USER MOD reduce.3.24.130724 H: found=0, std=0, add=1751, rem=0, adj=80 USER MOD reduce.3.24.130724 removed 1751 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 219 HIS : no HD1:sc= 1.1 K(o=2.4,f=-3.3) USER MOD Set 1.2: A 220 SER OG : rot 69:sc= 1.29 USER MOD Set 2.1: A 76 LYS NZ :NH3+ -155:sc= 1.58 (180deg=0) USER MOD Set 2.2: A 191 ASN : amide:sc= 0.382 K(o=-0.53,f=-6.8!) USER MOD Set 2.3: A 194 ASN : amide:sc= -2.49 K(o=-0.53,f=-12!) USER MOD Set 3.1: A 40 SER OG : rot 30:sc= -4.04! USER MOD Set 3.2: A 149 HIS : no HE2:sc= -1.59! C(o=-6.8!,f=-10!) USER MOD Set 3.3: A 172 GLN : amide:sc= -1.19 X(o=-6.8,f=-6.7) USER MOD Set 4.1: A 148 ASN : amide:sc= 0.102 K(o=-3.9,f=-6.9!) USER MOD Set 4.2: A 173 THR OG1 : rot -170:sc= -0.814 USER MOD Set 4.3: A 175 MET CE :methyl -131:sc= 0 (180deg=-0.405) USER MOD Set 4.4: A 187 THR OG1 : rot -100:sc= -0.0552 USER MOD Set 4.5: A 188 MET CE :methyl -110:sc= -3.09! (180deg=-4.93!) USER MOD Set 5.1: A 82 ASN : amide:sc= 0 X(o=-4.1,f=-4.1) USER MOD Set 5.2: A 95 HIS :FLIP no HD1:sc= -4.08! C(o=-5.8!,f=-4.1!) USER MOD Set 5.3: A 137 TYR OH : rot 180:sc= 0 USER MOD Set 6.1: A 116 TYR OH : rot -155:sc= -0.481 USER MOD Set 6.2: A 128 SER OG : rot -86:sc= -0.0609 USER MOD Set 7.1: A 105 SER OG : rot 81:sc= 1.01 USER MOD Set 7.2: A 186 LYS NZ :NH3+ 157:sc= 1.1 (180deg=0) USER MOD Set 8.1: A 94 CYS SG : rot -42:sc= 0.482 USER MOD Set 8.2: A 129 SER OG : rot 180:sc= -2.1! USER MOD Set 9.1: A 67 GLN :FLIP amide:sc= -1.14 F(o=-4.5!,f=-2.2) USER MOD Set 9.2: A 81 TYR OH : rot -15:sc= -0.287 USER MOD Set 9.3: A 83 MET CE :methyl -145:sc= -0.782 (180deg=-2.51!) USER MOD Set10.1: A 37 SER OG : rot 114:sc= 0.873 USER MOD Set10.2: A 46 ASN : amide:sc= 0.872 K(o=1.7,f=-1.5!) USER MOD Set11.1: A 18 ASN : amide:sc= -1.46 K(o=-1.7,f=-3.3!) USER MOD Set11.2: A 124 MET CE :methyl -116:sc= -0.187 (180deg=0) USER MOD Set11.3: A 156 SER OG : rot 180:sc= -0.0626 USER MOD Single : A 1 MET CE :methyl 135:sc= -0.227 (180deg=-0.955) USER MOD Single : A 1 MET N :NH3+ 150:sc= 1.41 (180deg=0.219) USER MOD Single : A 4 LYS NZ :NH3+ -172:sc=-0.00983 (180deg=-0.126) USER MOD Single : A 8 GLN : amide:sc= -0.236 K(o=-0.24,f=-1.4!) USER MOD Single : A 9 GLN :FLIP amide:sc= -0.0777 F(o=-2!,f=-0.078) USER MOD Single : A 10 THR OG1 : rot 160:sc= -0.531 USER MOD Single : A 12 GLN :FLIP amide:sc= -0.0221 F(o=-1.3!,f=-0.022) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 THR OG1 : rot 45:sc= 0.502 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00183) USER MOD Single : A 29 THR OG1 : rot 27:sc= 0.318 USER MOD Single : A 30 SER OG : rot -160:sc= -0.241 USER MOD Single : A 31 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0241) USER MOD Single : A 32 LYS NZ :NH3+ 160:sc= -2.17! (180deg=-2.92!) USER MOD Single : A 34 THR OG1 : rot 180:sc= -0.0622 USER MOD Single : A 36 SER OG : rot 126:sc= 0.162 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ -167:sc= 1.28 (180deg=1.03) USER MOD Single : A 44 HIS : no HD1:sc= -0.468 K(o=-0.47,f=-1.4) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot -66:sc= 0.781 USER MOD Single : A 60 LYS NZ :NH3+ 151:sc= 1.19 (180deg=0.982) USER MOD Single : A 62 SER OG : rot -29:sc= 0.2 USER MOD Single : A 66 TYR OH : rot -95:sc= 0.218 USER MOD Single : A 68 THR OG1 : rot -41:sc= 0.65 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot -26:sc= 0.635 USER MOD Single : A 79 GLN : amide:sc= -2.09! C(o=-2.1!,f=-2.1!) USER MOD Single : A 85 HIS : no HE2:sc= 1.24 K(o=1.2,f=-4.5!) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 91 THR OG1 : rot -100:sc= -0.137 USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 THR OG1 : rot -114:sc= 1.17 USER MOD Single : A 99 GLN :FLIP amide:sc=-0.00184 F(o=-1.1,f=-0.0018) USER MOD Single : A 100 SER OG : rot 180:sc= -0.226 USER MOD Single : A 107 SER OG : rot 180:sc= 0.479 USER MOD Single : A 118 LYS NZ :NH3+ -134:sc= 0.872 (180deg=0.0462) USER MOD Single : A 120 TYR OH : rot 30:sc=-0.00212 USER MOD Single : A 123 ASN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 125 ASN : amide:sc= -2.81! C(o=-2.8!,f=-4.1!) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 SER OG : rot 117:sc= 1.59 USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 142 ASN :FLIP amide:sc= -0.0684 F(o=-1.4!,f=-0.068) USER MOD Single : A 143 TYR OH : rot 180:sc= 0 USER MOD Single : A 147 TYR OH : rot 180:sc= 0 USER MOD Single : A 151 CYS SG : rot 143:sc= -1.47 USER MOD Single : A 155 CYS SG : rot 40:sc= -4.79! USER MOD Single : A 158 MET CE :methyl -166:sc= -0.0314 (180deg=-0.369) USER MOD Single : A 161 ASN : amide:sc= -0.597 K(o=-0.6,f=-3.7!) USER MOD Single : A 164 TYR OH : rot 180:sc= 0 USER MOD Single : A 165 SER OG : rot -90:sc= -2.22! USER MOD Single : A 166 LYS NZ :NH3+ 150:sc= -0.095 (180deg=-0.404) USER MOD Single : A 169 MET CE :methyl 162:sc= 0 (180deg=-0.249) USER MOD Single : A 178 LYS NZ :NH3+ -137:sc= -1.32 (180deg=-3.79!) USER MOD Single : A 180 SER OG : rot 180:sc= 0 USER MOD Single : A 182 SER OG : rot 180:sc= 0.0034 