM 2019 NH1 ARG B 25 0.682 -20.210 14.142 1.00 3.48 N ATOM 2020 NH2 ARG B 25 1.967 -18.924 15.568 1.00 4.18 N ATOM 0 H ARG B 25 -0.288 -13.578 11.639 1.00 1.12 H new ATOM 0 HA ARG B 25 -0.645 -13.657 14.406 1.00 1.19 H new ATOM 0 HB2 ARG B 25 -1.678 -15.722 14.060 1.00 1.29 H new ATOM 0 HB3 ARG B 25 -1.969 -14.828 12.581 1.00 1.29 H new ATOM 0 HG2 ARG B 25 -1.195 -16.590 11.440 1.00 1.71 H new ATOM 0 HG3 ARG B 25 0.405 -16.217 12.049 1.00 1.71 H new ATOM 0 HD2 ARG B 25 -1.557 -18.083 13.440 1.00 1.91 H new ATOM 0 HD3 ARG B 25 -0.302 -18.616 12.340 1.00 1.91 H new ATOM 0 HE ARG B 25 0.607 -17.029 14.668 1.00 2.30 H new ATOM 0 HH11 ARG B 25 -0.047 -20.285 13.432 1.00 3.48 H new ATOM 0 HH12 ARG B 25 1.154 -21.049 14.479 1.00 3.48 H new ATOM 0 HH21 ARG B 25 2.223 -18.014 15.951 1.00 4.18 H new ATOM 0 HH22 ARG B 25 2.435 -19.767 15.900 1.00 4.18 H new ATOM 2034 N GLN B 26 2.212 -14.876 13.511 1.00 1.23 N ATOM 2035 CA GLN B 26 3.296 -15.790 13.831 1.00 1.25 C ATOM 2036 C GLN B 26 3.698 -15.783 15.313 1.00 1.33 C ATOM 2037 O GLN B 26 3.495 -16.781 16.005 1.00 1.40 O ATOM 2038 CB GLN B 26 4.510 -15.384 12.975 1.00 1.15 C ATOM 2039 CG GLN B 26 5.218 -16.546 12.326 1.00 1.36 C ATOM 2040 CD GLN B 26 4.362 -17.226 11.260 1.00 1.55 C ATOM 2041 OE1 GLN B 26 3.772 -18.272 11.510 1.00 1.88 O ATOM 2042 NE2 GLN B 26 4.263 -16.634 10.072 1.00 2.11 N ATOM 0 H GLN B 26 2.396 -14.257 12.722 1.00 1.23 H new ATOM 0 HA GLN B 26 2.953 -16.802 13.618 1.00 1.25 H new ATOM 0 HB2 GLN B 26 4.180 -14.693 12.199 1.00 1.15 H new ATOM 0 HB3 GLN B 26 5.219 -14.844 13.602 1.00 1.15 H new ATOM 0 HG2 GLN B 26 6.146 -16.196 11.874 1.00 1.36 H new ATOM 0 HG3 GLN B 26 5.490 -17.275 13.089 1.00 1.36 H new ATOM 0 HE21 GLN B 26 4.765 -15.764 9.892 1.00 2.11 H new ATOM 0 HE22 GLN B 26 3.685 -17.050 9.342 1.00 2.11 H new ATOM 2051 N GLU B 27 4.267 -14.672 15.775 1.00 1.35 N ATOM 2052 CA GLU B 27 4.739 -14.457 17.131 1.00 1.30 C ATOM 2053 C GLU B 27 3.652 -13.868 18.028 1.00 1.39 C ATOM 2054 O GLU B 27 3.532 -14.233 19.194 1.00 1.15 O ATOM 2055 CB GLU B 27 6.022 -13.621 17.098 1.00 1.45 C ATOM 2056 CG GLU B 27 7.162 -14.351 16.365 1.00 1.77 C ATOM 2057 CD GLU B 27 8.439 -13.514 16.424 1.00 2.29 C ATOM 2058 OE1 GLU B 27 8.329 -12.289 16.191 1.00 2.49 O ATOM 2059 OE2 GLU B 27 9.491 -14.099 16.753 1.00 3.72 O ATOM 0 H GLU B 27 4.417 -13.858 15.179 1.00 1.35 H new ATOM 0 HA GLU B 27 4.983 -15.418 17.583 1.00 1.30 H new ATOM 0 HB2 GLU B 27 5.823 -12.670 16.604 1.00 1.45 H new ATOM 0 HB3 GLU B 27 6.333 -13.392 18.117 1.00 1.45 H new ATOM 0 HG2 GLU B 27 7.334 -15.326 16.822 1.00 1.77 H new ATOM 0 HG3 GLU B 27 6.882 -14.531 15.327 1.00 1.77 H new ATOM 2066 N GLY B 28 2.944 -12.868 17.487 1.00 2.12 N ATOM 2067 CA GLY B 28 2.074 -11.984 18.266 1.00 1.96 C ATOM 2068 C GLY B 28 0.749 -12.639 18.683 1.00 2.08 C ATOM 2069 O GLY B 28 0.727 -13.815 19.025 1.00 3.75 O ATOM 0 H GLY B 28 2.960 -12.650 16.491 1.00 2.12 H new ATOM 0 HA2 GLY B 28 2.606 -11.659 19.160 1.00 1.96 H new ATOM 0 HA3 GLY B 28 1.860 -11.090 17.680 1.00 1.96 H new ATOM 2073 N ARG B 29 -0.400 -11.949 18.726 1.00 1.83 N ATOM 2074 CA ARG B 29 -0.857 -10.772 17.989 1.00 1.58 C ATOM 2075 C ARG B 29 -0.673 -10.919 16.490 1.00 1.46 C ATOM 2076 O ARG B 29 0.401 -10.616 15.957 1.00 1.46 O ATOM 2077 CB ARG B 29 -0.319 -9.410 18.440 1.00 1.58 C ATOM 2078 CG ARG B 29 -0.324 -9.228 19.961 1.00 2.02 C ATOM 2079 CD ARG B 29 0.004 -7.771 20.329 1.00 1.91 C ATOM 2080 NE ARG B 29 -0.568 -7.393 21.635 1.00 2.58 N ATOM 2081 CZ ARG B 29 -1.853 -7.059 21.846 1.00 2.73 C ATOM 2082 NH1 ARG B 29 -2.723 -7.093 20.829 1.00 3.25 N ATOM 2083 NH2 ARG B 29 -2.266 -6.701 23.066 1.00 3.58 N ATOM 0 H ARG B 29 -1.129 -12.252 19.372 1.00 1.83 H new ATOM 0 HA ARG B 29 -1.916 -10.754 18.245 1.00 1.58 H new ATOM 0 HB2 ARG B 29 0.699 -9.289 18.070 1.00 1.58 H new ATOM 0 HB3 ARG B 29 -0.919 -8.622 17.985 1.00 1.58 H new ATOM 0 HG2 ARG B 29 -1.300 -9.500 20.363 1.00 2.02 H new ATOM 0 HG3 ARG B 29 0.406 -9.898 20.416 1.00 2.02 H new ATOM 0 HD2 ARG B 29 1.085 -7.637 20.354 1.00 1.91 H new ATOM 0 HD3 ARG B 29 -0.382 -7.105 19.557 1.00 1.91 H new ATOM 0 HE ARG B 29 0.059 -7.384 22.439 1.00 2.58 H new ATOM 0 HH11 ARG B 29 -2.410 -7.371 19.899 1.00 3.25 H new ATOM 0 HH12 ARG B 29 -3.699 -6.840 20.984 1.00 3.25 H new ATOM 0 HH21 ARG B 29 -1.605 -6.680 23.843 1.00 3.58 H new ATOM 0 HH22 ARG B 29 -3.242 -6.449 23.220 1.00 3.58 H new ATOM 2097 N LYS B 30 -1.757 -11.269 15.801 1.00 1.49 N ATOM 2098 CA LYS B 30 -1.906 -10.803 14.440 1.00 1.22 C ATOM 2099 C LYS B 30 -2.081 -9.275 14.445 1.00 1.10 C ATOM 2100 O LYS B 30 -2.010 -8.630 15.490 1.00 2.60 O ATOM 2101 CB LYS B 30 -3.031 -11.574 13.730 1.00 1.66 C ATOM 2102 CG LYS B 30 -4.436 -11.347 14.307 1.00 1.90 C ATOM 2103 CD LYS B 30 -5.497 -12.059 13.450 1.00 2.65 C ATOM 2104 CE LYS B 30 -5.462 -13.597 13.484 1.00 3.80 C ATOM 2105 NZ LYS B 30 -5.768 -14.153 14.819 1.00 3.85 N ATOM 0 H LYS B 30 -2.516 -11.853 16.153 1.00 1.49 H new ATOM 0 HA LYS B 30 -1.008 -11.008 13.857 1.00 1.22 H new ATOM 0 HB2 LYS B 30 -3.037 -11.291 12.677 1.00 1.66 H new ATOM 0 HB3 LYS B 30 -2.804 -12.639 13.773 1.00 1.66 H new ATOM 0 HG2 LYS B 30 -4.479 -11.719 15.331 1.00 1.90 H new ATOM 0 HG3 LYS B 30 -4.650 -10.279 14.347 1.00 1.90 H new ATOM 0 HD2 LYS B 30 -6.483 -11.729 13.778 1.00 2.65 H new ATOM 0 HD3 LYS B 30 -5.380 -11.734 12.416 1.00 2.65 H new ATOM 0 HE2 LYS B 30 -6.179 -13.987 12.761 1.00 3.80 H new ATOM 0 HE3 LYS B 30 -4.475 -13.939 13.171 1.00 3.80 H new ATOM 0 HZ1 LYS B 30 -5.729 -15.192 14.780 1.00 3.85 H new ATOM 0 HZ2 LYS B 30 -5.070 -13.806 15.508 1.00 3.85 H new ATOM 0 HZ3 LYS B 30 -6.720 -13.853 15.110 1.00 3.85 H new ATOM 2119 N ASP B 31 -2.277 -8.712 13.258 1.00 1.91 N ATOM 2120 CA ASP B 31 -2.476 -7.295 12.966 1.00 1.82 C ATOM 2121 C ASP B 31 -1.137 -6.568 12.994 1.00 1.54 C ATOM 2122 O ASP B 31 -0.695 -6.045 11.974 1.00 1.66 O ATOM 2123 CB ASP B 31 -3.535 -6.643 13.871 1.00 2.13 C ATOM 2124 CG ASP B 31 -4.013 -5.310 13.309 1.00 3.10 C ATOM 2125 OD1 ASP B 31 -3.229 -4.332 13.321 1.00 3.92 O ATOM 2126 OD2 ASP B 31 -5.174 -5.258 12.842 1.00 4.15 O ATOM 0 H ASP B 31 -2.303 -9.277 12.409 1.00 1.91 H new ATOM 0 HA ASP B 31 -2.884 -7.208 11.959 1.00 1.82 H new ATOM 0 HB2 ASP B 31 -4.384 -7.317 13.981 1.00 2.13 H new ATOM 0 HB3 ASP B 31 -3.118 -6.490 14.867 1.00 2.13 H new ATOM 2131 N SER B 32 -0.452 -6.603 14.139 1.00 1.40 N ATOM 2132 CA SER B 32 0.872 -6.025 14.263 1.00 1.27 C ATOM 2133 C SER B 32 1.933 -7.051 13.877 1.00 1.17 C ATOM 2134 O SER B 32 1.894 -8.217 14.305 1.00 1.16 O ATOM 2135 CB SER B 32 1.085 -5.485 15.674 1.00 1.45 C ATOM 2136 OG SER B 32 0.783 -6.430 16.681 1.00 1.85 O ATOM 0 H SER B 32 -0.803 -7.031 14.996 1.00 1.40 H new ATOM 0 HA SER B 32 0.964 -5.184 13.576 1.00 1.27 H new ATOM 0 HB2 SER B 32 2.122 -5.167 15.782 1.00 1.45 H new ATOM 0 HB3 SER B 32 0.464 -4.601 15.816 1.00 1.45 H new ATOM 0 HG SER B 32 1.017 -6.060 17.558 1.00 1.85 H new ATOM 2142 N LEU B 33 2.905 -6.620 13.076 1.00 1.20 N ATOM 2143 CA LEU B 33 4.115 -7.379 12.844 1.00 1.14 C ATOM 2144 C LEU B 33 5.052 -7.091 14.021 1.00 1.27 C ATOM 2145 O LEU B 33 5.070 -5.986 14.547 1.00 1.45 O ATOM 2146 CB LEU B 33 4.729 -7.023 11.480 1.00 0.97 C ATOM 2147 CG LEU B 33 4.174 -7.819 10.283 1.00 1.08 C ATOM 2148 CD1 LEU B 33 4.614 -9.289 10.309 1.00 2.20 C ATOM 2149 CD2 LEU B 33 2.653 -7.706 10.178 1.00 1.56 C ATOM 0 H LEU B 33 2.868 -5.733 12.573 1.00 1.20 H new ATOM 0 HA LEU B 33 3.917 -8.450 12.797 1.00 1.14 H new ATOM 0 HB2 LEU B 33 4.571 -5.961 11.294 1.00 0.97 H new ATOM 0 HB3 LEU B 33 5.806 -7.180 11.532 1.00 0.97 H new ATOM 0 HG LEU B 33 4.603 -7.366 9.389 1.00 1.08 H new ATOM 0 HD11 LEU B 33 4.198 -9.809 9.446 1.00 2.20 H new ATOM 0 HD12 LEU B 33 5.702 -9.344 10.276 1.00 2.20 H new ATOM 0 HD13 LEU B 33 4.255 -9.760 11.224 1.00 2.20 H new ATOM 0 HD21 LEU B 33 2.304 -8.282 9.321 1.00 1.56 H new ATOM 0 HD22 LEU B 33 2.196 -8.095 11.088 1.00 1.56 H new ATOM 0 HD23 LEU B 33 2.374 -6.660 10.050 1.00 1.56 H new ATOM 2161 N SER B 34 5.782 -8.098 14.485 1.00 1.47 N ATOM 2162 CA SER B 34 6.924 -7.962 15.382 1.00 1.46 C ATOM 2163 C SER B 34 8.212 -7.870 14.575 1.00 1.19 C ATOM 2164 O SER B 34 8.192 -7.831 13.347 1.00 1.28 O ATOM 2165 CB SER B 34 6.950 -9.017 16.497 1.00 1.71 C ATOM 2166 OG SER B 34 7.768 -8.543 17.555 1.00 2.21 O ATOM 0 H SER B 34 5.588 -9.068 14.238 1.00 1.47 H new ATOM 0 HA SER B 34 6.820 -7.024 15.927 1.00 1.46 H new ATOM 0 HB2 SER B 34 5.940 -9.210 16.858 1.00 1.71 H new ATOM 0 HB3 SER B 34 7.337 -9.961 16.114 1.00 1.71 H new ATOM 0 HG SER B 34 8.502 -9.174 17.708 1.00 2.21 H new ATOM 2172 N VAL B 35 9.308 -7.907 15.324 1.00 1.27 N ATOM 2173 CA VAL B 35 10.717 -7.838 14.987 1.00 1.28 C ATOM 2174 C VAL B 35 10.863 -9.160 14.250 1.00 1.18 C ATOM 2175 O VAL B 35 10.497 -9.176 13.072 1.00 2.60 O ATOM 2176 CB VAL B 35 11.602 -7.647 16.230 1.00 2.03 C ATOM 2177 CG1 VAL B 35 13.090 -7.591 15.854 1.00 1.49 C ATOM 2178 CG2 VAL B 35 11.239 -6.316 16.900 1.00 3.52 C ATOM 0 H VAL B 35 9.205 -8.000 16.334 1.00 1.27 H new ATOM 0 HA VAL B 35 11.040 -6.986 14.389 1.00 1.28 H new ATOM 0 HB VAL B 35 11.432 -8.492 16.897 1.00 2.03 H new ATOM 0 HG11 VAL B 35 13.688 -7.455 16.755 1.00 1.49 H new ATOM 0 HG12 VAL B 35 13.377 -8.522 15.365 1.00 1.49 H new ATOM 0 HG13 VAL B 35 13.263 -6.756 15.175 1.00 1.49 H new ATOM 0 HG21 VAL B 35 11.862 -6.171 17.783 1.00 3.52 H new ATOM 0 HG22 VAL B 35 11.407 -5.498 16.199 1.00 3.52 H new ATOM 0 HG23 VAL B 35 10.190 -6.331 17.194 1.00 3.52 H new ATOM 2188 N ASN B 36 11.572 -10.183 14.713 1.00 1.13 N ATOM 2189 CA ASN B 36 11.789 -11.346 13.844 1.00 1.19 C ATOM 2190 C ASN B 36 10.520 -12.240 13.733 1.00 1.24 C ATOM 2191 O ASN B 36 10.579 -13.466 13.769 1.00 1.82 O ATOM 2192 CB ASN B 36 12.972 -12.138 14.419 1.00 1.76 C ATOM 2193 CG ASN B 36 13.667 -12.961 13.340 1.00 2.28 C ATOM 2194 OD1 ASN B 36 14.744 -12.600 12.866 1.00 2.90 O ATOM 2195 ND2 ASN B 36 13.052 -14.043 12.896 1.00 2.39 N ATOM 0 H ASN B 36 11.992 -10.239 15.641 1.00 1.13 H new ATOM 0 HA ASN B 36 12.007 -11.009 12.831 1.00 1.19 H new ATOM 0 HB2 ASN B 36 13.687 -11.450 14.871 1.00 1.76 H new ATOM 0 HB3 ASN B 36 12.619 -12.798 15.212 1.00 1.76 H new ATOM 0 HD21 ASN B 36 13.469 -14.596 12.147 1.00 2.39 H new ATOM 0 HD22 ASN B 36 12.160 -14.325 13.302 1.00 2.39 H new ATOM 2202 N GLU B 37 9.419 -11.581 13.357 1.00 1.14 N ATOM 2203 CA GLU B 37 8.242 -11.991 12.620 1.00 1.21 C ATOM 2204 C GLU B 37 8.431 -11.364 11.237 1.00 1.19 C ATOM 2205 O GLU B 37 8.493 -12.051 10.220 1.00 1.45 O ATOM 2206 CB GLU B 37 7.010 -11.352 13.299 1.00 1.16 C ATOM 2207 CG GLU B 37 5.800 -12.272 13.408 1.00 0.87 C ATOM 2208 CD GLU B 37 4.675 -11.573 14.162 1.00 0.93 C ATOM 2209 OE1 GLU B 37 4.460 -10.359 13.971 1.00 1.35 O ATOM 2210 OE2 GLU B 37 3.894 -12.151 14.952 1.00 1.66 O ATOM 0 H GLU B 37 9.333 -10.596 13.608 1.00 1.14 H new ATOM 0 HA GLU B 37 8.106 -13.072 12.576 1.00 1.21 H new ATOM 0 HB2 GLU B 37 7.292 -11.023 14.299 1.00 1.16 H new ATOM 0 HB3 GLU B 37 6.724 -10.461 12.740 1.00 1.16 H new ATOM 0 HG2 GLU B 37 5.459 -12.556 12.412 1.00 0.87 H new ATOM 0 HG3 GLU B 37 6.078 -13.191 13.924 1.00 0.87 H new ATOM 2217 N PHE B 38 8.569 -10.032 11.211 1.00 0.95 N ATOM 2218 CA PHE B 38 8.731 -9.265 9.995 1.00 0.93 C ATOM 2219 C PHE B 38 9.952 -9.753 9.225 1.00 0.83 C ATOM 2220 O PHE B 38 9.880 -9.881 8.005 1.00 0.82 O ATOM 2221 CB PHE B 38 8.820 -7.775 10.332 1.00 0.93 C ATOM 2222 CG PHE B 38 8.712 -6.861 9.132 1.00 0.96 C ATOM 2223 CD1 PHE B 38 9.818 -6.688 8.285 1.00 1.82 C ATOM 2224 CD2 PHE B 38 7.509 -6.180 8.862 1.00 2.13 C ATOM 2225 CE1 PHE B 38 9.733 -5.827 7.181 1.00 2.04 C ATOM 2226 CE2 PHE B 38 7.420 -5.329 7.751 1.00 2.17 C ATOM 2227 CZ PHE B 38 8.530 -5.156 6.914 1.00 1.40 C ATOM 0 H PHE B 38 8.570 -9.459 12.055 1.00 0.95 H new ATOM 0 HA PHE B 38 7.864 -9.408 9.351 1.00 0.93 H new ATOM 0 HB2 PHE B 38 8.027 -7.525 11.037 1.00 0.93 H new ATOM 0 HB3 PHE B 38 9.767 -7.584 10.836 1.00 0.93 H new ATOM 0 HD1 PHE B 38 10.737 -7.219 8.484 1.00 1.82 H new ATOM 0 HD2 PHE B 38 6.656 -6.313 9.510 1.00 2.13 H new ATOM 0 HE1 PHE B 38 10.589 -5.681 6.539 1.00 2.04 H new ATOM 0 HE2 PHE B 38 6.498 -4.808 7.541 1.00 2.17 H new ATOM 0 HZ PHE B 38 8.459 -4.502 6.058 1.00 1.40 H new ATOM 2237 N LYS B 39 11.061 -10.075 9.906 1.00 0.81 N ATOM 2238 CA LYS B 39 12.230 -10.550 9.175 1.00 0.79 C ATOM 2239 C LYS B 39 11.870 -11.793 8.367 1.00 0.79 C ATOM 2240 O LYS B 39 12.313 -11.962 7.232 1.00 0.79 O ATOM 2241 CB LYS B 39 13.456 -10.785 10.061 1.00 0.83 C ATOM 2242 CG LYS B 39 14.680 -10.939 9.138 1.00 0.81 C ATOM 2243 CD LYS B 39 16.001 -11.007 9.914 1.00 1.07 C ATOM 2244 CE LYS B 39 16.620 -12.408 9.853 1.00 2.78 C ATOM 2245 NZ LYS B 39 15.785 -13.430 10.531 1.00 4.63 N ATOM 0 H LYS B 39 11.168 -10.017 10.919 1.00 0.81 H new ATOM 0 HA LYS B 39 12.524 -9.753 8.492 1.00 0.79 H new ATOM 0 HB2 LYS B 39 13.597 -9.950 10.747 1.00 0.83 H new ATOM 0 HB3 LYS B 39 13.322 -11.679 10.670 1.00 0.83 H new ATOM 0 HG2 LYS B 39 14.568 -11.843 8.540 1.00 0.81 H new ATOM 0 HG3 LYS B 39 14.714 -10.100 8.443 1.00 0.81 H new ATOM 0 HD2 LYS B 39 16.702 -10.281 9.504 1.00 1.07 H new ATOM 0 HD3 LYS B 39 15.827 -10.730 10.954 1.00 1.07 H new ATOM 0 HE2 LYS B 39 16.762 -12.693 8.811 1.00 2.78 H new ATOM 0 HE3 LYS B 39 17.607 -12.386 10.315 1.00 2.78 H new ATOM 0 HZ1 LYS B 39 16.320 -14.318 10.611 1.00 4.63 H new ATOM 0 HZ2 LYS B 39 15.528 -13.094 11.481 1.00 4.63 H new ATOM 0 HZ3 LYS B 39 14.920 -13.595 9.977 1.00 4.63 H new ATOM 2259 N GLU B 40 11.020 -12.640 8.934 1.00 0.81 N ATOM 2260 CA GLU B 40 10.579 -13.846 8.279 1.00 0.88 C ATOM 2261 C GLU B 40 9.588 -13.523 7.166 1.00 0.92 C ATOM 2262 O GLU B 40 9.515 -14.257 6.184 1.00 0.91 O ATOM 2263 CB GLU B 40 10.070 -14.833 9.333 1.00 1.34 C ATOM 2264 CG GLU B 40 11.132 -14.957 10.445 1.00 1.56 C ATOM 2265 CD GLU B 40 12.536 -15.251 9.911 1.00 3.40 C ATOM 2266 OE1 GLU B 40 12.661 -16.195 9.106 1.00 4.14 O ATOM 2267 OE2 GLU B 40 13.471 -14.510 10.304 1.00 4.90 O ATOM 0 H GLU B 40 10.621 -12.502 9.863 1.00 0.81 H new ATOM 0 HA GLU B 40 11.408 -14.341 7.773 1.00 0.88 H new ATOM 0 HB2 GLU B 40 9.124 -14.487 9.750 1.00 1.34 H new ATOM 0 HB3 GLU B 40 9.881 -15.806 8.880 1.00 1.34 H new ATOM 0 HG2 GLU B 40 11.156 -14.031 11.020 1.00 1.56 H new ATOM 0 HG3 GLU B 40 10.838 -15.751 11.132 1.00 1.56 H new ATOM 2274 N LEU B 41 8.881 -12.394 7.260 1.00 1.08 N ATOM 2275 CA LEU B 41 8.037 -11.930 6.177 1.00 1.18 C ATOM 2276 C LEU B 41 8.929 -11.528 5.007 1.00 1.09 C ATOM 2277 O LEU B 41 8.689 -11.969 3.885 1.00 1.11 O ATOM 2278 CB LEU B 41 7.103 -10.803 6.650 1.00 1.44 C ATOM 2279 CG LEU B 41 6.096 -10.374 5.568 1.00 1.50 C ATOM 2280 CD1 LEU B 41 4.753 -10.016 6.211 1.00 2.69 C ATOM 2281 CD2 LEU B 41 6.602 -9.161 4.775 1.00 1.68 C ATOM 0 H LEU B 41 8.882 -11.789 8.081 1.00 1.08 H new ATOM 0 HA LEU B 41 7.376 -12.728 5.838 1.00 1.18 H new ATOM 0 HB2 LEU B 41 6.560 -11.134 7.535 1.00 1.44 H new ATOM 0 HB3 LEU B 41 7.701 -9.941 6.946 1.00 1.44 H new ATOM 0 HG LEU B 41 5.975 -11.214 4.884 1.00 1.50 H new ATOM 0 HD11 LEU B 41 4.048 -9.714 5.437 1.00 2.69 H new ATOM 0 HD12 LEU B 41 4.360 -10.884 6.741 1.00 2.69 H new ATOM 0 HD13 LEU B 41 4.894 -9.195 6.914 1.00 2.69 H new ATOM 0 HD21 LEU B 41 5.865 -8.887 4.020 1.00 1.68 H new ATOM 0 HD22 LEU B 41 6.757 -8.322 5.453 1.00 1.68 H new ATOM 0 HD23 LEU B 41 7.544 -9.412 4.288 1.00 1.68 H new ATOM 2293 N VAL B 42 9.975 -10.728 5.254 1.00 1.03 N ATOM 2294 CA VAL B 42 10.836 -10.273 4.166 1.00 0.98 C ATOM 2295 C VAL B 42 11.559 -11.469 3.561 1.00 0.90 C ATOM 2296 O VAL B 42 11.492 -11.698 2.358 1.00 1.12 O ATOM 2297 CB VAL B 42 11.762 -9.095 4.535 1.00 0.88 C ATOM 2298 CG1 VAL B 42 10.984 -7.775 4.460 1.00 0.88 C ATOM 2299 CG2 VAL B 42 12.474 -9.169 5.877 1.00 0.81 C ATOM 0 H VAL B 42 10.238 -10.391 6.180 1.00 1.03 H new ATOM 0 HA VAL B 42 10.200 -9.836 3.396 1.00 0.98 H new ATOM 0 HB VAL B 42 12.559 -9.155 3.794 1.00 0.88 H new ATOM 0 HG11 VAL B 42 11.644 -6.948 4.722 1.00 0.88 H new ATOM 0 HG12 VAL B 42 10.607 -7.632 3.447 1.00 0.88 H new ATOM 0 HG13 VAL B 42 10.147 -7.806 5.158 1.00 0.88 H new ATOM 0 HG21 VAL B 42 13.091 -8.281 6.011 1.00 0.81 H new ATOM 0 HG22 VAL B 42 11.736 -9.223 6.678 1.00 0.81 H new ATOM 0 HG23 VAL B 42 13.106 -10.057 5.905 1.00 0.81 H new ATOM 2309 N THR B 43 12.193 -12.269 4.413 1.00 0.71 N ATOM 2310 CA THR B 43 12.871 -13.491 4.019 1.00 0.69 C ATOM 2311 C THR B 43 11.961 -14.395 3.179 1.00 0.77 C ATOM 2312 O THR B 43 12.333 -14.794 2.078 1.00 0.89 O ATOM 2313 CB THR B 43 13.362 -14.176 5.297 1.00 0.65 C ATOM 2314 OG1 THR B 43 14.284 -13.330 5.956 1.00 0.66 O ATOM 2315 CG2 THR B 43 14.042 -15.523 5.042 1.00 0.76 C ATOM 0 H THR B 43 12.249 -12.079 5.414 1.00 0.71 H new ATOM 0 HA THR B 43 13.722 -13.266 3.376 1.00 0.69 H new ATOM 0 HB THR B 43 12.479 -14.364 5.907 1.00 0.65 H new ATOM 0 HG1 THR B 43 13.798 -12.694 6.521 1.00 0.66 H new ATOM 0 HG21 THR B 43 14.365 -15.953 5.990 1.00 0.76 H new ATOM 0 HG22 THR B 43 13.338 -16.200 4.558 1.00 0.76 H new ATOM 0 HG23 THR B 43 14.908 -15.377 4.396 1.00 0.76 H new ATOM 2323 N GLN B 44 10.795 -14.763 3.715 1.00 0.78 N ATOM 2324 CA GLN B 44 9.955 -15.786 3.115 1.00 0.84 C ATOM 2325 C GLN B 44 9.119 -15.228 1.958 1.00 1.07 C ATOM 2326 O GLN B 44 9.117 -15.789 0.866 1.00 1.21 O ATOM 2327 CB GLN B 44 9.091 -16.419 4.215 1.00 0.86 C ATOM 2328 CG GLN B 44 8.448 -17.734 3.752 1.00 0.94 C ATOM 2329 CD GLN B 44 7.493 -18.325 4.787 1.00 1.21 C ATOM 2330 OE1 GLN B 44 6.625 -19.123 4.452 1.00 1.77 O ATOM 2331 NE2 GLN B 44 7.636 -17.957 6.058 1.00 1.61 N ATOM 0 H GLN B 44 10.414 -14.360 4.571 1.00 0.78 H new ATOM 0 HA GLN B 44 10.581 -16.561 2.673 1.00 0.84 H new ATOM 0 HB2 GLN B 44 9.705 -16.605 5.096 1.00 0.86 H new ATOM 0 HB3 GLN B 44 8.311 -15.718 4.512 1.00 0.86 H new ATOM 0 HG2 GLN B 44 7.906 -17.560 2.822 1.00 0.94 H new ATOM 0 HG3 GLN B 44 9.232 -18.459 3.533 1.00 0.94 H new ATOM 0 HE21 GLN B 44 8.364 -17.292 6.317 1.00 1.61 H new ATOM 0 HE22 GLN B 44 7.017 -18.340 6.773 1.00 1.61 H new ATOM 2340 N GLN B 45 8.358 -14.162 2.214 1.00 1.21 N ATOM 2341 CA GLN B 45 7.284 -13.731 1.326 1.00 1.50 C ATOM 2342 C GLN B 45 7.773 -12.933 0.118 1.00 1.58 C ATOM 2343 O GLN B 45 7.213 -13.089 -0.962 1.00 1.91 O ATOM 2344 CB GLN B 45 6.224 -12.939 2.108 1.00 1.71 C ATOM 2345 CG GLN B 45 5.680 -13.696 3.329 1.00 2.63 C ATOM 2346 CD GLN B 45 5.143 -15.077 2.975 1.00 2.47 C ATOM 2347 OE1 GLN B 45 5.635 -16.083 3.472 1.00 3.57 O ATOM 2348 NE2 GLN B 45 4.131 -15.141 2.115 1.00 2.19 N ATOM 0 H GLN B 45 8.471 -13.576 3.042 1.00 1.21 H new ATOM 0 HA GLN B 45 6.835 -14.640 0.925 1.00 1.50 H new ATOM 0 HB2 GLN B 45 6.656 -11.994 2.438 1.00 1.71 H new ATOM 0 HB3 GLN B 45 5.397 -12.696 1.441 1.00 1.71 H new ATOM 0 HG2 GLN B 45 6.473 -13.798 4.070 1.00 2.63 H new ATOM 0 HG3 GLN B 45 4.886 -13.109 3.790 1.00 2.63 H new ATOM 0 HE21 GLN B 45 3.744 -14.285 1.719 1.00 2.19 H new ATOM 0 HE22 GLN B 45 3.742 -16.046 1.852 1.00 2.19 H new ATOM 2357 N LEU B 46 8.754 -12.038 0.287 1.00 1.31 N ATOM 2358 CA LEU B 46 9.096 -11.066 -0.757 1.00 1.21 C ATOM 2359 C LEU B 46 9.403 -11.734 -2.101 1.00 1.61 C ATOM 2360 O LEU B 46 8.902 -11.266 -3.117 1.00 2.08 O ATOM 2361 CB LEU B 46 10.179 -10.083 -0.293 1.00 0.94 C ATOM 2362 CG LEU B 46 9.626 -8.898 0.523 1.00 1.32 C ATOM 2363 CD1 LEU B 46 9.185 -7.770 -0.410 1.00 1.64 C ATOM 2364 CD2 LEU B 46 8.436 -9.226 1.436 1.00 2.06 C ATOM 0 H LEU B 46 9.322 -11.967 1.132 1.00 1.31 H new ATOM 0 HA LEU B 46 8.207 -10.461 -0.938 1.00 1.21 H new ATOM 0 HB2 LEU B 46 10.911 -10.620 0.311 1.00 0.94 H new ATOM 0 HB3 LEU B 46 10.707 -9.698 -1.166 1.00 0.94 H new ATOM 0 HG LEU B 46 10.457 -8.609 1.166 1.00 1.32 H new ATOM 0 HD11 LEU B 46 8.797 -6.940 0.181 1.00 1.64 H new ATOM 0 HD12 LEU B 46 10.038 -7.430 -0.998 1.00 1.64 H new ATOM 0 HD13 LEU B 46 8.406 -8.135 -1.079 1.00 1.64 H new ATOM 0 HD21 LEU B 46 8.124 -8.325 1.965 1.00 2.06 H new ATOM 0 HD22 LEU B 46 7.607 -9.599 0.834 1.00 2.06 H new ATOM 0 HD23 LEU B 46 8.731 -9.987 2.159 1.00 2.06 H new ATOM 2376 N PRO B 47 10.140 -12.854 -2.130 1.00 1.77 N ATOM 2377 CA PRO B 47 11.332 -13.104 -1.339 1.00 2.10 C ATOM 2378 C PRO B 47 12.449 -12.207 -1.886 1.00 1.98 C ATOM 2379 O PRO B 47 13.062 -11.435 -1.155 1.00 2.39 O ATOM 2380 CB PRO B 47 11.667 -14.592 -1.541 1.00 2.36 C ATOM 2381 CG PRO B 47 10.544 -15.158 -2.418 1.00 2.63 C ATOM 2382 CD PRO B 47 9.891 -13.936 -3.060 1.00 2.09 C ATOM 0 HA PRO B 47 11.203 -12.888 -0.278 1.00 2.10 H new ATOM 0 HB2 PRO B 47 12.637 -14.712 -2.022 1.00 2.36 H new ATOM 0 HB3 PRO B 47 11.718 -15.114 -0.586 1.00 2.36 H new ATOM 0 HG2 PRO B 47 10.938 -15.838 -3.174 1.00 2.63 H new ATOM 0 HG3 PRO B 47 9.826 -15.723 -1.824 1.00 2.63 H new ATOM 0 HD2 PRO B 47 10.323 -13.724 -4.038 1.00 2.09 H new ATOM 0 HD3 PRO B 47 8.823 -14.091 -3.210 1.00 2.09 H new ATOM 2390 N HIS B 48 12.700 -12.314 -3.195 1.00 1.73 N ATOM 2391 CA HIS B 48 13.777 -11.629 -3.892 1.00 1.85 C ATOM 2392 C HIS B 48 13.574 -10.114 -3.914 1.00 1.78 C ATOM 2393 O HIS B 48 14.541 -9.378 -3.740 1.00 2.43 O ATOM 2394 CB HIS B 48 13.877 -12.178 -5.322 1.00 1.76 C ATOM 2395 CG HIS B 48 15.045 -11.616 -6.094 1.00 2.08 C ATOM 2396 ND1 HIS B 48 16.314 -12.152 -6.140 1.00 3.48 N ATOM 2397 CD2 HIS B 48 15.056 -10.462 -6.832 1.00 2.06 C ATOM 2398 CE1 HIS B 48 17.068 -11.336 -6.896 1.00 3.40 C ATOM 2399 NE2 HIS B 48 16.349 -10.292 -7.339 1.00 2.36 N ATOM 0 H HIS B 48 12.137 -12.900 -3.812 1.00 1.73 H new ATOM 0 HA HIS B 48 14.707 -11.816 -3.355 1.00 1.85 H new ATOM 0 HB2 HIS B 48 13.965 -13.264 -5.282 1.00 1.76 H new ATOM 0 HB3 HIS B 48 12.954 -11.952 -5.856 1.00 1.76 H new ATOM 0 HD2 HIS B 48 14.217 -9.802 -6.994 1.00 2.06 H new ATOM 0 HE1 HIS B 48 18.113 -11.498 -7.118 1.00 3.40 H new ATOM 0 HE2 HIS B 48 16.680 -9.527 -7.928 1.00 2.36 H new ATOM 2407 N LEU B 49 12.339 -9.672 -4.189 1.00 1.36 N ATOM 2408 CA LEU B 49 11.965 -8.291 -4.491 1.00 1.17 C ATOM 2409 C LEU B 49 12.804 -7.257 -3.732 1.00 1.15 C ATOM 2410 O LEU B 49 13.537 -6.478 -4.340 1.00 1.28 O ATOM 2411 CB LEU B 49 10.464 -8.123 -4.215 1.00 0.94 C ATOM 2412 CG LEU B 49 9.899 -6.788 -4.726 1.00 0.77 C ATOM 2413 CD1 LEU B 49 9.924 -6.737 -6.256 1.00 0.89 C ATOM 2414 CD2 LEU B 49 8.456 -6.633 -4.242 1.00 0.66 C ATOM 0 H LEU B 49 11.537 -10.302 -4.207 1.00 1.36 H new ATOM 0 HA LEU B 49 12.173 -8.099 -5.544 1.00 1.17 H new ATOM 0 HB2 LEU B 49 9.921 -8.943 -4.685 1.00 0.94 H new ATOM 0 HB3 LEU B 49 10.288 -8.197 -3.142 1.00 0.94 H new ATOM 0 HG LEU B 49 10.517 -5.978 -4.339 1.00 0.77 H new ATOM 0 HD11 LEU B 49 9.520 -5.783 -6.595 1.00 0.89 H new ATOM 0 HD12 LEU B 49 10.951 -6.841 -6.607 1.00 0.89 H new ATOM 0 HD13 LEU B 49 9.319 -7.551 -6.657 1.00 0.89 H new ATOM 0 HD21 LEU B 49 8.051 -5.687 -4.602 1.00 0.66 H new ATOM 0 HD22 LEU B 49 7.853 -7.456 -4.626 1.00 0.66 H new ATOM 0 HD23 LEU B 49 8.434 -6.645 -3.152 1.00 0.66 H new ATOM 2426 N LEU B 50 12.717 -7.259 -2.400 1.00 1.10 N ATOM 2427 CA LEU B 50 13.662 -6.521 -1.580 1.00 1.13 C ATOM 2428 C LEU B 50 14.919 -7.368 -1.444 1.00 1.08 C ATOM 2429 O LEU B 50 14.981 -8.250 -0.589 1.00 1.69 O ATOM 2430 CB LEU B 50 13.071 -6.199 -0.202 1.00 1.40 C ATOM 2431 CG LEU B 50 12.104 -5.008 -0.248 1.00 1.02 C ATOM 2432 CD1 LEU B 50 11.323 -4.968 1.065 1.00 1.37 C ATOM 2433 CD2 LEU B 50 12.833 -3.666 -0.406 1.00 1.12 C ATOM 0 H LEU B 50 12.003 -7.763 -1.874 1.00 1.10 H new ATOM 0 HA LEU B 50 13.896 -5.567 -2.053 1.00 1.13 H new ATOM 0 HB2 LEU B 50 12.547 -7.075 0.180 1.00 1.40 H new ATOM 0 HB3 LEU B 50 13.879 -5.981 0.496 1.00 1.40 H new ATOM 0 HG LEU B 50 11.452 -5.144 -1.111 1.00 1.02 H new ATOM 0 HD11 LEU B 50 10.630 -4.127 1.051 1.00 1.37 H new ATOM 0 HD12 LEU B 50 10.765 -5.896 1.185 1.00 1.37 H new ATOM 0 HD13 LEU B 50 12.017 -4.852 1.898 1.00 1.37 H new ATOM 0 HD21 LEU B 50 12.103 -2.857 -0.433 1.00 1.12 H new ATOM 0 HD22 LEU B 50 13.509 -3.518 0.436 1.00 1.12 H new ATOM 0 HD23 LEU B 50 13.405 -3.670 -1.334 1.00 1.12 H new ATOM 2445 N LYS B 51 15.925 -7.078 -2.276 1.00 0.97 N ATOM 2446 CA LYS B 51 17.241 -7.677 -2.126 1.00 1.11 C ATOM 2447 C LYS B 51 17.692 -7.535 -0.672 1.00 1.31 C ATOM 2448 O LYS B 51 17.418 -6.503 -0.058 1.00 1.75 O ATOM 2449 CB LYS B 51 18.251 -7.026 -3.094 1.00 1.40 C ATOM 2450 CG LYS B 51 18.707 -5.602 -2.698 1.00 1.88 C ATOM 2451 CD LYS B 51 20.001 -5.604 -1.850 1.00 3.28 C ATOM 2452 CE LYS B 51 20.053 -4.450 -0.821 1.00 4.62 C ATOM 2453 NZ LYS B 51 21.197 -4.529 0.133 1.00 6.05 N ATOM 0 H LYS B 51 15.845 -6.430 -3.060 1.00 0.97 H new ATOM 0 HA LYS B 51 17.190 -8.736 -2.378 1.00 1.11 H new ATOM 0 HB2 LYS B 51 19.130 -7.667 -3.164 1.00 1.40 H new ATOM 0 HB3 LYS B 51 17.806 -6.986 -4.088 1.00 1.40 H new ATOM 0 HG2 LYS B 51 18.870 -5.013 -3.601 1.00 1.88 H new ATOM 0 HG3 LYS B 51 17.911 -5.113 -2.137 1.00 1.88 H new ATOM 0 HD2 LYS B 51 20.083 -6.555 -1.325 1.00 3.28 H new ATOM 0 HD3 LYS B 51 20.863 -5.531 -2.513 1.00 3.28 H new ATOM 0 HE2 LYS B 51 20.107 -3.503 -1.357 1.00 4.62 H new ATOM 0 HE3 LYS B 51 19.122 -4.442 -0.254 1.00 4.62 H new ATOM 0 HZ1 LYS B 51 21.617 -3.585 0.250 1.00 6.05 H new ATOM 0 HZ2 LYS B 51 20.858 -4.874 1.054 1.00 6.05 H new ATOM 0 HZ3 LYS B 51 21.915 -5.183 -0.239 1.00 6.05 H new ATOM 2467 N ASP B 52 18.419 -8.530 -0.148 1.00 1.76 N ATOM 2468 CA ASP B 52 19.065 -8.440 1.157 1.00 2.01 C ATOM 2469 C ASP B 52 17.997 -8.291 2.236 1.00 1.60 C ATOM 2470 O ASP B 52 17.946 -7.352 3.027 1.00 1.66 O ATOM 2471 CB ASP B 52 20.104 -7.327 1.127 1.00 2.45 C ATOM 2472 CG ASP B 52 20.828 -7.039 2.418 1.00 3.18 C ATOM 2473 OD1 ASP B 52 20.794 -7.875 3.347 1.00 4.31 O ATOM 2474 OD2 ASP B 52 21.432 -5.941 2.378 1.00 3.34 O ATOM 0 H ASP B 52 18.573 -9.420 -0.622 1.00 1.76 H new ATOM 0 HA ASP B 52 19.612 -9.350 1.403 1.00 2.01 H new ATOM 0 HB2 ASP B 52 20.847 -7.576 0.369 1.00 2.45 H new ATOM 0 HB3 ASP B 52 19.611 -6.411 0.802 1.00 2.45 H new ATOM 2479 N VAL B 53 17.158 -9.322 2.263 1.00 1.54 N ATOM 2480 CA VAL B 53 16.257 -9.635 3.356 1.00 1.53 C ATOM 2481 C VAL B 53 17.022 -9.791 4.682 1.00 1.87 C ATOM 2482 O VAL B 53 16.428 -9.687 5.755 1.00 1.96 O ATOM 2483 CB VAL B 53 15.480 -10.910 2.986 1.00 1.63 C ATOM 2484 CG1 VAL B 53 14.655 -10.707 1.706 1.00 1.79 C ATOM 2485 CG2 VAL B 53 16.393 -12.135 2.815 1.00 2.08 C ATOM 0 H VAL B 53 17.088 -9.986 1.491 1.00 1.54 H new ATOM 0 HA VAL B 53 15.554 -8.816 3.508 1.00 1.53 H new ATOM 0 HB VAL B 53 14.811 -11.105 3.824 1.00 1.63 H new ATOM 