USER MOD Single : A 190 SER OG : rot 180:sc= 0 USER MOD Single : A 198 ASN : amide:sc= -1.68 K(o=-1.7,f=-8.1!) USER MOD Single : A 200 LYS NZ :NH3+ -164:sc=-0.00473 (180deg=-0.232) USER MOD Single : A 204 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 206 HIS : no HE2:sc= -0.465 K(o=-0.47,f=-8.8!) USER MOD Single : A 208 THR OG1 : rot 180:sc= -1.65! USER MOD Single : A 210 SER OG : rot 180:sc= -0.721 USER MOD Single : A 215 HIS : no HD1:sc=-0.00343 X(o=-0.0034,f=0) USER MOD Single : A 216 HIS : no HE2:sc= 0.896 K(o=0.9,f=-3.6!) USER MOD Single : A 217 ASN : amide:sc= 1.15 K(o=1.1,f=-0.7) USER MOD Single : A 218 SER OG : rot 180:sc= 0.0274 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -7.167 -6.274 -22.292 1.00 1.81 N ATOM 2 CA MET A 1 -6.781 -5.894 -20.915 1.00 1.25 C ATOM 3 C MET A 1 -7.538 -4.650 -20.480 1.00 1.04 C ATOM 4 O MET A 1 -7.128 -3.526 -20.775 1.00 1.62 O ATOM 5 CB MET A 1 -5.274 -5.631 -20.806 1.00 1.61 C ATOM 6 CG MET A 1 -4.408 -6.838 -21.115 1.00 2.19 C ATOM 7 SD MET A 1 -4.286 -7.172 -22.883 1.00 2.82 S ATOM 8 CE MET A 1 -3.429 -5.699 -23.444 1.00 3.86 C ATOM 0 H1 MET A 1 -6.365 -6.742 -22.761 1.00 1.81 H new ATOM 0 H2 MET A 1 -7.977 -6.926 -22.258 1.00 1.81 H new ATOM 0 H3 MET A 1 -7.431 -5.422 -22.826 1.00 1.81 H new ATOM 0 HA MET A 1 -7.036 -6.729 -20.262 1.00 1.25 H new ATOM 0 HB2 MET A 1 -5.007 -4.823 -21.487 1.00 1.61 H new ATOM 0 HB3 MET A 1 -5.049 -5.285 -19.797 1.00 1.61 H new ATOM 0 HG2 MET A 1 -3.409 -6.677 -20.710 1.00 2.19 H new ATOM 0 HG3 MET A 1 -4.819 -7.713 -20.611 1.00 2.19 H new ATOM 0 HE1 MET A 1 -2.633 -5.981 -24.133 1.00 3.86 H new ATOM 0 HE2 MET A 1 -4.133 -5.040 -23.953 1.00 3.86 H new ATOM 0 HE3 MET A 1 -3.000 -5.179 -22.587 1.00 3.86 H new ATOM 20 N ASP A 2 -8.629 -4.849 -19.759 1.00 0.84 N ATOM 21 CA ASP A 2 -9.440 -3.747 -19.292 1.00 0.67 C ATOM 22 C ASP A 2 -8.807 -3.185 -18.054 1.00 0.52 C ATOM 23 O ASP A 2 -8.768 -1.974 -17.859 1.00 0.53 O ATOM 24 CB ASP A 2 -10.860 -4.207 -18.970 1.00 0.98 C ATOM 25 CG ASP A 2 -11.558 -4.819 -20.162 1.00 1.50 C ATOM 26 OD1 ASP A 2 -12.120 -4.058 -20.978 1.00 1.72 O ATOM 27 OD2 ASP A 2 -11.552 -6.058 -20.292 1.00 2.25 O ATOM 0 H ASP A 2 -8.971 -5.770 -19.485 1.00 0.84 H new ATOM 0 HA ASP A 2 -9.498 -2.991 -20.075 1.00 0.67 H new ATOM 0 HB2 ASP A 2 -10.827 -4.935 -18.160 1.00 0.98 H new ATOM 0 HB3 ASP A 2 -11.440 -3.357 -18.611 1.00 0.98 H new ATOM 32 N PHE A 3 -8.263 -4.091 -17.249 1.00 0.43 N ATOM 33 CA PHE A 3 -7.647 -3.738 -15.993 1.00 0.34 C ATOM 34 C PHE A 3 -6.455 -2.863 -16.257 1.00 0.37 C ATOM 35 O PHE A 3 -6.173 -1.936 -15.509 1.00 0.40 O ATOM 36 CB PHE A 3 -7.200 -4.979 -15.238 1.00 0.30 C ATOM 37 CG PHE A 3 -8.315 -5.831 -14.712 1.00 0.29 C ATOM 38 CD1 PHE A 3 -8.996 -5.471 -13.562 1.00 0.28 C ATOM 39 CD2 PHE A 3 -8.706 -6.970 -15.390 1.00 0.30 C ATOM 40 CE1 PHE A 3 -10.050 -6.228 -13.102 1.00 0.29 C ATOM 41 CE2 PHE A 3 -9.754 -7.737 -14.930 1.00 0.31 C ATOM 42 CZ PHE A 3 -10.318 -7.447 -13.692 1.00 0.29 C ATOM 0 H PHE A 3 -8.241 -5.089 -17.457 1.00 0.43 H new ATOM 0 HA PHE A 3 -8.379 -3.208 -15.384 1.00 0.34 H new ATOM 0 HB2 PHE A 3 -6.579 -5.585 -15.898 1.00 0.30 H new ATOM 0 HB3 PHE A 3 -6.571 -4.672 -14.402 1.00 0.30 H new ATOM 0 HD1 PHE A 3 -8.697 -4.586 -13.019 1.00 0.28 H new ATOM 0 HD2 PHE A 3 -8.185 -7.262 -16.290 1.00 0.30 H new ATOM 0 HE1 PHE A 3 -10.662 -5.871 -12.287 1.00 0.29 H new ATOM 0 HE2 PHE A 3 -10.134 -8.555 -15.524 1.00 0.31 H new ATOM 0 HZ PHE A 3 -10.957 -8.165 -13.199 1.00 0.29 H new ATOM 52 N LYS A 4 -5.773 -3.153 -17.350 1.00 0.40 N ATOM 53 CA LYS A 4 -4.636 -2.395 -17.741 1.00 0.47 C ATOM 54 C LYS A 4 -5.055 -0.963 -17.978 1.00 0.54 C ATOM 55 O LYS A 4 -4.463 -0.053 -17.445 1.00 0.95 O ATOM 56 CB LYS A 4 -4.014 -2.992 -18.998 1.00 0.54 C ATOM 57 CG LYS A 4 -2.702 -2.350 -19.383 1.00 0.68 C ATOM 58 CD LYS A 4 -1.612 -2.672 -18.371 1.00 0.83 C ATOM 59 CE LYS A 4 -0.303 -1.965 -18.688 1.00 1.10 C ATOM 60 NZ LYS A 4 0.207 -2.304 -20.041 1.00 1.51 N ATOM 0 H LYS A 4 -6.004 -3.922 -17.979 1.00 0.40 H new ATOM 0 HA LYS A 4 -3.887 -2.421 -16.950 1.00 0.47 H new ATOM 0 HB2 LYS A 4 -3.856 -4.059 -18.844 1.00 0.54 H new ATOM 0 HB3 LYS A 4 -4.716 -2.890 -19.825 1.00 0.54 H new ATOM 0 HG2 LYS A 4 -2.399 -2.699 -20.370 1.00 0.68 H new ATOM 0 HG3 LYS A 4 -2.830 -1.270 -19.452 1.00 0.68 H new ATOM 0 HD2 LYS A 4 -1.947 -2.382 -17.375 1.00 0.83 H new ATOM 0 HD3 LYS A 4 -1.445 -3.749 -18.350 1.00 0.83 H new ATOM 0 HE2 LYS A 4 -0.448 -0.887 -18.616 1.00 1.10 H new ATOM 0 HE3 LYS A 4 0.444 -2.236 -17.942 1.00 1.10 H new ATOM 0 HZ1 LYS A 4 1.162 -1.910 -20.161 1.00 1.51 H new ATOM 0 HZ2 LYS A 4 0.243 -3.338 -20.150 1.00 1.51 H new ATOM 0 HZ3 LYS A 4 -0.426 -1.902 -20.761 1.00 1.51 H new ATOM 74 N ALA A 5 -6.131 -0.792 -18.727 1.00 0.45 N ATOM 75 CA ALA A 5 -6.645 0.525 -19.065 1.00 0.47 C ATOM 76 C ALA A 5 -6.824 1.409 -17.828 1.00 0.42 C ATOM 77 O ALA A 5 -6.364 2.555 -17.795 1.00 0.42 O ATOM 78 CB ALA A 5 -7.962 0.371 -19.804 1.00 0.54 C ATOM 0 H ALA A 5 -6.673 -1.562 -19.118 