0 HG11 VAL B 53 14.117 -11.625 1.470 1.00 1.79 H new ATOM 0 HG12 VAL B 53 13.941 -9.897 1.858 1.00 1.79 H new ATOM 0 HG13 VAL B 53 15.320 -10.454 0.881 1.00 1.79 H new ATOM 0 HG21 VAL B 53 15.790 -13.005 2.555 1.00 2.08 H new ATOM 0 HG22 VAL B 53 17.115 -11.943 2.021 1.00 2.08 H new ATOM 0 HG23 VAL B 53 16.923 -12.327 3.748 1.00 2.08 H new ATOM 2495 N GLY B 54 18.333 -10.062 4.608 1.00 2.41 N ATOM 2496 CA GLY B 54 19.207 -10.206 5.756 1.00 2.97 C ATOM 2497 C GLY B 54 19.324 -8.899 6.533 1.00 2.61 C ATOM 2498 O GLY B 54 18.980 -8.865 7.716 1.00 2.84 O ATOM 0 H GLY B 54 18.817 -10.188 3.719 1.00 2.41 H new ATOM 0 HA2 GLY B 54 18.823 -10.988 6.412 1.00 2.97 H new ATOM 0 HA3 GLY B 54 20.196 -10.524 5.425 1.00 2.97 H new ATOM 2502 N SER B 55 19.820 -7.833 5.890 1.00 2.21 N ATOM 2503 CA SER B 55 20.064 -6.551 6.547 1.00 2.02 C ATOM 2504 C SER B 55 18.738 -5.806 6.733 1.00 1.57 C ATOM 2505 O SER B 55 18.462 -4.785 6.105 1.00 1.72 O ATOM 2506 CB SER B 55 21.088 -5.725 5.748 1.00 2.33 C ATOM 2507 OG SER B 55 21.716 -4.727 6.540 1.00 2.71 O ATOM 0 H SER B 55 20.062 -7.840 4.899 1.00 2.21 H new ATOM 0 HA SER B 55 20.492 -6.721 7.535 1.00 2.02 H new ATOM 0 HB2 SER B 55 21.848 -6.391 5.339 1.00 2.33 H new ATOM 0 HB3 SER B 55 20.589 -5.253 4.902 1.00 2.33 H new ATOM 0 HG SER B 55 21.058 -4.045 6.789 1.00 2.71 H new ATOM 2513 N LEU B 56 17.878 -6.367 7.581 1.00 1.30 N ATOM 2514 CA LEU B 56 16.532 -5.914 7.822 1.00 1.03 C ATOM 2515 C LEU B 56 16.557 -4.588 8.599 1.00 0.86 C ATOM 2516 O LEU B 56 15.740 -3.712 8.336 1.00 0.88 O ATOM 2517 CB LEU B 56 15.820 -7.095 8.503 1.00 1.12 C ATOM 2518 CG LEU B 56 14.309 -6.988 8.746 1.00 1.05 C ATOM 2519 CD1 LEU B 56 14.055 -6.593 10.200 1.00 1.18 C ATOM 2520 CD2 LEU B 56 13.610 -6.037 7.784 1.00 1.03 C ATOM 0 H LEU B 56 18.123 -7.186 8.138 1.00 1.30 H new ATOM 0 HA LEU B 56 15.970 -5.661 6.923 1.00 1.03 H new ATOM 0 HB2 LEU B 56 15.998 -7.984 7.898 1.00 1.12 H new ATOM 0 HB3 LEU B 56 16.301 -7.263 9.467 1.00 1.12 H new ATOM 0 HG LEU B 56 13.875 -7.969 8.551 1.00 1.05 H new ATOM 0 HD11 LEU B 56 12.982 -6.517 10.374 1.00 1.18 H new ATOM 0 HD12 LEU B 56 14.477 -7.350 10.862 1.00 1.18 H new ATOM 0 HD13 LEU B 56 14.525 -5.631 10.403 1.00 1.18 H new ATOM 0 HD21 LEU B 56 12.544 -6.008 8.011 1.00 1.03 H new ATOM 0 HD22 LEU B 56 14.031 -5.037 7.891 1.00 1.03 H new ATOM 0 HD23 LEU B 56 13.754 -6.384 6.761 1.00 1.03 H new ATOM 2532 N ASP B 57 17.529 -4.418 9.502 1.00 0.99 N ATOM 2533 CA ASP B 57 17.912 -3.168 10.165 1.00 1.33 C ATOM 2534 C ASP B 57 17.424 -1.881 9.483 1.00 1.16 C ATOM 2535 O ASP B 57 16.571 -1.199 10.053 1.00 1.12 O ATOM 2536 CB ASP B 57 19.437 -3.141 10.343 1.00 2.00 C ATOM 2537 CG ASP B 57 20.121 -3.730 9.124 1.00 3.04 C ATOM 2538 OD1 ASP B 57 20.255 -3.007 8.113 1.00 4.19 O ATOM 2539 OD2 ASP B 57 20.366 -4.951 9.177 1.00 3.52 O ATOM 0 H ASP B 57 18.106 -5.201 9.809 1.00 0.99 H new ATOM 0 HA ASP B 57 17.401 -3.171 11.128 1.00 1.33 H new ATOM 0 HB2 ASP B 57 19.774 -2.116 10.497 1.00 2.00 H new ATOM 0 HB3 ASP B 57 19.716 -3.705 11.233 1.00 2.00 H new ATOM 2544 N GLU B 58 17.961 -1.504 8.313 1.00 1.21 N ATOM 2545 CA GLU B 58 17.576 -0.231 7.694 1.00 1.21 C ATOM 2546 C GLU B 58 16.066 -0.165 7.428 1.00 1.02 C ATOM 2547 O GLU B 58 15.430 0.864 7.680 1.00 1.12 O ATOM 2548 CB GLU B 58 18.456 0.129 6.474 1.00 1.38 C ATOM 2549 CG GLU B 58 18.119 -0.526 5.118 1.00 2.19 C ATOM 2550 CD GLU B 58 17.362 0.402 4.163 1.00 2.42 C ATOM 2551 OE1 GLU B 58 16.206 0.754 4.482 1.00 3.17 O ATOM 2552 OE2 GLU B 58 17.918 0.731 3.086 1.00 3.21 O ATOM 0 H GLU B 58 18.646 -2.048 7.789 1.00 1.21 H new ATOM 0 HA GLU B 58 17.780 0.560 8.416 1.00 1.21 H new ATOM 0 HB2 GLU B 58 18.416 1.210 6.341 1.00 1.38 H new ATOM 0 HB3 GLU B 58 19.487 -0.124 6.720 1.00 1.38 H new ATOM 0 HG2 GLU B 58 19.044 -0.850 4.640 1.00 2.19 H new ATOM 0 HG3 GLU B 58 17.521 -1.420 5.294 1.00 2.19 H new ATOM 2559 N LYS B 59 15.474 -1.288 7.004 1.00 0.83 N ATOM 2560 CA LYS B 59 14.033 -1.389 6.869 1.00 0.88 C ATOM 2561 C LYS B 59 13.408 -1.166 8.245 1.00 0.75 C ATOM 2562 O LYS B 59 12.658 -0.215 8.402 1.00 0.78 O ATOM 2563 CB LYS B 59 13.597 -2.729 6.237 1.00 1.10 C ATOM 2564 CG LYS B 59 12.649 -2.576 5.034 1.00 2.01 C ATOM 2565 CD LYS B 59 13.355 -2.586 3.668 1.00 1.97 C ATOM 2566 CE LYS B 59 14.461 -1.535 3.535 1.00 2.31 C ATOM 2567 NZ LYS B 59 13.944 -0.155 3.572 1.00 3.56 N ATOM 0 H LYS B 59 15.980 -2.136 6.750 1.00 0.83 H new ATOM 0 HA LYS B 59 13.678 -0.622 6.181 1.00 0.88 H new ATOM 0 HB2 LYS B 59 14.485 -3.275 5.919 1.00 1.10 H new ATOM 0 HB3 LYS B 59 13.106 -3.335 6.998 1.00 1.10 H new ATOM 0 HG2 LYS B 59 11.917 -3.383 5.058 1.00 2.01 H new ATOM 0 HG3 LYS B 59 12.097 -1.642 5.138 1.00 2.01 H new ATOM 0 HD2 LYS B 59 13.783 -3.574 3.498 1.00 1.97 H new ATOM 0 HD3 LYS B 59 12.614 -2.421 2.886 1.00 1.97 H new ATOM 0 HE2 LYS B 59 15.183 -1.670 4.341 1.00 2.31 H new ATOM 0 HE3 LYS B 59 14.996 -1.693 2.598 1.00 2.31 H new ATOM 0 HZ1 LYS B 59 14.579 0.439 4.143 1.00 3.56 H new ATOM 0 HZ2 LYS B 59 13.893 0.223 2.604 1.00 3.56 H new ATOM 0 HZ3 LYS B 59 12.994 -0.151 3.995 1.00 3.56 H new ATOM 2581 N MET B 60 13.727 -1.996 9.243 1.00 0.78 N ATOM 2582 CA MET B 60 13.163 -1.896 10.586 1.00 0.93 C ATOM 2583 C MET B 60 13.184 -0.451 11.082 1.00 0.90 C ATOM 2584 O MET B 60 12.149 0.070 11.480 1.00 0.96 O ATOM 2585 CB MET B 60 13.864 -2.875 11.538 1.00 1.16 C ATOM 2586 CG MET B 60 13.374 -2.793 12.993 1.00 1.43 C ATOM 2587 SD MET B 60 14.187 -1.532 14.015 1.00 2.26 S ATOM 2588 CE MET B 60 13.350 -1.803 15.591 1.00 2.21 C ATOM 0 H MET B 60 14.391 -2.763 9.137 1.00 0.78 H new ATOM 0 HA MET B 60 12.114 -2.189 10.555 1.00 0.93 H new ATOM 0 HB2 MET B 60 13.715 -3.891 11.172 1.00 1.16 H new ATOM 0 HB3 MET B 60 14.937 -2.682 11.515 1.00 1.16 H new ATOM 0 HG2 MET B 60 12.302 -2.597 12.988 1.00 1.43 H new ATOM 0 HG3 MET B 60 13.518 -3.766 13.463 1.00 1.43 H new ATOM 0 HE1 MET B 60 13.923 -1.336 16.392 1.00 2.21 H new ATOM 0 HE2 MET B 60 12.353 -1.364 15.554 1.00 2.21 H new ATOM 0 HE3 MET B 60 13.268 -2.873 15.780 1.00 2.21 H new ATOM 2598 N LYS B 61 14.329 0.225 11.019 1.00 0.91 N ATOM 2599 CA LYS B 61 14.412 1.612 11.451 1.00 1.01 C ATOM 2600 C LYS B 61 13.527 2.531 10.601 1.00 0.91 C ATOM 2601 O LYS B 61 12.842 3.392 11.152 1.00 0.96 O ATOM 2602 CB LYS B 61 15.877 2.066 11.507 1.00 1.23 C ATOM 2603 CG LYS B 61 16.673 1.338 12.607 1.00 1.95 C ATOM 2604 CD LYS B 61 16.192 1.746 14.012 1.00 1.97 C ATOM 2605 CE LYS B 61 17.025 1.101 15.129 1.00 2.29 C ATOM 2606 NZ LYS B 61 16.500 1.450 16.469 1.00 3.55 N ATOM 0 H LYS B 61 15.206 -0.165 10.674 1.00 0.91 H new ATOM 0 HA LYS B 61 14.014 1.684 12.463 1.00 1.01 H new ATOM 0 HB2 LYS B 61 16.348 1.886 10.541 1.00 1.23 H new ATOM 0 HB3 LYS B 61 15.915 3.141 11.685 1.00 1.23 H new ATOM 0 HG2 LYS B 61 16.566 0.260 12.483 1.00 1.95 H new ATOM 0 HG3 LYS B 61 17.734 1.567 12.503 1.00 1.95 H new ATOM 0 HD2 LYS B 61 16.239 2.831 14.108 1.00 1.97 H new ATOM 0 HD3 LYS B 61 15.147 1.461 14.132 1.00 1.97 H new ATOM 0 HE2 LYS B 61 17.022 0.018 15.007 1.00 2.29 H new ATOM 0 HE3 LYS B 61 18.061 1.428 15.047 1.00 2.29 H new ATOM 0 HZ1 LYS B 61 17.086 0.998 17.200 1.00 3.55 H new ATOM 0 HZ2 LYS B 61 16.526 2.482 16.594 1.00 3.55 H new ATOM 0 HZ3 LYS B 61 15.519 1.115 16.556 1.00 3.55 H new ATOM 2620 N SER B 62 13.501 2.352 9.278 1.00 0.87 N ATOM 2621 CA SER B 62 12.596 3.117 8.428 1.00 0.96 C ATOM 2622 C SER B 62 11.126 2.862 8.785 1.00 0.94 C ATOM 2623 O SER B 62 10.305 3.776 8.708 1.00 1.12 O ATOM 2624 CB SER B 62 12.855 2.797 6.951 1.00 1.14 C ATOM 2625 OG SER B 62 12.068 3.646 6.132 1.00 2.30 O ATOM 0 H SER B 62 14.093 1.688 8.778 1.00 0.87 H new ATOM 0 HA SER B 62 12.794 4.175 8.602 1.00 0.96 H new ATOM 0 HB2 SER B 62 13.912 2.931 6.720 1.00 1.14 H new ATOM 0 HB3 SER B 62 12.614 1.754 6.747 1.00 1.14 H new ATOM 0 HG SER B 62 12.237 3.440 5.189 1.00 2.30 H new ATOM 2631 N LEU B 63 10.762 1.617 9.094 1.00 0.89 N ATOM 2632 CA LEU B 63 9.386 1.185 9.287 1.00 1.03 C ATOM 2633 C LEU B 63 8.896 1.551 10.693 1.00 1.13 C ATOM 2634 O LEU B 63 7.936 2.298 10.850 1.00 1.21 O ATOM 2635 CB LEU B 63 9.305 -0.336 9.101 1.00 1.08 C ATOM 2636 CG LEU B 63 9.704 -0.887 7.722 1.00 1.27 C ATOM 2637 CD1 LEU B 63 9.968 -2.388 7.863 1.00 1.64 C ATOM 2638 CD2 LEU B 63 8.628 -0.649 6.671 1.00 1.18 C ATOM 0 H LEU B 63 11.438 0.864 9.219 1.00 0.89 H new ATOM 0 HA LEU B 63 8.753 1.688 8.555 1.00 1.03 H new ATOM 0 HB2 LEU B 63 9.942 -0.805 9.851 1.00 1.08 H new ATOM 0 HB3 LEU B 63 8.282 -0.650 9.310 1.00 1.08 H new ATOM 0 HG LEU B 63 10.598 -0.362 7.385 1.00 1.27 H new ATOM 0 HD11 LEU B 63 10.253 -2.800 6.895 1.00 1.64 H new ATOM 0 HD12 LEU B 63 10.775 -2.550 8.578 1.00 1.64 H new ATOM 0 HD13 LEU B 63 9.065 -2.885 8.217 1.00 1.64 H new ATOM 0 HD21 LEU B 63 8.957 -1.056 5.715 1.00 1.18 H new ATOM 