1.00 0.45 H new ATOM 0 HA ALA A 5 -5.916 1.022 -19.705 1.00 0.47 H new ATOM 0 HB1 ALA A 5 -8.353 1.356 -20.060 1.00 0.54 H new ATOM 0 HB2 ALA A 5 -7.802 -0.205 -20.716 1.00 0.54 H new ATOM 0 HB3 ALA A 5 -8.678 -0.149 -19.167 1.00 0.54 H new ATOM 84 N ILE A 6 -7.421 0.851 -16.786 1.00 0.42 N ATOM 85 CA ILE A 6 -7.792 1.654 -15.624 1.00 0.43 C ATOM 86 C ILE A 6 -6.586 1.861 -14.749 1.00 0.37 C ATOM 87 O ILE A 6 -6.382 2.922 -14.178 1.00 0.38 O ATOM 88 CB ILE A 6 -8.919 1.036 -14.759 1.00 0.53 C ATOM 89 CG1 ILE A 6 -8.679 -0.457 -14.474 1.00 0.91 C ATOM 90 CG2 ILE A 6 -10.280 1.277 -15.401 1.00 1.07 C ATOM 91 CD1 ILE A 6 -9.625 -1.402 -15.183 1.00 0.65 C ATOM 0 H ILE A 6 -7.657 -0.139 -16.717 1.00 0.42 H new ATOM 0 HA ILE A 6 -8.173 2.594 -16.023 1.00 0.43 H new ATOM 0 HB ILE A 6 -8.907 1.539 -13.792 1.00 0.53 H new ATOM 0 HG12 ILE A 6 -7.657 -0.707 -14.760 1.00 0.91 H new ATOM 0 HG13 ILE A 6 -8.759 -0.624 -13.400 1.00 0.91 H new ATOM 0 HG21 ILE A 6 -11.059 0.836 -14.779 1.00 1.07 H new ATOM 0 HG22 ILE A 6 -10.454 2.349 -15.494 1.00 1.07 H new ATOM 0 HG23 ILE A 6 -10.302 0.819 -16.390 1.00 1.07 H new ATOM 0 HD11 ILE A 6 -9.377 -2.430 -14.920 1.00 0.65 H new ATOM 0 HD12 ILE A 6 -10.650 -1.187 -14.880 1.00 0.65 H new ATOM 0 HD13 ILE A 6 -9.531 -1.271 -16.261 1.00 0.65 H new ATOM 103 N ALA A 7 -5.784 0.833 -14.690 1.00 0.33 N ATOM 104 CA ALA A 7 -4.625 0.786 -13.841 1.00 0.31 C ATOM 105 C ALA A 7 -3.491 1.593 -14.412 1.00 0.30 C ATOM 106 O ALA A 7 -2.795 2.306 -13.711 1.00 0.32 O ATOM 107 CB ALA A 7 -4.195 -0.633 -13.754 1.00 0.34 C ATOM 0 H ALA A 7 -5.921 -0.013 -15.243 1.00 0.33 H new ATOM 0 HA ALA A 7 -4.879 1.200 -12.865 1.00 0.31 H new ATOM 0 HB1 ALA A 7 -3.315 -0.708 -13.116 1.00 0.34 H new ATOM 0 HB2 ALA A 7 -5.002 -1.232 -13.332 1.00 0.34 H new ATOM 0 HB3 ALA A 7 -3.953 -1.002 -14.751 1.00 0.34 H new ATOM 113 N GLN A 8 -3.315 1.435 -15.697 1.00 0.31 N ATOM 114 CA GLN A 8 -2.263 2.089 -16.439 1.00 0.34 C ATOM 115 C GLN A 8 -2.441 3.584 -16.334 1.00 0.35 C ATOM 116 O GLN A 8 -1.473 4.342 -16.302 1.00 0.39 O ATOM 117 CB GLN A 8 -2.316 1.637 -17.906 1.00 0.38 C ATOM 118 CG GLN A 8 -3.008 2.600 -18.852 1.00 0.96 C ATOM 119 CD GLN A 8 -2.249 2.789 -20.151 1.00 1.04 C ATOM 120 OE1 GLN A 8 -1.021 2.716 -20.180 1.00 1.59 O ATOM 121 NE2 GLN A 8 -2.966 3.032 -21.230 1.00 1.50 N ATOM 0 H GLN A 8 -3.909 0.837 -16.271 1.00 0.31 H new ATOM 0 HA GLN A 8 -1.290 1.820 -16.028 1.00 0.34 H new ATOM 0 HB2 GLN A 8 -1.297 1.476 -18.257 1.00 0.38 H new ATOM 0 HB3 GLN A 8 -2.826 0.675 -17.955 1.00 0.38 H new ATOM 0 HG2 GLN A 8 -4.010 2.231 -19.071 1.00 0.96 H new ATOM 0 HG3 GLN A 8 -3.125 3.566 -18.360 1.00 0.96 H new ATOM 0 HE21 GLN A 8 -3.983 3.085 -21.166 1.00 1.50 H new ATOM 0 HE22 GLN A 8 -2.504 3.167 -22.129 1.00 1.50 H new ATOM 130 N GLN A 9 -3.697 3.991 -16.271 1.00 0.36 N ATOM 131 CA GLN A 9 -4.018 5.400 -16.192 1.00 0.40 C ATOM 132 C GLN A 9 -4.148 5.841 -14.741 1.00 0.38 C ATOM 133 O GLN A 9 -3.795 6.961 -14.388 1.00 0.45 O ATOM 134 CB GLN A 9 -5.278 5.689 -16.998 1.00 0.48 C ATOM 135 CG GLN A 9 -5.096 5.369 -18.475 1.00 0.74 C ATOM 136 CD GLN A 9 -4.133 6.321 -19.162 1.00 1.65 C ATOM 137 OE1 GLN A 9 -2.849 6.000 -19.126 1.00 2.47 O flip ATOM 138 NE2 GLN A 9 -4.538 7.341 -19.712 1.00 2.31 N flip ATOM 0 H GLN A 9 -4.505 3.368 -16.273 1.00 0.36 H new ATOM 0 HA GLN A 9 -3.205 5.982 -16.627 1.00 0.40 H new ATOM 0 HB2 GLN A 9 -6.106 5.103 -16.599 1.00 0.48 H new ATOM 0 HB3 GLN A 9 -5.548 6.739 -16.885 1.00 0.48 H new ATOM 0 HG2 GLN A 9 -4.729 4.348 -18.580 1.00 0.74 H new ATOM 0 HG3 GLN A 9 -6.064 5.413 -18.975 1.00 0.74 H new ATOM 0 HE21 GLN A 9 -5.535 7.555 -19.719 1.00 2.31 H new ATOM 0 HE22 GLN A 9 -3.877 7.975 -20.162 1.00 2.31 H new ATOM 147 N THR A 10 -4.620 4.947 -13.890 1.00 0.34 N ATOM 148 CA THR A 10 -4.741 5.257 -12.480 1.00 0.34 C ATOM 149 C THR A 10 -3.375 5.221 -11.799 1.00 0.30 C ATOM 150 O THR A 10 -3.180 5.870 -10.773 1.00 0.30 O ATOM 151 CB THR A 10 -5.720 4.307 -11.766 1.00 0.37 C ATOM 152 OG1 THR A 10 -6.666 5.054 -10.996 1.00 0.48 O ATOM 153 CG2 THR A 10 -4.986 3.335 -10.868 1.00 0.34 C ATOM 0 H THR A 10 -4.923 4.008 -14.150 1.00 0.34 H new ATOM 0 HA THR A 10 -5.145 6.266 -12.405 1.00 0.34 H new ATOM 0 HB THR A 10 -6.247 3.737 -12.532 1.00 0.37 H new ATOM 0 HG1 THR A 10 -7.452 4.498 -10.815 1.00 0.48 H new ATOM 0 HG21 THR A 10 -5.705 2.678 -10.378 1.00 0.34 H new ATOM 0 HG22 THR A 10 -4.297 2.738 -11.465 1.00 0.34 H new ATOM 0 HG23 THR A 10 -4.427 3.888 -10.113 1.00 0.34 H new ATOM 161 N ALA A 11 -2.433 4.442 -12.336 1.00 0.29 N ATOM 162 CA ALA A 11 -1.056 4.518 -11.857 1.00 0.28 C ATOM 163 C ALA A 11 -0.555 5.961 -11.795 1.00 0.30 C ATOM 164 O ALA A 11 0.078 6.355 -10.827 1.00 0.31 O ATOM 165 CB ALA A 11 -0.128 3.708 -12.728 1.00 0.31 C ATOM 0 H ALA A 11 -2.594 3.768 -13.084 1.00 0.29 H new ATOM 0 HA ALA A 11 -1.056 4.104 -10.849 1.00 0.28 H new ATOM 0 HB1 ALA A 11 0.890 3.785 -12.345 1.00 0.31 H new ATOM 0 HB2 ALA A 11 -0.441 2.664 -12.720 1.00 0.31 H new ATOM 0 HB3 ALA A 11 -0.162 4.089 -13.749 1.00 0.31 H new ATOM 171 N GLN A 12 -0.825 6.747 -12.826 1.00 0.35 N ATOM 172 CA GLN A 12 -0.446 8.154 -12.817 1.00 0.40 C ATOM 173 C GLN A 12 -1.491 8.997 -12.091 1.00 0.40 C ATOM 174 O GLN A 12 -1.330 10.208 -11.952 1.00 0.45 O ATOM 175 CB GLN A 12 -0.235 8.682 -14.236 1.00 0.48 C ATOM 176 CG GLN A 12 -1.463 8.560 -15.113 1.00 0.98 C ATOM 177 CD GLN A 12 -1.283 9.199 -16.475 1.00 0.97 C ATOM 178 OE1 GLN A 12 -0.502 10.264 -16.528 1.00 1.30 O flip ATOM 179 NE2 GLN A 12 -1.850 8.747 -17.469 1.00 1.64 N flip ATOM 0 H GLN A 12 -1.301 6.439 -13.674 1.00 0.35 H new ATOM 0 HA GLN A 12 0.499 8.234 -12.280 1.00 0.40 H new ATOM 0 HB2 GLN A 12 0.063 9.729 -14.185 1.00 0.48 H new ATOM 0 HB3 GLN A 12 0.588 8.138 -14.699 1.00 0.48 H new ATOM 0 HG2 GLN A 12 -1.708 7.506 -15.242 1.00 0.98 H new ATOM 0 HG3 GLN A 12 -2.310 9.024 -14.609 1.00 0.98 H new ATOM 0 HE21 GLN A 12 -2.445 7.923 -17.386 1.00 1.64 H new ATOM 0 HE22 GLN A 12 -1.725 9.197 -18.376 1.00 1.64 H new ATOM 188 N GLU A 13 -2.554 8.355 -11.627 1.00 0.38 N ATOM 189 CA GLU A 13 -3.568 9.036 -10.818 1.00 0.39 C ATOM 190 C GLU A 13 -3.183 8.972 -9.349 1.00 0.37 C ATOM 191 O GLU A 13 -3.255 9.965 -8.639 1.00 0.42 O ATOM 192 CB GLU A 13 -4.953 8.428 -11.029 1.00 0.43 C ATOM 193 CG GLU A 13 -5.491 8.651 -12.423 1.00 1.10 C ATOM 194 CD GLU A 13 -5.625 10.120 -12.761 1.00 1.65 C ATOM 195 OE1 GLU A 13 -6.625 10.741 -12.338 1.00 1.64 O ATOM 196 OE2 GLU A 13 -4.731 10.662 -13.447 1.00 2.54 O ATOM 0 H GLU A 13 -2.741 7.366 -11.794 1.00 0.38 H new ATOM 0 HA GLU A 13 -3.612 10.078 -11.136 1.00 0.39 H new ATOM 0 HB2 GLU A 13 -4.907 7.357 -10.830 1.00 0.43 H new ATOM 0 HB3 GLU A 13 -5.646 8.857 -10.305 1.00 0.43 H new ATOM 0 HG2 GLU A 13 -4.829 8.174 -13.146 1.00 1.10 H new ATOM 0 HG3 GLU A 13 -6.464 8.169 -12.515 1.00 1.10 H new ATOM 203 N VAL A 14 -2.760 7.796 -8.907 1.00 0.34 N ATOM 204 CA VAL A 14 -2.174 7.644 -7.578 1.00 0.33 C ATOM 205 C VAL A 14 -0.854 8.395 -7.533 1.00 0.33 C ATOM 206 O VAL A 14 -0.521 9.083 -6.559 1.00 0.36 O ATOM 207 CB VAL A 14 -1.939 6.161 -7.228 1.00 0.32 C ATOM 208 CG1 VAL A 14 -1.147 5.472 -8.308 1.00 0.53 C ATOM 209 CG2 VAL A 14 -1.241 6.014 -5.893 1.00 0.49 C ATOM 0 H VAL A 14 -2.811 6.932 -9.447 1.00 0.34 H new ATOM 0 HA VAL A 14 -2.870 8.052 -6.845 1.00 0.33 H new ATOM 0 HB VAL A 14 -2.916 5.684 -7.155 1.00 0.32 H new ATOM 0 HG11 VAL A 14 -0.995 4.427 -8.037 1.00 0.53 H new ATOM 0 HG12 VAL A 14 -1.692 5.527 -9.250 1.00 0.53 H new ATOM 0 HG13 VAL A 14 -0.180 5.963 -8.419 1.00 0.53 H new ATOM 0 HG21 VAL A 14 -1.090 4.957 -5.676 1.00 0.49 H new ATOM 0 HG22 VAL A 14 -0.275 6.518 -5.930 1.00 0.49 H new ATOM 0 HG23 VAL A 14 -1.854 6.461 -5.111 1.00 0.49 H new ATOM 219 N LEU A 15 -0.121 8.291 -8.627 1.00 0.32 N ATOM 220 CA LEU A 15 1.072 9.055 -8.819 1.00 0.33 C ATOM 221 C LEU A 15 0.684 10.504 -8.943 1.00 0.39 C ATOM 222 O LEU A 15 1.471 11.412 -8.715 1.00 0.43 O ATOM 223 CB LEU A 15 1.729 8.606 -10.091 1.00 0.34 C ATOM 224 CG LEU A 15 3.109 9.145 -10.293 1.00 0.43 C ATOM 225 CD1 LEU A 15 4.101 8.023 -10.109 1.00 0.56 C ATOM 226 CD2 LEU A 15 3.240 9.789 -11.662 1.00 0.60 C ATOM 0 H LEU A 15 -0.348 7.669 -9.403 1.00 0.32 H new ATOM 0 HA LEU A 15 1.759 8.920 -7.984 1.00 0.33 H new ATOM 0 HB2 LEU A 15 1.772 7.517 -10.099 1.00 0.34 H new ATOM 0 HB3 LEU A 15 1.107 8.907 -10.934 1.00 0.34 H new ATOM 0 HG LEU A 15 3.314 9.922 -9.557 1.00 0.43 H new ATOM 0 HD11 LEU A 15 5.112 8.404 -10.254 1.00 0.56 H new ATOM 0 HD12 LEU A 15 4.007 7.616 -9.102 1.00 0.56 H new ATOM 0 HD13 LEU A 15 3.901 7.238 -10.838 1.00 0.56 H new ATOM 0 HD21 LEU A 15 4.252 10.174 -11.788 1.00 0.60 H new ATOM 0 HD22 LEU A 15 3.036 9.047 -12.434 1.00 0.60 H new ATOM 0 HD23 LEU A 15 2.526 10.608 -11.748 1.00 0.60 H new ATOM 238 N GLY A 16 -0.567 10.692 -9.305 1.00 0.43 N ATOM 239 CA GLY A 16 -1.131 12.015 -9.392 1.00 0.50 C ATOM 240 C GLY A 16 -1.122 12.673 -8.045 1.00 0.50 C ATOM 241 O GLY A 16 -1.089 13.889 -7.942 1.00 0.57 O ATOM 0 H GLY A 16 -1.213 9.939 -9.544 1.00 0.43 H new ATOM 0 HA2 GLY A 16 -0.561 12.615 -10.101 1.00 0.50 H new ATOM 0 HA3 GLY A 16 -2.152 11.959 -9.770 1.00 0.50 H new ATOM 245 N TYR A 17 -1.111 11.844 -7.011 1.00 0.45 N ATOM 246 CA TYR A 17 -1.069 12.323 -5.643 1.00 0.48 C ATOM 247 C TYR A 17 0.363 12.409 -5.171 1.00 0.50 C ATOM 248 O TYR A 17 0.639 12.930 -4.092 1.00 0.64 O ATOM 249 CB TYR A 17 -1.887 11.427 -4.716 1.00 0.49 C ATOM 250 CG TYR A 17 -3.374 11.588 -4.909 1.00 0.96 C ATOM 251 CD1 TYR A 17 -3.977 11.190 -6.087 1.00 1.41 C ATOM 252 CD2 TYR A 17 -4.170 12.152 -3.922 1.00 1.59 C ATOM 253 CE1 TYR A 17 -5.334 11.343 -6.284 1.00 2.13 C ATOM 254 CE2 TYR A 17 -5.530 12.313 -4.109 1.00 2.29 C ATOM 255 CZ TYR A 17 -6.107 11.905 -5.293 1.00 2.49 C ATOM 256 OH TYR A 17 -7.460 12.066 -5.488 1.00 3.27 O ATOM 0 H TYR A 17 -1.131 10.828 -7.099 1.00 0.45 H new ATOM 0 HA TYR A 17 -1.513 13.318 -5.616 1.00 0.48 H new ATOM 0 HB2 TYR A 17 -1.613 10.386 -4.890 1.00 0.49 H new ATOM 0 HB3 TYR A 17 -1.633 11.655 -3.681 1.00 0.49 H new ATOM 0 HD1 TYR A 17 -3.375 10.751 -6.868 1.00 1.41 H new ATOM 0 HD2 TYR A 17 -3.720 12.470 -2.993 1.00 1.59 H new ATOM 0 HE1 TYR A 17 -5.787 11.024 -7.211 1.00 2.13 H new ATOM 0 HE2 TYR A 17 -6.137 12.755 -3.333 1.00 2.29 H new ATOM 0 HH TYR A 17 -7.859 12.476 -4.692 1.00 3.27 H new ATOM 266 N ASN A 18 1.291 11.889 -5.969 1.00 0.43 N ATOM 267 CA ASN A 18 2.692 12.001 -5.598 1.00 0.51 C ATOM 268 C ASN A 18 3.246 13.298 -6.176 1.00 0.62 C ATOM 269 O ASN A 18 4.335 13.750 -5.819 1.00 0.77 O ATOM 270 CB ASN A 18 3.488 10.749 -6.033 1.00 0.60 C ATOM 271 CG ASN A 18 4.422 10.936 -7.227 1.00 1.20 C ATOM 272 OD1 ASN A 18 4.122 11.638 -8.188 1.00 2.03 O ATOM 273 ND2 ASN A 18 5.579 10.293 -7.166 1.00 1.65 N ATOM 0 H ASN A 18 1.106 11.403 -6.846 1.00 0.43 H new ATOM 0 HA ASN A 18 2.793 12.044 -4.514 1.00 0.51 H new ATOM 0 HB2 ASN A 18 4.079 10.404 -5.184 1.00 0.60 H new ATOM 0 HB3 ASN A 18 2.779 9.956 -6.271 1.00 0.60 H new ATOM 0 HD21 ASN A 18 6.249 10.374 -7.931 1.00 1.65 H new ATOM 0 HD22 ASN A 18 5.800 9.717 -6.354 1.00 1.65 H new ATOM 280 N ARG A 19 2.445 13.902 -7.050 1.00 0.61 N ATOM 281 CA ARG A 19 2.799 15.147 -7.715 1.00 0.80 C ATOM 282 C ARG A 19 1.747 16.221 -7.439 1.00 0.90 C ATOM 283 O ARG A 19 1.826 17.332 -7.969 1.00 1.10 O ATOM 284 CB ARG A 19 2.926 14.901 -9.220 1.00 0.83 C ATOM 285 CG ARG A 19 1.646 14.381 -9.852 1.00 1.26 C ATOM 286 CD ARG A 19 1.936 13.570 -11.101 1.00 1.01 C ATOM 287 NE ARG A 19 0.739 12.904 -11.619 1.00 1.65 N ATOM 288 CZ ARG A 19 -0.041 13.385 -12.590 1.00 1.85 C ATOM 289 NH1 ARG A 19 0.215 14.561 -13.148 1.00 1.70 N ATOM 290 NH2 ARG A 19 -1.096 12.685 -12.990 1.00 2.72 N ATOM 0 H ARG A 19 1.530 13.538 -7.316 1.00 0.61 H new ATOM 0 HA ARG A 19 3.754 15.500 -7.326 1.00 0.80 H new ATOM 0 HB2 ARG A 19 3.214 15.831 -9.710 1.00 0.83 H new ATOM 0 HB3 ARG A 19 3.728 14.185 -9.398 1.00 0.83 H new ATOM 0 HG2 ARG A 19 1.108 13.764 -9.133 1.00 1.26 H new ATOM 0 HG3 ARG A 19 0.996 15.219 -10.103 1.00 1.26 H new ATOM 0 HD2 ARG A 19 2.347 14.224 -11.870 1.00 1.01 H new ATOM 0 HD3 ARG A 19 2.698 12.823 -10.878 1.00 1.01 H new ATOM 0 HE ARG A 19 0.482 12.007 -11.208 1.00 1.65 H new ATOM 0 HH11 ARG A 19 1.016 15.110 -12.836 1.00 1.70 H new ATOM 0 HH12 ARG A 19 -0.389 14.916 -13.889 1.00 1.70 H new ATOM 0 HH21 ARG A 19 -1.306 11.786 -12.556 1.00 2.72 H new ATOM 0 HH22 ARG A 19 -1.696 13.046 -13.731 1.00 2.72 H new ATOM 304 N ASP A 20 0.760 15.879 -6.616 1.00 0.87 N ATOM 305 CA ASP A 20 -0.356 16.782 -6.343 1.00 1.08 C ATOM 306 C ASP A 20 -0.056 17.661 -5.155 1.00 0.94 C ATOM 307 O ASP A 20 0.050 17.183 -4.027 1.00 1.32 O ATOM 308 CB ASP A 20 -1.638 16.017 -6.046 1.00 1.59 C ATOM 309 CG ASP A 20 -2.850 16.931 -5.984 1.00 1.74 C ATOM 310 OD1 ASP A 20 -3.341 17.346 -7.057 1.00 1.91 O ATOM 311 OD2 ASP A 20 -3.327 17.234 -4.869 1.00 2.16 O ATOM 0 H ASP A 20 0.709 14.985 -6.127 1.00 0.87 H new ATOM 0 HA ASP A 20 -0.492 17.387 -7.239 1.00 1.08 H new ATOM 0 HB2 ASP A 20 -1.794 15.261 -6.815 1.00 1.59 H new ATOM 0 HB3 ASP A 20 -1.533 15.490 -5.098 1.00 1.59 H new ATOM 316 N THR A 21 0.090 18.937 -5.406 1.00 0.91 N ATOM 317 CA THR A 21 0.307 19.882 -4.344 1.00 1.05 C ATOM 318 C THR A 21 -0.663 21.035 -4.493 1.00 1.13 C ATOM 319 O THR A 21 -0.423 21.991 -5.231 1.00 1.46 O ATOM 320 CB THR A 21 1.767 20.350 -4.334 1.00 1.45 C ATOM 321 OG1 THR A 21 2.120 20.919 -5.604 1.00 1.82 O ATOM 322 CG2 THR A 21 2.661 19.158 -4.034 1.00 1.70 C ATOM 0 H THR A 21 0.062 19.345 -6.340 1.00 0.91 H new ATOM 0 HA THR A 21 0.121 19.407 -3.381 1.00 1.05 H new ATOM 0 HB THR A 21 1.897 21.115 -3.568 1.00 1.45 H new ATOM 0 HG1 THR A 21 1.405 21.518 -5.904 1.00 1.82 H new ATOM 0 HG21 THR A 21 3.703 19.478 -4.024 1.00 1.70 H new ATOM 0 HG22 THR A 21 2.400 18.743 -3.061 1.00 1.70 H new ATOM 0 HG23 THR A 21 2.522 18.397 -4.802 1.00 1.70 H new ATOM 330 N SER A 22 -1.779 20.907 -3.803 1.00 1.05 N ATOM 331 CA SER A 22 -2.904 21.803 -3.999 1.00 1.30 C ATOM 332 C SER A 22 -3.364 22.409 -2.676 1.00 1.31 C ATOM 333 O SER A 22 -3.035 23.554 -2.361 1.00 2.15 O ATOM 334 CB SER A 22 -4.056 21.054 -4.682 1.00 1.67 C ATOM 335 OG SER A 22 -5.168 21.904 -4.916 1.00 2.19 O ATOM 0 H SER A 22 -1.932 20.187 -3.097 1.00 1.05 H new ATOM 0 HA SER A 22 -2.584 22.622 -4.643 1.00 1.30 H new ATOM 0 HB2 SER A 22 -3.710 20.639 -5.628 1.00 1.67 H new ATOM 0 HB3 SER A 22 -4.364 20.214 -4.059 1.00 1.67 H new ATOM 0 HG SER A 22 -5.882 21.395 -5.353 1.00 2.19 H new ATOM 341 N GLY A 23 -4.102 21.637 -1.892 1.00 0.96 N ATOM 342 CA GLY A 23 -4.630 22.147 -0.645 1.00 1.10 C ATOM 343 C GLY A 23 -4.585 21.121 0.460 1.00 0.89 C ATOM 344 O GLY A 23 -5.620 20.730 0.997 1.00 1.01 O ATOM 0 H GLY A 23 -4.344 20.668 -2.097 1.00 0.96 H new ATOM 0 HA2 GLY A 23 -4.060 23.026 -0.345 1.00 1.10 H new ATOM 0 HA3 GLY A 23 -5.660 22.471 -0.795 1.00 1.10 H new ATOM 348 N TRP A 24 -3.388 20.664 0.782 1.00 0.79 N ATOM 349 CA TRP A 24 -3.204 19.724 1.874 1.00 0.66 C ATOM 350 C TRP A 24 -2.281 20.314 2.924 1.00 0.67 C ATOM 351 O TRP A 24 -2.016 21.518 2.935 1.00 0.83 O ATOM 352 CB TRP A 24 -2.705 18.364 