0 HD22 LEU B 63 7.705 -1.142 6.977 1.00 1.18 H new ATOM 0 HD23 LEU B 63 8.451 0.422 6.568 1.00 1.18 H new ATOM 2650 N ASP B 64 9.571 0.995 11.701 1.00 1.19 N ATOM 2651 CA ASP B 64 9.176 0.851 13.101 1.00 1.41 C ATOM 2652 C ASP B 64 9.158 2.149 13.906 1.00 1.68 C ATOM 2653 O ASP B 64 8.824 2.141 15.098 1.00 1.87 O ATOM 2654 CB ASP B 64 10.020 -0.230 13.802 1.00 1.57 C ATOM 2655 CG ASP B 64 9.235 -1.006 14.833 1.00 1.98 C ATOM 2656 OD1 ASP B 64 8.027 -0.716 14.972 1.00 1.66 O ATOM 2657 OD2 ASP B 64 9.848 -1.890 15.459 1.00 2.94 O ATOM 0 H ASP B 64 10.496 0.597 11.541 1.00 1.19 H new ATOM 0 HA ASP B 64 8.134 0.533 13.069 1.00 1.41 H new ATOM 0 HB2 ASP B 64 10.412 -0.920 13.055 1.00 1.57 H new ATOM 0 HB3 ASP B 64 10.878 0.240 14.283 1.00 1.57 H new ATOM 2662 N VAL B 65 9.703 3.203 13.294 1.00 1.80 N ATOM 2663 CA VAL B 65 10.202 4.456 13.819 1.00 1.81 C ATOM 2664 C VAL B 65 9.431 5.092 14.982 1.00 1.62 C ATOM 2665 O VAL B 65 10.008 5.919 15.685 1.00 1.67 O ATOM 2666 CB VAL B 65 10.329 5.409 12.612 1.00 2.02 C ATOM 2667 CG1 VAL B 65 9.080 6.265 12.365 1.00 2.03 C ATOM 2668 CG2 VAL B 65 11.583 6.258 12.759 1.00 3.99 C ATOM 0 H VAL B 65 9.815 3.183 12.280 1.00 1.80 H new ATOM 0 HA VAL B 65 11.157 4.248 14.301 1.00 1.81 H new ATOM 0 HB VAL B 65 10.419 4.789 11.720 1.00 2.02 H new ATOM 0 HG11 VAL B 65 9.245 6.909 11.501 1.00 2.03 H new ATOM 0 HG12 VAL B 65 8.225 5.615 12.176 1.00 2.03 H new ATOM 0 HG13 VAL B 65 8.881 6.880 13.243 1.00 2.03 H new ATOM 0 HG21 VAL B 65 11.670 6.930 11.905 1.00 3.99 H new ATOM 0 HG22 VAL B 65 11.521 6.843 13.676 1.00 3.99 H new ATOM 0 HG23 VAL B 65 12.458 5.610 12.801 1.00 3.99 H new ATOM 2678 N ASN B 66 8.163 4.736 15.224 1.00 1.55 N ATOM 2679 CA ASN B 66 7.484 5.201 16.428 1.00 1.47 C ATOM 2680 C ASN B 66 8.189 4.713 17.704 1.00 1.58 C ATOM 2681 O ASN B 66 7.976 5.290 18.766 1.00 1.96 O ATOM 2682 CB ASN B 66 5.986 4.867 16.403 1.00 1.59 C ATOM 2683 CG ASN B 66 5.622 3.561 17.107 1.00 1.86 C ATOM 2684 OD1 ASN B 66 6.391 2.596 17.124 1.00 2.00 O ATOM 2685 ND2 ASN B 66 4.438 3.517 17.700 1.00 2.76 N ATOM 0 H ASN B 66 7.602 4.141 14.614 1.00 1.55 H new ATOM 0 HA ASN B 66 7.550 6.289 16.443 1.00 1.47 H new ATOM 0 HB2 ASN B 66 5.436 5.684 16.870 1.00 1.59 H new ATOM 0 HB3 ASN B 66 5.655 4.812 15.366 1.00 1.59 H new ATOM 0 HD21 ASN B 66 4.142 2.671 18.186 1.00 2.76 H new ATOM 0 HD22 ASN B 66 3.822 4.330 17.670 1.00 2.76 H new ATOM 2692 N GLN B 67 9.018 3.662 17.594 1.00 1.56 N ATOM 2693 CA GLN B 67 9.982 3.186 18.573 1.00 1.85 C ATOM 2694 C GLN B 67 9.449 1.975 19.333 1.00 1.71 C ATOM 2695 O GLN B 67 10.248 1.152 19.781 1.00 2.18 O ATOM 2696 CB GLN B 67 10.516 4.291 19.501 1.00 2.82 C ATOM 2697 CG GLN B 67 11.896 3.927 20.066 1.00 3.62 C ATOM 2698 CD GLN B 67 13.026 4.162 19.064 1.00 3.09 C ATOM 2699 OE1 GLN B 67 13.625 3.228 18.534 1.00 3.13 O ATOM 2700 NE2 GLN B 67 13.344 5.429 18.806 1.00 3.47 N ATOM 0 H GLN B 67 9.024 3.087 16.752 1.00 1.56 H new ATOM 0 HA GLN B 67 10.855 2.855 18.011 1.00 1.85 H new ATOM 0 HB2 GLN B 67 10.582 5.230 18.951 1.00 2.82 H new ATOM 0 HB3 GLN B 67 9.816 4.450 20.321 1.00 2.82 H new ATOM 0 HG2 GLN B 67 12.083 4.517 20.963 1.00 3.62 H new ATOM 0 HG3 GLN B 67 11.896 2.880 20.367 1.00 3.62 H new ATOM 0 HE21 GLN B 67 12.832 6.186 19.259 1.00 3.47 H new ATOM 0 HE22 GLN B 67 14.100 5.643 18.156 1.00 3.47 H new ATOM 2709 N ASP B 68 8.124 1.806 19.442 1.00 1.74 N ATOM 2710 CA ASP B 68 7.623 0.506 19.863 1.00 1.59 C ATOM 2711 C ASP B 68 8.061 -0.517 18.817 1.00 1.42 C ATOM 2712 O ASP B 68 8.038 -0.225 17.621 1.00 2.99 O ATOM 2713 CB ASP B 68 6.109 0.484 20.167 1.00 1.79 C ATOM 2714 CG ASP B 68 5.157 0.594 18.982 1.00 1.68 C ATOM 2715 OD1 ASP B 68 5.461 0.032 17.907 1.00 1.65 O ATOM 2716 OD2 ASP B 68 4.129 1.282 19.134 1.00 2.13 O ATOM 0 H ASP B 68 7.417 2.517 19.254 1.00 1.74 H new ATOM 0 HA ASP B 68 8.057 0.246 20.829 1.00 1.59 H new ATOM 0 HB2 ASP B 68 5.884 -0.443 20.695 1.00 1.79 H new ATOM 0 HB3 ASP B 68 5.891 1.303 20.852 1.00 1.79 H new ATOM 2721 N SER B 69 8.478 -1.691 19.277 1.00 1.79 N ATOM 2722 CA SER B 69 8.954 -2.830 18.514 1.00 1.40 C ATOM 2723 C SER B 69 7.816 -3.645 17.879 1.00 1.24 C ATOM 2724 O SER B 69 8.048 -4.755 17.400 1.00 1.22 O ATOM 2725 CB SER B 69 9.806 -3.677 19.467 1.00 1.55 C ATOM 2726 OG SER B 69 9.264 -3.618 20.778 1.00 3.28 O ATOM 0 H SER B 69 8.491 -1.882 20.279 1.00 1.79 H new ATOM 0 HA SER B 69 9.546 -2.486 17.666 1.00 1.40 H new ATOM 0 HB2 SER B 69 9.835 -4.711 19.122 1.00 1.55 H new ATOM 0 HB3 SER B 69 10.833 -3.313 19.472 1.00 1.55 H new ATOM 0 HG SER B 69 8.291 -3.730 20.735 1.00 3.28 H new ATOM 2732 N GLU B 70 6.589 -3.110 17.856 1.00 1.34 N ATOM 2733 CA GLU B 70 5.555 -3.618 16.978 1.00 1.19 C ATOM 2734 C GLU B 70 5.753 -2.854 15.680 1.00 1.15 C ATOM 2735 O GLU B 70 5.562 -1.642 15.679 1.00 1.19 O ATOM 2736 CB GLU B 70 4.154 -3.311 17.530 1.00 1.34 C ATOM 2737 CG GLU B 70 3.657 -4.300 18.592 1.00 1.67 C ATOM 2738 CD GLU B 70 2.231 -3.950 18.989 1.00 2.37 C ATOM 2739 OE1 GLU B 70 2.050 -2.963 19.733 1.00 2.70 O ATOM 2740 OE2 GLU B 70 1.274 -4.552 18.445 1.00 3.26 O ATOM 0 H GLU B 70 6.299 -2.326 18.440 1.00 1.34 H new ATOM 0 HA GLU B 70 5.624 -4.700 16.864 1.00 1.19 H new ATOM 0 HB2 GLU B 70 4.158 -2.309 17.959 1.00 1.34 H new ATOM 0 HB3 GLU B 70 3.445 -3.301 16.702 1.00 1.34 H new ATOM 0 HG2 GLU B 70 3.697 -5.317 18.203 1.00 1.67 H new ATOM 0 HG3 GLU B 70 4.307 -4.267 19.466 1.00 1.67 H new ATOM 2747 N LEU B 71 6.081 -3.534 14.588 1.00 1.25 N ATOM 2748 CA LEU B 71 5.834 -3.025 13.252 1.00 1.32 C ATOM 2749 C LEU B 71 4.308 -2.953 13.133 1.00 1.21 C ATOM 2750 O LEU B 71 3.651 -3.928 12.760 1.00 1.11 O ATOM 2751 CB LEU B 71 6.431 -3.975 12.198 1.00 1.39 C ATOM 2752 CG LEU B 71 7.956 -3.955 12.006 1.00 1.61 C ATOM 2753 CD1 LEU B 71 8.420 -2.627 11.410 1.00 1.73 C ATOM 2754 CD2 LEU B 71 8.731 -4.291 13.282 1.00 1.85 C ATOM 0 H LEU B 71 6.525 -4.452 14.608 1.00 1.25 H new ATOM 0 HA LEU B 71 6.296 -2.052 13.085 1.00 1.32 H new ATOM 0 HB2 LEU B 71 6.138 -4.992 12.458 1.00 1.39 H new ATOM 0 HB3 LEU B 71 5.968 -3.746 11.238 1.00 1.39 H new ATOM 0 HG LEU B 71 8.183 -4.750 11.296 1.00 1.61 H new ATOM 0 HD11 LEU B 71 9.503 -2.642 11.286 1.00 1.73 H new ATOM 0 HD12 LEU B 71 7.946 -2.478 10.440 1.00 1.73 H new ATOM 0 HD13 LEU B 71 8.143 -1.812 12.078 1.00 1.73 H new ATOM 0 HD21 LEU B 71 9.801 -4.259 13.077 1.00 1.85 H new ATOM 0 HD22 LEU B 71 8.488 -3.564 14.057 1.00 1.85 H new ATOM 0 HD23 LEU B 71 8.456 -5.289 13.622 1.00 1.85 H new ATOM 2766 N LYS B 72 3.723 -1.812 13.493 1.00 1.31 N ATOM 2767 CA LYS B 72 2.293 -1.721 13.718 1.00 1.36 C ATOM 2768 C LYS B 72 1.600 -1.601 12.362 1.00 1.31 C ATOM 2769 O LYS B 72 2.240 -1.368 11.337 1.00 1.23 O ATOM 2770 CB LYS B 72 2.026 -0.475 14.590 1.00 1.51 C ATOM 2771 CG LYS B 72 0.722 -0.488 15.399 1.00 2.03 C ATOM 2772 CD LYS B 72 0.882 -1.413 16.620 1.00 3.30 C ATOM 2773 CE LYS B 72 -0.365 -1.450 17.513 1.00 3.66 C ATOM 2774 NZ LYS B 72 -0.177 -2.357 18.665 1.00 4.94 N ATOM 0 H LYS B 72 4.226 -0.936 13.634 1.00 1.31 H new ATOM 0 HA LYS B 72 1.908 -2.603 14.230 1.00 1.36 H new ATOM 0 HB2 LYS B 72 2.859 -0.355 15.283 1.00 1.51 H new ATOM 0 HB3 LYS B 72 2.021 0.402 13.943 1.00 1.51 H new ATOM 0 HG2 LYS B 72 0.474 0.522 15.725 1.00 2.03 H new ATOM 0 HG3 LYS B 72 -0.102 -0.832 14.774 1.00 2.03 H new ATOM 0 HD2 LYS B 72 1.106 -2.423 16.277 1.00 3.30 H new ATOM 0 HD3 LYS B 72 1.735 -1.081 17.211 1.00 3.30 H new ATOM 0 HE2 LYS B 72 -0.587 -0.445 17.872 1.00 3.66 H new ATOM 0 HE3 LYS B 72 -1.224 -1.777 16.927 1.00 3.66 H new ATOM 0 HZ1 LYS B 72 -1.018 -2.321 19.276 1.00 4.94 H new ATOM 0 HZ2 LYS B 72 -0.039 -3.329 18.322 1.00 4.94 H new ATOM 0 HZ3 LYS B 72 0.659 -2.060 19.208 1.00 4.94 H new ATOM 2788 N PHE B 73 0.277 -1.744 12.348 1.00 1.42 N ATOM 2789 CA PHE B 73 -0.532 -1.566 11.154 1.00 1.37 C ATOM 2790 C PHE B 73 -1.002 -0.107 11.075 1.00 1.46 C ATOM 2791 O PHE B 73 -2.206 0.145 11.037 1.00 1.73 O ATOM 2792 CB PHE B 73 -1.690 -2.573 11.211 1.00 1.65 C ATOM 2793 CG PHE B 73 -2.535 -2.811 9.960 1.00 1.76 C ATOM 2794 CD1 PHE B 73 -2.472 -1.974 8.825 1.00 3.32 C ATOM 2795 CD2 PHE B 73 -3.413 -3.911 9.948 1.00 2.64 C ATOM 2796 CE1 PHE B 73 -3.351 -2.179 7.745 1.00 4.64 C ATOM 2797 CE2 PHE B 73 -4.304 -4.105 8.880 1.00 3.73 C ATOM 2798 CZ PHE B 73 -4.283 -3.230 7.782 1.00 4.55 C ATOM 0 H PHE B 73 -0.265 -1.989 13.176 1.00 1.42 H new ATOM 0 HA PHE B 73 0.036 -1.760 10.244 1.00 1.37 H new ATOM 0 HB2 PHE B 73 -1.274 -3.534 11.513 1.00 1.65 H new ATOM 0 HB3 PHE B 73 -2.364 -2.253 12.006 1.00 1.65 H new ATOM 0 HD1 PHE B 73 -1.747 -1.174 8.785 1.00 3.32 H new ATOM 0 HD2 PHE B 73 -3.401 -4.613 10.769 1.00 2.64 H new ATOM 0 HE1 PHE B 73 -3.309 -1.527 6.885 1.00 4.64 H new ATOM 0 HE2 PHE B 73 -5.005 -4.926 8.903 1.00 3.73 H new ATOM 0 HZ PHE B 73 -4.981 -3.364 