1.358 1.00 0.71 C ATOM 353 CG TRP A 24 -1.326 18.335 0.784 1.00 0.81 C ATOM 354 CD1 TRP A 24 -0.353 19.278 0.908 1.00 1.34 C ATOM 355 CD2 TRP A 24 -0.761 17.273 0.012 1.00 0.87 C ATOM 356 NE1 TRP A 24 0.781 18.865 0.276 1.00 1.41 N ATOM 357 CE2 TRP A 24 0.558 17.638 -0.292 1.00 0.99 C ATOM 358 CE3 TRP A 24 -1.245 16.046 -0.448 1.00 1.36 C ATOM 359 CZ2 TRP A 24 1.404 16.823 -1.040 1.00 1.09 C ATOM 360 CZ3 TRP A 24 -0.408 15.236 -1.190 1.00 1.67 C ATOM 361 CH2 TRP A 24 0.905 15.626 -1.476 1.00 1.37 C ATOM 0 H TRP A 24 -2.528 20.929 0.302 1.00 0.79 H new ATOM 0 HA TRP A 24 -4.169 19.543 2.347 1.00 0.66 H new ATOM 0 HB2 TRP A 24 -2.747 17.650 2.181 1.00 0.71 H new ATOM 0 HB3 TRP A 24 -3.400 18.013 0.595 1.00 0.71 H new ATOM 0 HD1 TRP A 24 -0.463 20.216 1.431 1.00 1.34 H new ATOM 0 HE1 TRP A 24 1.657 19.386 0.233 1.00 1.41 H new ATOM 0 HE3 TRP A 24 -2.256 15.736 -0.227 1.00 1.36 H new ATOM 0 HZ2 TRP A 24 2.416 17.124 -1.267 1.00 1.09 H new ATOM 0 HZ3 TRP A 24 -0.772 14.287 -1.555 1.00 1.67 H new ATOM 0 HH2 TRP A 24 1.538 14.968 -2.053 1.00 1.37 H new ATOM 372 N LYS A 25 -1.781 19.452 3.775 1.00 0.60 N ATOM 373 CA LYS A 25 -1.020 19.831 4.936 1.00 0.70 C ATOM 374 C LYS A 25 -0.551 18.577 5.620 1.00 0.61 C ATOM 375 O LYS A 25 -1.317 17.623 5.758 1.00 0.59 O ATOM 376 CB LYS A 25 -1.878 20.630 5.904 1.00 0.89 C ATOM 377 CG LYS A 25 -1.442 22.070 6.060 1.00 1.29 C ATOM 378 CD LYS A 25 -2.246 22.763 7.146 1.00 1.62 C ATOM 379 CE LYS A 25 -2.167 21.994 8.458 1.00 2.23 C ATOM 380 NZ LYS A 25 -0.840 22.130 9.119 1.00 2.95 N ATOM 0 H LYS A 25 -1.896 18.443 3.675 1.00 0.60 H new ATOM 0 HA LYS A 25 -0.176 20.449 4.628 1.00 0.70 H new ATOM 0 HB2 LYS A 25 -2.912 20.608 5.561 1.00 0.89 H new ATOM 0 HB3 LYS A 25 -1.856 20.145 6.880 1.00 0.89 H new ATOM 0 HG2 LYS A 25 -0.381 22.109 6.306 1.00 1.29 H new ATOM 0 HG3 LYS A 25 -1.569 22.597 5.115 1.00 1.29 H new ATOM 0 HD2 LYS A 25 -1.871 23.776 7.291 1.00 1.62 H new ATOM 0 HD3 LYS A 25 -3.287 22.850 6.834 1.00 1.62 H new ATOM 0 HE2 LYS A 25 -2.944 22.353 9.133 1.00 2.23 H new ATOM 0 HE3 LYS A 25 -2.370 20.940 8.270 1.00 2.23 H new ATOM 0 HZ1 LYS A 25 -0.837 21.589 10.007 1.00 2.95 H new ATOM 0 HZ2 LYS A 25 -0.099 21.764 8.488 1.00 2.95 H new ATOM 0 HZ3 LYS A 25 -0.656 23.133 9.324 1.00 2.95 H new ATOM 394 N VAL A 26 0.694 18.553 6.024 1.00 0.63 N ATOM 395 CA VAL A 26 1.202 17.410 6.736 1.00 0.58 C ATOM 396 C VAL A 26 0.537 17.281 8.077 1.00 0.66 C ATOM 397 O VAL A 26 0.535 18.202 8.893 1.00 0.80 O ATOM 398 CB VAL A 26 2.714 17.443 6.911 1.00 0.64 C ATOM 399 CG1 VAL A 26 3.360 17.039 5.621 1.00 1.22 C ATOM 400 CG2 VAL A 26 3.191 18.808 7.339 1.00 1.56 C ATOM 0 H VAL A 26 1.368 19.304 5.874 1.00 0.63 H new ATOM 0 HA VAL A 26 0.966 16.539 6.124 1.00 0.58 H new ATOM 0 HB VAL A 26 2.994 16.744 7.699 1.00 0.64 H new ATOM 0 HG11 VAL A 26 4.444 17.059 5.735 1.00 1.22 H new ATOM 0 HG12 VAL A 26 3.042 16.031 5.355 1.00 1.22 H new ATOM 0 HG13 VAL A 26 3.065 17.733 4.834 1.00 1.22 H new ATOM 0 HG21 VAL A 26 4.275 18.795 7.454 1.00 1.56 H new ATOM 0 HG22 VAL A 26 2.915 19.543 6.583 1.00 1.56 H new ATOM 0 HG23 VAL A 26 2.728 19.074 8.289 1.00 1.56 H new ATOM 410 N VAL A 27 -0.042 16.130 8.278 1.00 0.62 N ATOM 411 CA VAL A 27 -0.740 15.835 9.498 1.00 0.73 C ATOM 412 C VAL A 27 0.180 15.054 10.409 1.00 0.76 C ATOM 413 O VAL A 27 0.014 15.050 11.631 1.00 0.90 O ATOM 414 CB VAL A 27 -2.041 15.037 9.231 1.00 0.75 C ATOM 415 CG1 VAL A 27 -1.733 13.666 8.647 1.00 1.21 C ATOM 416 CG2 VAL A 27 -2.877 14.905 10.498 1.00 1.22 C ATOM 0 H VAL A 27 -0.043 15.369 7.599 1.00 0.62 H new ATOM 0 HA VAL A 27 -1.029 16.772 9.974 1.00 0.73 H new ATOM 0 HB VAL A 27 -2.624 15.595 8.498 1.00 0.75 H new ATOM 0 HG11 VAL A 27 -2.664 13.128 8.470 1.00 1.21 H new ATOM 0 HG12 VAL A 27 -1.197 13.784 7.705 1.00 1.21 H new ATOM 0 HG13 VAL A 27 -1.116 13.102 9.347 1.00 1.21 H new ATOM 0 HG21 VAL A 27 -3.783 14.340 10.279 1.00 1.22 H new ATOM 0 HG22 VAL A 27 -2.300 14.383 11.262 1.00 1.22 H new ATOM 0 HG23 VAL A 27 -3.146 15.897 10.861 1.00 1.22 H new ATOM 426 N LYS A 28 1.170 14.394 9.810 1.00 0.65 N ATOM 427 CA LYS A 28 2.023 13.522 10.578 1.00 0.68 C ATOM 428 C LYS A 28 3.382 13.342 9.924 1.00 0.58 C ATOM 429 O LYS A 28 3.494 12.768 8.846 1.00 0.55 O ATOM 430 CB LYS A 28 1.347 12.162 10.776 1.00 0.77 C ATOM 431 CG LYS A 28 1.729 11.503 12.083 1.00 0.87 C ATOM 432 CD LYS A 28 1.452 12.448 13.236 1.00 1.45 C ATOM 433 CE LYS A 28 1.988 11.908 14.551 1.00 2.02 C ATOM 434 NZ LYS A 28 1.263 10.686 14.991 1.00 2.41 N ATOM 0 H LYS A 28 1.390 14.451 8.816 1.00 0.65 H new ATOM 0 HA LYS A 28 2.184 13.990 11.549 1.00 0.68 H new ATOM 0 HB2 LYS A 28 0.265 12.291 10.742 1.00 0.77 H new ATOM 0 HB3 LYS A 28 1.616 11.504 9.950 1.00 0.77 H new ATOM 0 HG2 LYS A 28 1.164 10.580 12.214 1.00 0.87 H new ATOM 0 HG3 LYS A 28 2.785 11.232 12.069 1.00 0.87 H new ATOM 0 HD2 LYS A 28 1.907 13.417 13.029 1.00 1.45 H new ATOM 0 HD3 LYS A 28 0.378 12.612 13.321 1.00 1.45 H new ATOM 0 HE2 LYS A 28 3.049 11.681 14.444 1.00 2.02 H new ATOM 0 HE3 