6.969 1.00 4.55 H new ATOM 2808 N ASN B 74 -0.071 0.854 10.992 1.00 1.43 N ATOM 2809 CA ASN B 74 0.429 1.236 9.694 1.00 1.25 C ATOM 2810 C ASN B 74 1.846 1.844 9.758 1.00 1.11 C ATOM 2811 O ASN B 74 2.128 2.856 9.118 1.00 1.36 O ATOM 2812 CB ASN B 74 -0.568 2.245 9.144 1.00 1.28 C ATOM 2813 CG ASN B 74 -0.823 3.474 10.027 1.00 2.61 C ATOM 2814 OD1 ASN B 74 -1.928 3.651 10.530 1.00 3.90 O ATOM 2815 ND2 ASN B 74 0.155 4.359 10.190 1.00 2.98 N ATOM 0 H ASN B 74 0.330 1.356 11.784 1.00 1.43 H new ATOM 0 HA ASN B 74 0.522 0.360 9.053 1.00 1.25 H new ATOM 0 HB2 ASN B 74 -0.213 2.586 8.171 1.00 1.28 H new ATOM 0 HB3 ASN B 74 -1.518 1.737 8.977 1.00 1.28 H new ATOM 0 HD21 ASN B 74 -0.007 5.202 10.741 1.00 2.98 H new ATOM 0 HD22 ASN B 74 1.067 4.195 9.764 1.00 2.98 H new ATOM 2822 N GLU B 75 2.777 1.157 10.417 1.00 1.05 N ATOM 2823 CA GLU B 75 4.206 1.222 10.176 1.00 1.02 C ATOM 2824 C GLU B 75 4.550 0.231 9.072 1.00 1.02 C ATOM 2825 O GLU B 75 5.124 0.611 8.057 1.00 1.08 O ATOM 2826 CB GLU B 75 4.954 0.903 11.464 1.00 1.06 C ATOM 2827 CG GLU B 75 4.771 2.029 12.488 1.00 1.17 C ATOM 2828 CD GLU B 75 5.327 1.592 13.819 1.00 1.24 C ATOM 2829 OE1 GLU B 75 4.955 0.507 14.298 1.00 2.12 O ATOM 2830 OE2 GLU B 75 6.193 2.250 14.424 1.00 2.20 O ATOM 0 H GLU B 75 2.537 0.510 11.169 1.00 1.05 H new ATOM 0 HA GLU B 75 4.502 2.222 9.859 1.00 1.02 H new ATOM 0 HB2 GLU B 75 4.589 -0.036 11.879 1.00 1.06 H new ATOM 0 HB3 GLU B 75 6.014 0.767 11.251 1.00 1.06 H new ATOM 0 HG2 GLU B 75 5.280 2.931 12.148 1.00 1.17 H new ATOM 0 HG3 GLU B 75 3.714 2.277 12.587 1.00 1.17 H new ATOM 2837 N TYR B 76 4.184 -1.046 9.277 1.00 0.99 N ATOM 2838 CA TYR B 76 4.546 -2.133 8.371 1.00 0.95 C ATOM 2839 C TYR B 76 4.193 -1.768 6.935 1.00 0.90 C ATOM 2840 O TYR B 76 4.960 -2.044 6.013 1.00 0.86 O ATOM 2841 CB TYR B 76 3.926 -3.478 8.812 1.00 1.08 C ATOM 2842 CG TYR B 76 2.485 -3.772 8.407 1.00 1.32 C ATOM 2843 CD1 TYR B 76 2.169 -4.041 7.059 1.00 2.12 C ATOM 2844 CD2 TYR B 76 1.512 -4.016 9.395 1.00 3.07 C ATOM 2845 CE1 TYR B 76 0.856 -4.366 6.685 1.00 3.37 C ATOM 2846 CE2 TYR B 76 0.222 -4.434 9.024 1.00 4.43 C ATOM 2847 CZ TYR B 76 -0.126 -4.549 7.669 1.00 4.36 C ATOM 2848 OH TYR B 76 -1.395 -4.881 7.306 1.00 5.91 O ATOM 0 H TYR B 76 3.629 -1.347 10.078 1.00 0.99 H new ATOM 0 HA TYR B 76 5.626 -2.272 8.417 1.00 0.95 H new ATOM 0 HB2 TYR B 76 4.553 -4.279 8.419 1.00 1.08 H new ATOM 0 HB3 TYR B 76 3.984 -3.532 9.899 1.00 1.08 H new ATOM 0 HD1 TYR B 76 2.944 -3.996 6.308 1.00 2.12 H new ATOM 0 HD2 TYR B 76 1.757 -3.882 10.438 1.00 3.07 H new ATOM 0 HE1 TYR B 76 0.602 -4.475 5.641 1.00 3.37 H new ATOM 0 HE2 TYR B 76 -0.506 -4.668 9.787 1.00 4.43 H new ATOM 0 HH TYR B 76 -2.009 -4.164 7.569 1.00 5.91 H new ATOM 2858 N TRP B 77 3.031 -1.124 6.771 1.00 0.93 N ATOM 2859 CA TRP B 77 2.524 -0.699 5.483 1.00 0.90 C ATOM 2860 C TRP B 77 3.608 0.016 4.669 1.00 0.86 C ATOM 2861 O TRP B 77 3.692 -0.213 3.465 1.00 0.85 O ATOM 2862 CB TRP B 77 1.251 0.154 5.641 1.00 0.97 C ATOM 2863 CG TRP B 77 0.679 0.576 4.323 1.00 0.90 C ATOM 2864 CD1 TRP B 77 0.314 -0.281 3.340 1.00 1.95 C ATOM 2865 CD2 TRP B 77 0.565 1.912 3.742 1.00 1.54 C ATOM 2866 NE1 TRP B 77 0.077 0.414 2.180 1.00 2.04 N ATOM 2867 CE2 TRP B 77 0.206 1.761 2.370 1.00 1.34 C ATOM 2868 CE3 TRP B 77 0.796 3.234 4.189 1.00 3.23 C ATOM 2869 CZ2 TRP B 77 0.067 2.837 1.496 1.00 1.94 C ATOM 2870 CZ3 TRP B 77 0.727 4.312 3.281 1.00 4.00 C ATOM 2871 CH2 TRP B 77 0.324 4.122 1.961 1.00 3.17 C ATOM 0 H TRP B 77 2.415 -0.885 7.548 1.00 0.93 H new ATOM 0 HA TRP B 77 2.241 -1.588 4.919 1.00 0.90 H new ATOM 0 HB2 TRP B 77 0.503 -0.414 6.194 1.00 0.97 H new ATOM 0 HB3 TRP B 77 1.481 1.039 6.234 1.00 0.97 H new ATOM 0 HD1 TRP B 77 0.223 -1.351 3.452 1.00 1.95 H new ATOM 0 HE1 TRP B 77 -0.165 -0.020 1.289 1.00 2.04 H new ATOM 0 HE3 TRP B 77 1.026 3.419 5.228 1.00 3.23 H new ATOM 0 HZ2 TRP B 77 -0.236 2.675 0.472 1.00 1.94 H new ATOM 0 HZ3 TRP B 77 0.992 5.304 3.616 1.00 4.00 H new ATOM 0 HH2 TRP B 77 0.212 4.970 1.301 1.00 3.17 H new ATOM 2882 N ARG B 78 4.458 0.834 5.313 1.00 0.90 N ATOM 2883 CA ARG B 78 5.581 1.537 4.681 1.00 0.94 C ATOM 2884 C ARG B 78 6.344 0.631 3.716 1.00 0.87 C ATOM 2885 O ARG B 78 6.717 1.082 2.634 1.00 1.02 O ATOM 2886 CB ARG B 78 6.509 2.157 5.728 1.00 0.97 C ATOM 2887 CG ARG B 78 5.793 3.289 6.487 1.00 1.17 C ATOM 2888 CD ARG B 78 6.524 3.741 7.763 1.00 2.31 C ATOM 2889 NE ARG B 78 7.915 4.173 7.541 1.00 2.84 N ATOM 2890 CZ ARG B 78 8.332 5.265 6.887 1.00 3.10 C ATOM 2891 NH1 ARG B 78 7.445 6.099 6.336 1.00 3.16 N ATOM 2892 NH2 ARG B 78 9.642 5.511 6.803 1.00 4.31 N ATOM 0 H ARG B 78 4.379 1.027 6.311 1.00 0.90 H new ATOM 0 HA ARG B 78 5.164 2.353 4.090 1.00 0.94 H new ATOM 0 HB2 ARG B 78 6.836 1.391 6.431 1.00 0.97 H new ATOM 0 HB3 ARG B 78 7.404 2.547 5.243 1.00 0.97 H new ATOM 0 HG2 ARG B 78 5.680 4.145 5.822 1.00 1.17 H new ATOM 0 HG3 ARG B 78 4.789 2.957 6.753 1.00 1.17 H new ATOM 0 HD2 ARG B 78 5.968 4.562 8.215 1.00 2.31 H new ATOM 0 HD3 ARG B 78 6.520 2.920 8.480 1.00 2.31 H new ATOM 0 HE ARG B 78 8.643 3.573 7.929 1.00 2.84 H new ATOM 0 HH11 ARG B 78 6.447 5.905 6.413 1.00 3.16 H new ATOM 0 HH12 ARG B 78 7.766 6.930 5.839 1.00 3.16 H new ATOM 0 HH21 ARG B 78 10.310 4.871 7.234 1.00 4.31 H new ATOM 0 HH22 ARG B 78 9.975 6.339 6.308 1.00 4.31 H new ATOM 2906 N LEU B 79 6.526 -0.647 4.068 1.00 0.69 N ATOM 2907 CA LEU B 79 7.195 -1.600 3.198 1.00 0.61 C ATOM 2908 C LEU B 79 6.580 -1.593 1.802 1.00 0.73 C ATOM 2909 O LEU B 79 7.309 -1.527 0.823 1.00 0.86 O ATOM 2910 CB LEU B 79 7.135 -3.018 3.776 1.00 0.54 C ATOM 2911 CG LEU B 79 8.174 -3.926 3.091 1.00 0.56 C ATOM 2912 CD1 LEU B 79 9.590 -3.589 3.580 1.00 0.56 C ATOM 2913 CD2 LEU B 79 7.839 -5.407 3.303 1.00 0.73 C ATOM 0 H LEU B 79 6.214 -1.039 4.956 1.00 0.69 H new ATOM 0 HA LEU B 79 8.239 -1.293 3.128 1.00 0.61 H new ATOM 0 HB2 LEU B 79 7.322 -2.987 4.849 1.00 0.54 H new ATOM 0 HB3 LEU B 79 6.136 -3.431 3.638 1.00 0.54 H new ATOM 0 HG LEU B 79 8.139 -3.739 2.018 1.00 0.56 H new ATOM 0 HD11 LEU B 79 10.310 -4.240 3.085 1.00 0.56 H new ATOM 0 HD12 LEU B 79 9.819 -2.550 3.344 1.00 0.56 H new ATOM 0 HD13 LEU B 79 9.647 -3.737 4.658 1.00 0.56 H new ATOM 0 HD21 LEU B 79 8.589 -6.024 2.809 1.00 0.73 H new ATOM 0 HD22 LEU B 79 7.832 -5.629 4.370 1.00 0.73 H new ATOM 0 HD23 LEU B 79 6.857 -5.622 2.881 1.00 0.73 H new ATOM 2925 N ILE B 80 5.250 -1.645 1.696 1.00 0.80 N ATOM 2926 CA ILE B 80 4.558 -1.724 0.411 1.00 1.04 C ATOM 2927 C ILE B 80 4.797 -0.424 -0.370 1.00 1.27 C ATOM 2928 O ILE B 80 4.794 -0.407 -1.596 1.00 1.42 O ATOM 2929 CB ILE B 80 3.073 -2.106 0.610 1.00 1.11 C ATOM 2930 CG1 ILE B 80 2.993 -3.490 1.284 1.00 1.21 C ATOM 2931 CG2 ILE B 80 2.320 -2.113 -0.729 1.00 1.73 C ATOM 2932 CD1 ILE B 80 1.558 -3.966 1.537 1.00 1.43 C ATOM 0 H ILE B 80 4.623 -1.633 2.501 1.00 0.80 H new ATOM 0 HA ILE B 80 4.965 -2.528 -0.203 1.00 1.04 H new ATOM 0 HB ILE B 80 2.598 -1.362 1.249 1.00 1.11 H new ATOM 0 HG12 ILE B 80 3.504 -4.221 0.657 1.00 1.21 H new ATOM 0 HG13 ILE B 80 3.528 -3.454 2.233 1.00 1.21 H new ATOM 0 HG21 ILE B 80 1.278 -2.385 -0.559 1.00 1.73 H new ATOM 0 HG22 ILE B 80 2.367 -1.121 -1.178 1.00 1.73 H new ATOM 0 HG23 ILE B 80 2.779 -2.838 -1.401 1.00 1.73 H new ATOM 0 HD11 ILE B 80 1.578 -4.946 2.013 1.00 1.43 H new ATOM 0 HD12 ILE B 80 1.049 -3.256 2.189 1.00 1.43 H new ATOM 0 HD13 ILE B 80 1.025 -4.034 0.589 1.00 1.43 H new ATOM 2944 N GLY B 81 5.056 0.661 0.355 1.00 1.39 N ATOM 2945 CA GLY B 81 5.391 1.977 -0.141 1.00 1.69 C ATOM 2946 C GLY B 81 6.736 1.898 -0.802 1.00 1.64 C ATOM 2947 O GLY B 81 6.884 2.279 -1.962 1.00 1.78 O ATOM 0 H GLY B 81 5.034 0.633 1.374 1.00 1.39 H new ATOM 0 HA2 GLY B 81 4.638 2.319 -0.851 1.00 1.69 H new ATOM 0 HA3 GLY B 81 5.410 2.698 0.676 1.00 1.69 H new ATOM 2951 N GLU B 82 7.693 1.343 -0.063 1.00 1.44 N ATOM 2952 CA GLU B 82 8.968 0.996 -0.645 1.00 1.29 C ATOM 2953 C GLU B 82 8.707 0.143 -1.898 1.00 1.07 C ATOM 2954 O GLU B 82 9.019 0.608 -2.983 1.00 1.20 O ATOM 2955 CB GLU B 82 9.909 0.347 0.380 1.00 1.19 C ATOM 2956 CG GLU B 82 10.073 1.110 1.707 1.00 1.67 C ATOM 2957 CD GLU B 82 11.392 0.770 2.402 1.00 2.95 C ATOM 2958 OE1 GLU B 82 12.461 0.969 1.781 1.00 3.36 O ATOM 2959 OE2 GLU B 82 11.382 0.303 3.564 1.00 4.39 O ATOM 0 H GLU B 82 7.603 1.129 0.930 1.00 1.44 H new ATOM 0 HA GLU B 82 9.503 1.893 -0.957 1.00 1.29 H new ATOM 0 HB2 GLU B 82 9.542 -0.655 0.601 1.00 1.19 H new ATOM 0 HB3 GLU B 82 10.892 0.233 -0.077 1.00 1.19 H new ATOM 0 HG2 GLU B 82 10.029 2.182 1.517 1.00 1.67 H new ATOM 0 HG3 GLU B 82 9.241 0.869 2.369 1.00 1.67 H new ATOM 2966 N LEU B 83 8.068 -1.033 -1.801 1.00 0.90 N ATOM 2967 CA LEU B 83 7.855 -1.956 -2.929 1.00 0.97 C ATOM 2968 C LEU B 83 7.309 -1.261 -4.180 1.00 1.15 C ATOM 2969 O LEU B 83 7.853 -1.414 -5.276 1.00 1.20 