LYS A 28 1.903 12.676 15.320 1.00 2.02 H new ATOM 0 HZ1 LYS A 28 1.650 10.361 15.900 1.00 2.41 H new ATOM 0 HZ2 LYS A 28 0.252 10.903 15.102 1.00 2.41 H new ATOM 0 HZ3 LYS A 28 1.380 9.938 14.278 1.00 2.41 H new ATOM 448 N THR A 29 4.408 13.853 10.571 1.00 0.61 N ATOM 449 CA THR A 29 5.773 13.619 10.145 1.00 0.59 C ATOM 450 C THR A 29 6.609 13.179 11.336 1.00 0.72 C ATOM 451 O THR A 29 6.614 13.839 12.373 1.00 0.88 O ATOM 452 CB THR A 29 6.403 14.878 9.520 1.00 0.75 C ATOM 453 OG1 THR A 29 6.392 15.960 10.460 1.00 1.38 O ATOM 454 CG2 THR A 29 5.663 15.301 8.264 1.00 0.82 C ATOM 0 H THR A 29 4.322 14.439 11.402 1.00 0.61 H new ATOM 0 HA THR A 29 5.754 12.838 9.384 1.00 0.59 H new ATOM 0 HB THR A 29 7.431 14.632 9.254 1.00 0.75 H new ATOM 0 HG1 THR A 29 6.411 15.601 11.372 1.00 1.38 H new ATOM 0 HG21 THR A 29 6.133 16.192 7.848 1.00 0.82 H new ATOM 0 HG22 THR A 29 5.700 14.495 7.531 1.00 0.82 H new ATOM 0 HG23 THR A 29 4.624 15.520 8.510 1.00 0.82 H new ATOM 462 N SER A 30 7.293 12.057 11.195 1.00 0.80 N ATOM 463 CA SER A 30 8.113 11.532 12.273 1.00 1.04 C ATOM 464 C SER A 30 9.502 12.166 12.262 1.00 1.45 C ATOM 465 O SER A 30 9.770 13.095 13.019 1.00 2.37 O ATOM 466 CB SER A 30 8.208 10.011 12.168 1.00 1.24 C ATOM 467 OG SER A 30 6.916 9.434 12.125 1.00 1.93 O ATOM 0 H SER A 30 7.297 11.492 10.346 1.00 0.80 H new ATOM 0 HA SER A 30 7.640 11.786 13.222 1.00 1.04 H new ATOM 0 HB2 SER A 30 8.765 9.737 11.272 1.00 1.24 H new ATOM 0 HB3 SER A 30 8.761 9.616 13.020 1.00 1.24 H new ATOM 0 HG SER A 30 6.972 8.488 12.375 1.00 1.93 H new ATOM 473 N LYS A 31 10.375 11.680 11.390 1.00 1.32 N ATOM 474 CA LYS A 31 11.728 12.217 11.287 1.00 1.71 C ATOM 475 C LYS A 31 12.345 11.880 9.935 1.00 1.47 C ATOM 476 O LYS A 31 13.567 11.779 9.813 1.00 2.02 O ATOM 477 CB LYS A 31 12.608 11.674 12.420 1.00 2.29 C ATOM 478 CG LYS A 31 12.591 10.158 12.544 1.00 2.73 C ATOM 479 CD LYS A 31 13.575 9.668 13.595 1.00 3.59 C ATOM 480 CE LYS A 31 13.275 10.241 14.974 1.00 4.18 C ATOM 481 NZ LYS A 31 11.968 9.775 15.511 1.00 4.55 N ATOM 0 H LYS A 31 10.173 10.917 10.744 1.00 1.32 H new ATOM 0 HA LYS A 31 11.669 13.302 11.377 1.00 1.71 H new ATOM 0 HB2 LYS A 31 13.634 12.004 12.259 1.00 2.29 H new ATOM 0 HB3 LYS A 31 12.278 12.109 13.363 1.00 2.29 H new ATOM 0 HG2 LYS A 31 11.586 9.825 12.804 1.00 2.73 H new ATOM 0 HG3 LYS A 31 12.836 9.711 11.580 1.00 2.73 H new ATOM 0 HD2 LYS A 31 13.543 8.579 13.641 1.00 3.59 H new ATOM 0 HD3 LYS A 31 14.587 9.945 13.300 1.00 3.59 H new ATOM 0 HE2 LYS A 31 14.070 9.956 15.663 1.00 4.18 H new ATOM 0 HE3 LYS A 31 13.275 11.330 14.920 1.00 4.18 H new ATOM 0 HZ1 LYS A 31 11.848 10.123 16.484 1.00 4.55 H new ATOM 0 HZ2 LYS A 31 11.198 10.140 14.915 1.00 4.55 H new ATOM 0 HZ3 LYS A 31 11.943 8.735 15.510 1.00 4.55 H new ATOM 495 N LYS A 32 11.489 11.734 8.922 1.00 0.87 N ATOM 496 CA LYS A 32 11.918 11.337 7.578 1.00 0.69 C ATOM 497 C LYS A 32 10.707 11.024 6.707 1.00 0.51 C ATOM 498 O LYS A 32 10.793 11.012 5.476 1.00 0.59 O ATOM 499 CB LYS A 32 12.828 10.112 7.640 1.00 0.80 C ATOM 500 CG LYS A 32 13.613 9.867 6.361 1.00 1.00 C ATOM 501 CD LYS A 32 14.885 9.067 6.619 1.00 0.93 C ATOM 502 CE LYS A 32 16.001 9.928 7.208 1.00 1.14 C ATOM 503 NZ LYS A 32 15.696 10.416 8.582 1.00 1.42 N ATOM 0 H LYS A 32 10.484 11.886 9.008 1.00 0.87 H new ATOM 0 HA LYS A 32 12.472 12.168 7.142 1.00 0.69 H new ATOM 0 HB2 LYS A 32 13.527 10.232 8.467 1.00 0.80 H new ATOM 0 HB3 LYS A 32 12.223 9.232 7.859 1.00 0.80 H new ATOM 0 HG2 LYS A 32 12.986 9.332 5.647 1.00 1.00 H new ATOM 0 HG3 LYS A 32 13.871 10.823 5.905 1.00 1.00 H new ATOM 0 HD2 LYS A 32 14.663 8.246 7.301 1.00 0.93 H new ATOM 0 HD3 LYS A 32 15.227 8.621 5.685 1.00 0.93 H new ATOM 0 HE2 LYS A 32 16.925 9.350 7.230 1.00 1.14 H new ATOM 0 HE3 LYS A 32 16.176 10.783 6.555 1.00 1.14 H new ATOM 0 HZ1 LYS A 32 16.579 10.691 9.057 1.00 1.42 H new ATOM 0 HZ2 LYS A 32 15.062 11.239 8.526 1.00 1.42 H new ATOM 0 HZ3 LYS A 32 15.233 9.659 9.124 1.00 1.42 H new ATOM 517 N ILE A 33 9.586 10.740 7.358 1.00 0.37 N ATOM 518 CA ILE A 33 8.343 10.460 6.658 1.00 0.33 C ATOM 519 C ILE A 33 7.360 11.600 6.845 1.00 0.36 C ATOM 520 O ILE A 33 7.441 12.350 7.818 1.00 0.46 O ATOM 521 CB ILE A 33 7.706 9.143 7.122 1.00 0.41 C ATOM 522 CG1 ILE A 33 7.437 9.181 8.623 1.00 0.58 C ATOM 523 CG2 ILE A 33 8.614 7.973 6.774 1.00 0.76 C ATOM 524 CD1 ILE A 33 6.637 7.996 9.111 1.00 0.75 C ATOM 0 H ILE A 33 9.514 10.698 8.375 1.00 0.37 H new ATOM 0 HA ILE A 33 8.586 10.360 5.600 1.00 0.33 H new ATOM 0 HB ILE A 33 6.755 9.013 6.606 1.00 0.41 H new ATOM 0 HG12 ILE A 33 8.387 9.215 9.156 1.00 0.58 H new ATOM 0 HG13 ILE A 33 6.902 10.099 8.867 1.00 0.58 H new ATOM 0 HG21 ILE A 33 8.153 7.043 7.107 1.00 0.76 H new ATOM 0 HG22 ILE A 33 8.764 7.937 5.695 1.00 0.76 H new ATOM 0 HG23 ILE A 33 9.576 8.099 7.270 1.00 0.76 H new ATOM 0 HD11 ILE A 33 6.479 8.082 10.186 1.00 0.75 H new ATOM 0 HD12 ILE A 33 5.673 7.974 8.603 1.00 0.75 H new ATOM 0 HD13 ILE A 33 7.181 7.076 8.896 1.00 0.75 H new ATOM 536 N THR A 34 