O ATOM 2970 CB LEU B 83 6.890 -3.100 -2.573 1.00 1.36 C ATOM 2971 CG LEU B 83 7.229 -3.956 -1.345 1.00 0.90 C ATOM 2972 CD1 LEU B 83 6.386 -5.236 -1.362 1.00 1.47 C ATOM 2973 CD2 LEU B 83 8.720 -4.251 -1.216 1.00 2.49 C ATOM 0 H LEU B 83 7.678 -1.376 -0.923 1.00 0.90 H new ATOM 0 HA LEU B 83 8.847 -2.354 -3.142 1.00 0.97 H new ATOM 0 HB2 LEU B 83 5.900 -2.670 -2.420 1.00 1.36 H new ATOM 0 HB3 LEU B 83 6.820 -3.762 -3.436 1.00 1.36 H new ATOM 0 HG LEU B 83 6.976 -3.380 -0.455 1.00 0.90 H new ATOM 0 HD11 LEU B 83 6.628 -5.843 -0.489 1.00 1.47 H new ATOM 0 HD12 LEU B 83 5.328 -4.975 -1.340 1.00 1.47 H new ATOM 0 HD13 LEU B 83 6.602 -5.802 -2.268 1.00 1.47 H new ATOM 0 HD21 LEU B 83 8.895 -4.860 -0.329 1.00 2.49 H new ATOM 0 HD22 LEU B 83 9.062 -4.790 -2.099 1.00 2.49 H new ATOM 0 HD23 LEU B 83 9.270 -3.314 -1.128 1.00 2.49 H new ATOM 2985 N ALA B 84 6.220 -0.506 -4.006 1.00 1.31 N ATOM 2986 CA ALA B 84 5.572 0.254 -5.065 1.00 1.60 C ATOM 2987 C ALA B 84 6.572 1.187 -5.744 1.00 1.59 C ATOM 2988 O ALA B 84 6.488 1.418 -6.948 1.00 1.91 O ATOM 2989 CB ALA B 84 4.393 1.040 -4.485 1.00 1.85 C ATOM 0 H ALA B 84 5.758 -0.408 -3.102 1.00 1.31 H new ATOM 0 HA ALA B 84 5.195 -0.434 -5.821 1.00 1.60 H new ATOM 0 HB1 ALA B 84 3.909 1.609 -5.279 1.00 1.85 H new ATOM 0 HB2 ALA B 84 3.675 0.348 -4.045 1.00 1.85 H new ATOM 0 HB3 ALA B 84 4.754 1.724 -3.717 1.00 1.85 H new ATOM 2995 N LYS B 85 7.533 1.715 -4.981 1.00 1.39 N ATOM 2996 CA LYS B 85 8.694 2.350 -5.565 1.00 1.45 C ATOM 2997 C LYS B 85 9.639 1.319 -6.195 1.00 1.01 C ATOM 2998 O LYS B 85 9.989 1.512 -7.351 1.00 0.93 O ATOM 2999 CB LYS B 85 9.445 3.206 -4.538 1.00 1.98 C ATOM 3000 CG LYS B 85 9.315 4.711 -4.778 1.00 1.35 C ATOM 3001 CD LYS B 85 7.945 5.263 -4.405 1.00 1.49 C ATOM 3002 CE LYS B 85 7.691 5.313 -2.896 1.00 0.86 C ATOM 3003 NZ LYS B 85 8.547 6.265 -2.160 1.00 1.97 N ATOM 0 H LYS B 85 7.521 1.710 -3.961 1.00 1.39 H new ATOM 0 HA LYS B 85 8.333 3.009 -6.355 1.00 1.45 H new ATOM 0 HB2 LYS B 85 9.071 2.973 -3.541 1.00 1.98 H new ATOM 0 HB3 LYS B 85 10.500 2.934 -4.554 1.00 1.98 H new ATOM 0 HG2 LYS B 85 10.079 5.232 -4.200 1.00 1.35 H new ATOM 0 HG3 LYS B 85 9.511 4.923 -5.829 1.00 1.35 H new ATOM 0 HD2 LYS B 85 7.844 6.268 -4.815 1.00 1.49 H new ATOM 0 HD3 LYS B 85 7.176 4.649 -4.874 1.00 1.49 H new ATOM 0 HE2 LYS B 85 6.647 5.576 -2.725 1.00 0.86 H new ATOM 0 HE3 LYS B 85 7.840 4.316 -2.482 1.00 0.86 H new ATOM 0 HZ1 LYS B 85 9.132 5.747 -1.473 1.00 1.97 H new ATOM 0 HZ2 LYS B 85 9.163 6.767 -2.830 1.00 1.97 H new ATOM 0 HZ3 LYS B 85 7.950 6.952 -1.657 1.00 1.97 H new ATOM 3017 N GLU B 86 10.126 0.309 -5.459 1.00 0.89 N ATOM 3018 CA GLU B 86 11.268 -0.523 -5.841 1.00 0.84 C ATOM 3019 C GLU B 86 11.123 -1.126 -7.234 1.00 0.76 C ATOM 3020 O GLU B 86 12.108 -1.251 -7.955 1.00 0.92 O ATOM 3021 CB GLU B 86 11.558 -1.636 -4.814 1.00 0.87 C ATOM 3022 CG GLU B 86 11.734 -1.200 -3.347 1.00 1.10 C ATOM 3023 CD GLU B 86 12.710 -0.059 -3.105 1.00 1.55 C ATOM 3024 OE1 GLU B 86 13.560 0.240 -3.969 1.00 1.95 O ATOM 3025 OE2 GLU B 86 12.600 0.601 -2.048 1.00 2.54 O ATOM 0 H GLU B 86 9.724 0.045 -4.560 1.00 0.89 H new ATOM 0 HA GLU B 86 12.120 0.157 -5.858 1.00 0.84 H new ATOM 0 HB2 GLU B 86 10.744 -2.359 -4.858 1.00 0.87 H new ATOM 0 HB3 GLU B 86 12.464 -2.157 -5.124 1.00 0.87 H new ATOM 0 HG2 GLU B 86 10.759 -0.908 -2.956 1.00 1.10 H new ATOM 0 HG3 GLU B 86 12.064 -2.063 -2.769 1.00 1.10 H new ATOM 3032 N ILE B 87 9.907 -1.505 -7.638 1.00 0.66 N ATOM 3033 CA ILE B 87 9.709 -1.987 -8.994 1.00 0.70 C ATOM 3034 C ILE B 87 10.196 -0.957 -10.036 1.00 0.78 C ATOM 3035 O ILE B 87 10.766 -1.332 -11.057 1.00 0.91 O ATOM 3036 CB ILE B 87 8.248 -2.442 -9.159 1.00 0.73 C ATOM 3037 CG1 ILE B 87 8.090 -3.357 -10.384 1.00 0.92 C ATOM 3038 CG2 ILE B 87 7.252 -1.276 -9.207 1.00 0.99 C ATOM 3039 CD1 ILE B 87 7.073 -4.454 -10.075 1.00 0.78 C ATOM 0 H ILE B 87 9.069 -1.486 -7.057 1.00 0.66 H new ATOM 0 HA ILE B 87 10.329 -2.863 -9.183 1.00 0.70 H new ATOM 0 HB ILE B 87 8.003 -3.014 -8.264 1.00 0.73 H new ATOM 0 HG12 ILE B 87 7.762 -2.775 -11.245 1.00 0.92 H new ATOM 0 HG13 ILE B 87 9.051 -3.801 -10.646 1.00 0.92 H new ATOM 0 HG21 ILE B 87 6.241 -1.666 -9.324 1.00 0.99 H new ATOM 0 HG22 ILE B 87 7.315 -0.705 -8.281 1.00 0.99 H new ATOM 0 HG23 ILE B 87 7.491 -0.628 -10.050 1.00 0.99 H new ATOM 0 HD11 ILE B 87 6.962 -5.102 -10.944 1.00 0.78 H new ATOM 0 HD12 ILE B 87 7.419 -5.042 -9.225 1.00 0.78 H new ATOM 0 HD13 ILE B 87 6.111 -4.001 -9.835 1.00 0.78 H new ATOM 3051 N ARG B 88 9.975 0.339 -9.775 1.00 0.86 N ATOM 3052 CA ARG B 88 10.538 1.458 -10.526 1.00 1.11 C ATOM 3053 C ARG B 88 11.961 1.852 -10.069 1.00 1.16 C ATOM 3054 O ARG B 88 12.879 1.856 -10.887 1.00 1.48 O ATOM 3055 CB ARG B 88 9.531 2.622 -10.516 1.00 1.29 C ATOM 3056 CG ARG B 88 10.057 3.903 -11.189 1.00 2.16 C ATOM 3057 CD ARG B 88 10.371 4.969 -10.131 1.00 3.17 C ATOM 3058 NE ARG B 88 11.323 5.981 -10.617 1.00 3.80 N ATOM 3059 CZ ARG B 88 11.945 6.847 -9.801 1.00 5.31 C ATOM 3060 NH1 ARG B 88 11.562 6.960 -8.530 1.00 6.58 N ATOM 3061 NH2 ARG B 88 12.965 7.602 -10.214 1.00 5.99 N ATOM 0 H ARG B 88 9.377 0.642 -9.006 1.00 0.86 H new ATOM 0 HA ARG B 88 10.689 1.148 -11.560 1.00 1.11 H new ATOM 0 HB2 ARG B 88 8.619 2.305 -11.021 1.00 1.29 H new ATOM 0 HB3 ARG B 88 9.262 2.849 -9.484 1.00 1.29 H new ATOM 0 HG2 ARG B 88 10.954 3.677 -11.765 1.00 2.16 H new ATOM 0 HG3 ARG B 88 9.315 4.284 -11.891 1.00 2.16 H new ATOM 0 HD2 ARG B 88 9.446 5.460 -9.829 1.00 3.17 H new ATOM 0 HD3 ARG B 88 10.780 4.486 -9.244 1.00 3.17 H new ATOM 0 HE ARG B 88 11.519 6.026 -11.617 1.00 3.80 H new ATOM 0 HH11 ARG B 88 10.795 6.388 -8.176 1.00 6.58 H new ATOM 0 HH12 ARG B 88 12.035 7.618 -7.911 1.00 6.58 H new ATOM 0 HH21 ARG B 88 13.295 7.531 -11.177 1.00 5.99 H new ATOM 0 HH22 ARG B 88 13.415 8.250 -9.567 1.00 5.99 H new ATOM 3075 N LYS B 89 12.159 2.277 -8.812 1.00 1.07 N ATOM 3076 CA LYS B 89 13.419 2.874 -8.372 1.00 1.27 C ATOM 3077 C LYS B 89 14.454 1.810 -8.002 1.00 1.33 C ATOM 3078 O LYS B 89 14.102 0.791 -7.424 1.00 1.59 O ATOM 3079 CB LYS B 89 13.183 3.831 -7.188 1.00 1.62 C ATOM 3080 CG LYS B 89 13.192 3.159 -5.803 1.00 2.78 C ATOM 3081 CD LYS B 89 12.907 4.182 -4.693 1.00 3.11 C ATOM 3082 CE LYS B 89 12.828 3.578 -3.277 1.00 4.94 C ATOM 3083 NZ LYS B 89 13.885 2.591 -2.994 1.00 6.51 N ATOM 0 H LYS B 89 11.452 2.215 -8.079 1.00 1.07 H new ATOM 0 HA LYS B 89 13.819 3.444 -9.210 1.00 1.27 H new ATOM 0 HB2 LYS B 89 13.951 4.605 -7.206 1.00 1.62 H new ATOM 0 HB3 LYS B 89 12.224 4.330 -7.328 1.00 1.62 H new ATOM 0 HG2 LYS B 89 12.443 2.367 -5.774 1.00 2.78 H new ATOM 0 HG3 LYS B 89 14.160 2.689 -5.629 1.00 2.78 H new ATOM 0 HD2 LYS B 89 13.687 4.943 -4.707 1.00 3.11 H new ATOM 0 HD3 LYS B 89 11.966 4.686 -4.913 1.00 3.11 H new ATOM 0 HE2 LYS B 89 12.889 4.383 -2.544 1.00 4.94 H new ATOM 0 HE3 LYS B 89 11.856 3.103 -3.148 1.00 4.94 H new ATOM 0 HZ1 LYS B 89 13.658 2.081 -2.116 1.00 6.51 H new ATOM 0 HZ2 LYS B 89 13.948 1.914 -3.781 1.00 6.51 H new ATOM 0 HZ3 LYS B 89 14.796 3.080 -2.884 1.00 6.51 H new ATOM 3097 N LYS B 90 15.742 2.096 -8.216 1.00 1.66 N ATOM 3098 CA LYS B 90 16.812 1.307 -7.611 1.00 1.87 C ATOM 3099 C LYS B 90 17.027 1.773 -6.160 1.00 1.86 C ATOM 3100 O LYS B 90 16.828 1.016 -5.214 1.00 2.06 O ATOM 3101 CB LYS B 90 18.063 1.366 -8.507 1.00 2.30 C ATOM 3102 CG LYS B 90 18.901 0.083 -8.403 1.00 3.20 C ATOM 3103 CD LYS B 90 19.893 -0.004 -9.573 1.00 3.26 C ATOM 3104 CE LYS B 90 20.630 -1.354 -9.560 1.00 4.67 C ATOM 3105 NZ LYS B 90 21.483 -1.537 -10.754 1.00 5.48 N ATOM 0 H LYS B 90 16.065 2.866 -8.802 1.00 1.66 H new ATOM 0 HA LYS B 90 16.549 0.251 -7.547 1.00 1.87 H new ATOM 0 HB2 LYS B 90 17.761 1.520 -9.543 1.00 2.30 H new ATOM 0 HB3 LYS B 90 18.674 2.223 -8.222 1.00 2.30 H new ATOM 0 HG2 LYS B 90 19.442 0.070 -7.457 1.00 3.20 H new ATOM 0 HG3 LYS B 90 18.246 -0.788 -8.407 1.00 3.20 H new ATOM 0 HD2 LYS B 90 19.362 0.117 -10.517 1.00 3.26 H new ATOM 0 HD3 LYS B 90 20.614 0.811 -9.507 1.00 3.26 H new ATOM 0 HE2 LYS B 90 21.245 -1.421 -8.663 1.00 4.67 H new ATOM 0 HE3 LYS B 90 19.901 -2.163 -9.509 1.00 4.67 H new ATOM 0 HZ1 LYS B 90 21.960 -2.460 -10.702 1.00 5.48 H new ATOM 0 HZ2 LYS B 90 20.894 -1.499 -11.610 1.00 5.48 H new ATOM 0 HZ3 LYS B 90 22.196 -0.781 -10.791 1.00 5.48 H new ATOM 3119 N LYS B 91 17.378 3.050 -5.972 1.00 1.98 N ATOM 3120 CA LYS B 91 17.349 3.729 -4.672 1.00 2.07 C ATOM 3121 C LYS B 91 16.929 5.195 -4.862 1.00 1.73 C ATOM 3122 O LYS B 91 17.179 6.019 -3.985 1.00 2.05 O ATOM 3123 CB LYS B 91 18.710 3.554 -3.964 1.00 3.02 C ATOM 3124 CG LYS B 91 18.713 3.719 -2.427 1.00 4.21 C ATOM 3125 CD LYS B 91 18.107 2.523 -1.661 1.00 5.28 C ATOM 3126 CE LYS B 91 18.383 2.619 -0.142 1.00 6.52 C ATOM 3127 NZ LYS B 91 17.790 1.498 0.632 1.00 8.06 N ATOM 0 H LYS B 91 17.696 3.651 -6.732 1.00 1.98 H new ATOM 0 HA LYS B 91 16.603 3.280 -4.017 1.00 2.07 H new ATOM 0 HB2 LYS B 91 19.093 2.562 -4.202 1.00 3.02 H new ATOM 0 HB3 LYS B 91 19.410 4.275 -4.386 1.00 3.02 H new ATOM 0 HG2 LYS B 91 19.739 3.869 -2.091 1.00 4.21 H new ATOM 0 HG3 LYS B 91 18.158 4.621 -2.168 1.00 4.21 H new ATOM 0 HD2 LYS B 91 17.031 2.487 -1.834 1.00 5.28 H new ATOM 0 HD3 LYS B 91 18.524 1.593 -2.049 1.00 5.28 H new ATOM 0 HE2 LYS B 91 19.460 2.637 0.025 1.00 6.52 H new ATOM 0 HE3 LYS B 91 17.986 3.562 0.234 1.00 6.52 H new ATOM 0 HZ1 LYS B 91 18.134 1.533 1.613 1.00 8.06 H new ATOM 0 HZ2 LYS B 91 16.753 1.582 0.625 1.00 8.06 H new ATOM 0 HZ3 LYS B 91 18.067 0.593 0.200 1.00 8.06 H new ATOM 3141 N ASP B 92 16.263 5.489 -5.994 1.00 1.55 N ATOM 3142 CA ASP B 92 15.985 6.829 -6.510 1.00 1.79 C ATOM 3143 C ASP B 92 17.152 7.761 -6.158 1.00 3.00 C ATOM 3144 O ASP B 92 18.298 7.430 -6.462 1.00 4.85 O ATOM 3145 CB ASP B 92 14.602 7.305 -6.030 1.00 2.66 C ATOM 3146 CG ASP B 92 14.166 8.585 -6.720 1.00 3.73 C ATOM 3147 OD1 ASP B 92 13.560 8.462 -7.811 1.00 4.42 O ATOM 3148 OD2 ASP B 92 14.427 9.651 -6.131 1.00 4.89 O ATOM 0 H ASP B 92 15.889 4.758 -6.598 1.00 1.55 H new ATOM 0 HA ASP B 92 15.921 6.828 -7.598 1.00 1.79 H new ATOM 0 HB2 ASP B 92 13.865 6.524 -6.218 1.00 2.66 H new ATOM 0 HB3 ASP B 92 14.629 7.466 -4.952 1.00 2.66 H new ATOM 3153 N LEU B 93 16.887 8.854 -5.449 1.00 3.00 N ATOM 3154 CA LEU B 93 17.831 9.530 -4.607 1.00 4.42 C ATOM 3155 C LEU B 93 17.351 9.272 -3.180 1.00 3.18 C ATOM 3156 O LEU B 93 16.168 9.429 -2.887 1.00 2.89 O ATOM 3157 CB LEU B 93 17.781 11.021 -4.955 1.00 6.33 C ATOM 3158 CG LEU B 93 18.630 11.872 -4.009 1.00 7.38 C ATOM 3159 CD1 LEU B 93 20.129 11.647 -4.250 1.00 9.05 C ATOM 3160 CD2 LEU B 93 18.291 13.348 -4.256 1.00 9.24 C ATOM 0 H LEU B 93 15.969 9.299 -5.455 1.00 3.00 H new ATOM 0 HA LEU B 93 18.859 9.189 -4.730 1.00 4.42 H new ATOM 0 HB2 LEU B 93 18.129 11.164 -5.978 1.00 6.33 H new ATOM 0 HB3 LEU B 93 16.747 11.365 -4.919 1.00 6.33 H new ATOM 0 HG LEU B 93 18.409 11.587 -2.980 1.00 7.38 H new ATOM 0 HD11 LEU B 93 20.705 12.266 -3.562 1.00 9.05 H new ATOM 0 HD12 LEU B 93 20.371 10.597 -4.083 1.00 9.05 H new ATOM 0 HD13 LEU B 93 20.377 11.918 -5.276 1.00 9.05 H new ATOM 0 HD21 LEU B 93 18.886 13.974 -3.591 1.00 9.24 H new ATOM 0 HD22 LEU B 93 18.514 13.604 -5.292 1.00 9.24 H new ATOM 0 HD23 LEU B 93 17.232 13.516 -4.061 1.00 9.24 H new ATOM 3172 N LYS B 94 18.284 8.920 -2.292 1.00 3.13 N ATOM 3173 CA LYS B 94 18.112 8.964 -0.844 1.00 2.75 C ATOM 3174 C LYS B 94 17.165 10.098 -0.399 1.00 2.25 C ATOM 3175 O LYS B 94 17.328 11.253 -0.810 1.00 3.21 O ATOM 3176 CB LYS B 94 19.504 9.058 -0.186 1.00 3.88 C ATOM 3177 CG LYS B 94 20.299 10.330 -0.550 1.00 4.67 C ATOM 3178 CD LYS B 94 20.031 11.456 0.461 1.00 5.42 C ATOM 3179 CE LYS B 94 20.204 12.878 -0.078 1.00 6.76 C ATOM 3180 NZ LYS B 94 19.169 13.195 -1.082 1.00 7.23 N ATOM 0 H LYS B 94 19.206 8.587 -2.573 1.00 3.13 H new ATOM 0 HA LYS B 94 17.625 8.047 -0.512 1.00 2.75 H new ATOM 0 HB2 LYS B 94 19.384 9.017 0.897 1.00 3.88 H new ATOM 0 HB3 LYS B 94 20.088 8.184 -0.475 1.00 3.88 H new ATOM 0 HG2 LYS B 94 21.365 10.103 -0.572 1.00 4.67 H new ATOM 0 HG3 LYS B 94 20.023 10.662 -1.551 1.00 4.67 H new ATOM 0 HD2 LYS B 94 19.013 11.349 0.836 1.00 5.42 H new ATOM 0 HD3 LYS B 94 20.700 11.324 1.311 1.00 5.42 H new ATOM 0 HE2 LYS B 94 20.148 13.591 0.744 1.00 6.76 H new ATOM 0 HE3 LYS B 94 21.193 12.983 -0.525 1.00 6.76 H new ATOM 0 HZ1 LYS B 94 19.600 13.223 -2.028 1.00 7.23 H new ATOM 0 HZ2 LYS B 94 18.429 12.465 -1.060 1.00 7.23 H new ATOM 0 HZ3 LYS B 94 18.748 14.121 -0.866 1.00 7.23 H new ATOM 3194 N ILE B 95 16.200 9.776 0.465 1.00 2.61 N ATOM 3195 CA ILE B 95 15.217 10.720 0.987 1.00 3.48 C ATOM 3196 C ILE B 95 15.590 11.118 2.417 1.00 3.49 C ATOM 3197 O ILE B 95 16.193 10.329 3.140 1.00 4.16 O ATOM 3198 CB ILE B 95 13.802 10.113 0.900 1.00 5.11 C ATOM 3199 CG1 ILE B 95 13.663 8.813 1.718 1.00 6.27 C ATOM 3200 CG2 ILE B 95 13.440 9.878 -0.575 1.00 5.96 C ATOM 3201 CD1 ILE B 95 12.231 8.273 1.734 1.00 7.65 C ATOM 0 H ILE B 95 16.080 8.830 0.827 1.00 2.61 H new ATOM 0 HA ILE B 95 15.217 11.627 0.382 1.00 3.48 H new ATOM 0 HB ILE B 95 13.103 10.824 1.340 1.00 5.11 H new ATOM 0 HG12 ILE B 95 14.328 8.055 1.303 1.00 6.27 H new ATOM 0 HG13 ILE B 95 13.989 8.997 2.742 1.00 6.27 H new ATOM 0 HG21 ILE B 95 12.440 9.449 -0.640 1.00 5.96 H new ATOM 0 HG22 ILE B 95 13.463 10.827 -1.111 1.00 5.96 H new ATOM 0 HG23 ILE B 95 14.159 9.191 -1.021 1.00 5.96 H new ATOM 0 HD11 ILE B 95 12.194 7.357 2.324 1.00 7.65 H new ATOM 0 HD12 ILE B 95 11.567 9.016 2.175 1.00 7.65 H new ATOM 0 HD13 ILE B 95 11.911 8.060 0.714 1.00 7.65 H new ATOM 3213 N ARG B 96 15.230 12.342 2.820 1.00 3.22 N ATOM 3214 CA ARG B 96 15.298 12.849 4.185 1.00 3.41 C ATOM 3215 C ARG B 96 14.521 14.165 4.211 1.00 3.25 C ATOM 3216 O ARG B 96 14.042 14.601 3.165 1.00 3.60 O ATOM 3217 CB ARG B 96 16.752 13.002 4.677 1.00 3.83 C ATOM 3218 CG ARG B 96 17.657 13.960 3.879 1.00 4.40 C ATOM 3219 CD ARG B 96 17.362 15.449 4.140 1.00 4.78 C ATOM 3220 NE ARG B 96 18.497 16.320 3.786 1.00 5.20 N ATOM 3221 CZ ARG B 96 19.555 16.580 4.575 1.00 5.50 C ATOM 3222 NH1 ARG B 96 19.699 15.931 5.735 1.00 5.67 N ATOM 3223 NH2 ARG B 96 20.465 17.487 4.198 1.00 6.30 N ATOM 0 H ARG B 96 14.866 13.036 2.167 1.00 3.22 H new ATOM 0 HA ARG B 96 14.849 12.140 4.880 1.00 3.41 H new ATOM 0 HB2 ARG B 96 16.727 13.342 5.712 1.00 3.83 H new ATOM 0 HB3 ARG B 96 17.217 12.016 4.676 1.00 3.83 H new ATOM 0 HG2 ARG B 96 18.698 13.755 4.129 1.00 4.40 H new ATOM 0 HG3 ARG B 96 17.539 13.756 2.815 1.00 4.40 H new ATOM 0 HD2 ARG B 96 16.485 15.748 3.565 1.00 4.78 H new ATOM 0 HD3 ARG B 96 17.116 15.588 5.193 1.00 4.78 H new ATOM 0 HE ARG B 96 18.479 16.762 2.867 1.00 5.20 H new ATOM 0 HH11 ARG B 96 19.007 15.239 6.022 1.00 5.67 H new ATOM 0 HH12 ARG B 96 20.501 16.128 6.333 1.00 5.67 H new ATOM 0 HH21 ARG B 96 20.356 17.981 3.312 1.00 6.30 H new ATOM 0 HH22 ARG B 96 21.267 17.684 4.797 1.00 6.30 H new ATOM 3237 N LYS B 97 14.464 14.828 5.368 1.00 3.30 N ATOM 3238 CA LYS B 97 13.803 16.107 5.578 1.00 3.45 C ATOM 3239 C LYS B 97 14.095 16.508 7.022 1.00 3.65 C ATOM 3240 O LYS B 97 14.078 15.649 7.901 1.00 4.24 O ATOM 3241 CB LYS B 97 12.280 16.006 5.366 1.00 4.32 C ATOM 3242 CG LYS B 97 11.615 17.396 5.343 1.00 5.12 C ATOM 3243 CD LYS B 97 10.473 17.534 6.361 1.00 6.01 C ATOM 3244 CE LYS B 97 9.266 16.664 5.982 1.00 6.87 C ATOM 3245 NZ LYS B 97 8.136 16.848 6.918 1.00 7.63 N ATOM 0 H LYS B 97 14.898 14.468 6.218 1.00 3.30 H new ATOM 0 HA LYS B 97 14.172 16.842 4.863 1.00 3.45 H new ATOM 0 HB2 LYS B 97 12.076 15.490 4.428 1.00 4.32 H new ATOM 0 HB3 LYS B 97 11.841 15.405 6.162 1.00 4.32 H new ATOM 0 HG2 LYS B 97 12.369 18.156 5.546 1.00 5.12 H new ATOM 0 HG3 LYS B 97 11.228 17.591 4.343 1.00 5.12 H new ATOM 0 HD2 LYS B 97 10.831 17.249 7.350 1.00 6.01 H new ATOM 0 HD3 LYS B 97 10.164 18.578 6.422 1.00 6.01 H new ATOM 0 HE2 LYS B 97 8.943 16.912 4.971 1.00 6.87 H new ATOM 0 HE3 LYS B 97 9.563 15.615 5.974 1.00 6.87 H new ATOM 0 HZ1 LYS B 97 7.342 16.243 6.627 1.00 7.63 H new ATOM 0 HZ2 LYS B 97 8.435 16.587 7.879 1.00 7.63 H new ATOM 0 HZ3 LYS B 97 7.835 17.843 6.907 1.00 7.63 H new ATOM 3259 N LYS B 98 14.415 17.782 7.240 1.00 3.75 N ATOM 3260 CA LYS B 98 14.440 18.411 8.544 1.00 4.18 C ATOM 3261 C LYS B 98 13.331 19.451 8.498 1.00 4.35 C ATOM 3262 O LYS B 98 13.195 20.122 7.447 1.00 4.69 O ATOM 3263 CB LYS B 98 15.830 19.030 8.801 1.00 4.95 C ATOM 3264 CG LYS B 98 15.819 20.313 9.658 1.00 5.81 C ATOM 3265 CD LYS B 98 15.684 21.586 8.794 1.00 6.58 C ATOM 3266 CE LYS B 98 14.661 22.613 9.310 1.00 6.77 C ATOM 3267 NZ LYS B 98 13.267 22.172 9.096 1.00 6.38 N ATOM 3268 OXT LYS B 98 12.707 19.707 9.550 1.00 4.81 O ATOM 0 H LYS B 98 14.671 18.419 6.485 1.00 3.75 H new ATOM 0 HA LYS B 98 14.274 17.713 9.364 1.00 4.18 H new ATOM 0 HB2 LYS B 98 16.458 18.287 9.293 1.00 4.95 H new ATOM 0 HB3 LYS B 98 16.295 19.255 7.841 1.00 4.95 H new ATOM 0 HG2 LYS B 98 14.993 20.268 10.368 1.00 5.81 H new ATOM 0 HG3 LYS B 98 16.738 20.367 10.242 1.00 5.81 H new ATOM 0 HD2 LYS B 98 16.659 22.068 8.728 1.00 6.58 H new ATOM 0 HD3 LYS B 98 15.404 21.293 7.782 1.00 6.58 H new ATOM 0 HE2 LYS B 98 14.826 22.784 10.374 1.00 6.77 H new ATOM 0 HE3 LYS B 98 14.820 23.566 8.805 1.00 6.77 H new ATOM 0 HZ1 LYS B 98 12.623 22.977 9.235 1.00 6.38 H new ATOM 0 HZ2 LYS B 98 13.163 21.808 8.127 1.00 6.38 H new ATOM 0 HZ3 LYS B 98 13.033 21.420 9.775 1.00 6.38 H new TER 3282 LYS B 98 HETATM 3283 CA CA A 197 -1.904 12.224 -16.264 1.00 1.46 CA HETATM 3284 CA CA A 198 1.671 16.502 -6.006 1.00 1.49 CA HETATM 3285 CA CA B 199 2.474 -10.334 15.000 1.00 1.05 CA HETATM 3286 CA CA B 200 6.500 0.499 15.989 1.00 1.35 CA