6.421 11.700 5.926 1.00 0.33 N ATOM 537 CA THR A 34 5.624 12.903 5.777 1.00 0.36 C ATOM 538 C THR A 34 4.218 12.574 5.275 1.00 0.36 C ATOM 539 O THR A 34 4.016 12.340 4.087 1.00 0.39 O ATOM 540 CB THR A 34 6.344 13.836 4.776 1.00 0.39 C ATOM 541 OG1 THR A 34 7.664 14.144 5.250 1.00 0.58 O ATOM 542 CG2 THR A 34 5.589 15.123 4.548 1.00 0.56 C ATOM 0 H THR A 34 6.189 10.957 5.266 1.00 0.33 H new ATOM 0 HA THR A 34 5.518 13.392 6.745 1.00 0.36 H new ATOM 0 HB THR A 34 6.398 13.303 3.827 1.00 0.39 H new ATOM 0 HG1 THR A 34 8.113 14.734 4.609 1.00 0.58 H new ATOM 0 HG21 THR A 34 6.135 15.744 3.838 1.00 0.56 H new ATOM 0 HG22 THR A 34 4.600 14.899 4.149 1.00 0.56 H new ATOM 0 HG23 THR A 34 5.486 15.657 5.493 1.00 0.56 H new ATOM 550 N VAL A 35 3.252 12.540 6.188 1.00 0.39 N ATOM 551 CA VAL A 35 1.870 12.255 5.823 1.00 0.40 C ATOM 552 C VAL A 35 1.094 13.553 5.639 1.00 0.40 C ATOM 553 O VAL A 35 0.783 14.244 6.606 1.00 0.44 O ATOM 554 CB VAL A 35 1.141 11.396 6.880 1.00 0.48 C ATOM 555 CG1 VAL A 35 -0.049 10.692 6.252 1.00 0.82 C ATOM 556 CG2 VAL A 35 2.079 10.396 7.539 1.00 0.86 C ATOM 0 H VAL A 35 3.401 12.706 7.183 1.00 0.39 H new ATOM 0 HA VAL A 35 1.908 11.692 4.891 1.00 0.40 H new ATOM 0 HB VAL A 35 0.781 12.062 7.664 1.00 0.48 H new ATOM 0 HG11 VAL A 35 -0.555 10.090 7.006 1.00 0.82 H new ATOM 0 HG12 VAL A 35 -0.742 11.433 5.855 1.00 0.82 H new ATOM 0 HG13 VAL A 35 0.295 10.047 5.443 1.00 0.82 H new ATOM 0 HG21 VAL A 35 1.528 9.811 8.276 1.00 0.86 H new ATOM 0 HG22 VAL A 35 2.491 9.729 6.781 1.00 0.86 H new ATOM 0 HG23 VAL A 35 2.891 10.930 8.033 1.00 0.86 H new ATOM 566 N SER A 36 0.801 13.881 4.399 1.00 0.42 N ATOM 567 CA SER A 36 0.029 15.065 4.065 1.00 0.42 C ATOM 568 C SER A 36 -1.437 14.713 3.864 1.00 0.43 C ATOM 569 O SER A 36 -1.783 13.818 3.092 1.00 0.47 O ATOM 570 CB SER A 36 0.632 15.716 2.830 1.00 0.45 C ATOM 571 OG SER A 36 0.950 14.745 1.848 1.00 1.10 O ATOM 0 H SER A 36 1.091 13.334 3.589 1.00 0.42 H new ATOM 0 HA SER A 36 0.070 15.778 4.888 1.00 0.42 H new ATOM 0 HB2 SER A 36 -0.070 16.440 2.417 1.00 0.45 H new ATOM 0 HB3 SER A 36 1.531 16.266 3.107 1.00 0.45 H new ATOM 0 HG SER A 36 0.521 14.984 1.000 1.00 1.10 H new ATOM 577 N SER A 37 -2.279 15.417 4.593 1.00 0.45 N ATOM 578 CA SER A 37 -3.705 15.187 4.596 1.00 0.48 C ATOM 579 C SER A 37 -4.386 16.261 3.765 1.00 0.53 C ATOM 580 O SER A 37 -4.159 17.453 3.972 1.00 0.59 O ATOM 581 CB SER A 37 -4.223 15.215 6.040 1.00 0.59 C ATOM 582 OG SER A 37 -5.602 14.897 6.119 1.00 1.27 O ATOM 0 H SER A 37 -1.985 16.176 5.208 1.00 0.45 H new ATOM 0 HA SER A 37 -3.927 14.211 4.164 1.00 0.48 H new ATOM 0 HB2 SER A 37 -3.653 14.508 6.643 1.00 0.59 H new ATOM 0 HB3 SER A 37 -4.055 16.204 6.466 1.00 0.59 H new ATOM 0 HG SER A 37 -5.715 14.049 6.596 1.00 1.27 H new ATOM 588 N LYS A 38 -5.207 15.839 2.823 1.00 0.59 N ATOM 589 CA LYS A 38 -5.878 16.777 1.931 1.00 0.76 C ATOM 590 C LYS A 38 -7.392 16.658 2.053 1.00 0.90 C ATOM 591 O LYS A 38 -8.010 17.372 2.841 1.00 1.69 O ATOM 592 CB LYS A 38 -5.432 16.549 0.480 1.00 0.99 C ATOM 593 CG LYS A 38 -5.863 17.647 -0.485 1.00 1.06 C ATOM 594 CD LYS A 38 -5.148 17.527 -1.827 1.00 1.11 C ATOM 595 CE LYS A 38 -5.640 16.338 -2.641 1.00 1.44 C ATOM 596 NZ LYS A 38 -6.927 16.628 -3.328 1.00 1.91 N ATOM 0 H LYS A 38 -5.428 14.858 2.652 1.00 0.59 H new ATOM 0 HA LYS A 38 -5.596 17.788 2.225 1.00 0.76 H new ATOM 0 HB2 LYS A 38 -4.346 16.464 0.455 1.00 0.99 H new ATOM 0 HB3 LYS A 38 -5.834 15.597 0.133 1.00 0.99 H new ATOM 0 HG2 LYS A 38 -6.941 17.594 -0.640 1.00 1.06 H new ATOM 0 HG3 LYS A 38 -5.652 18.622 -0.046 1.00 1.06 H new ATOM 0 HD2 LYS A 38 -5.298 18.443 -2.399 1.00 1.11 H new ATOM 0 HD3 LYS A 38 -4.076 17.429 -1.657 1.00 1.11 H new ATOM 0 HE2 LYS A 38 -4.887 16.069 -3.381 1.00 1.44 H new ATOM 0 HE3 LYS A 38 -5.765 15.476 -1.985 1.00 1.44 H new ATOM 0 HZ1 LYS A 38 -7.227 15.793 -3.871 1.00 1.91 H new ATOM 0 HZ2 LYS A 38 -7.653 16.860 -2.621 1.00 1.91 H new ATOM 0 HZ3 LYS A 38 -6.802 17.434 -3.973 1.00 1.91 H new ATOM 610 N ALA A 39 -7.981 15.741 1.296 1.00 1.16 N ATOM 611 CA ALA A 39 -9.422 15.527 1.317 1.00 1.25 C ATOM 612 C ALA A 39 -9.786 14.360 0.420 1.00 1.19 C ATOM 613 O ALA A 39 -9.100 14.091 -0.563 1.00 1.50 O ATOM 614 CB ALA A 39 -10.174 16.778 0.876 1.00 1.68 C ATOM 0 H ALA A 39 -7.477 15.129 0.654 1.00 1.16 H new ATOM 0 HA ALA A 39 -9.715 15.301 2.342 1.00 1.25 H new ATOM 0 HB1 ALA A 39 -11.247 16.586 0.902 1.00 1.68 H new ATOM 0 HB2 ALA A 39 -9.936 17.602 1.549 1.00 1.68 H new ATOM 0 HB3 ALA A 39 -9.878 17.042 -0.139 1.00 1.68 H new ATOM 620 N SER A 40 -10.843 13.654 0.780 1.00 1.11 N ATOM 621 CA SER A 40 -11.319 12.537 -0.013 1.00 1.35 C ATOM 622 C SER A 40 -12.835 12.445 0.045 1.00 1.53 C ATOM 623 O SER A 40 -13.490 12.116 -0.943 1.00 2.09 O ATOM 624 CB SER A 40 -10.714 11.238 0.505 1.00 1.66 C ATOM 625 OG SER A 40 -11.223 10.130 -0.199 1.00 2.06 O ATOM 0 H SER A 40 -11.390 13.837 1.621 1.00 1.11 H new ATOM 0 HA SER A 40 -11.015 12.697 -1.047 1.00 1.35 H new ATOM 0 HB2 SER A 40 -9.629 11.271 0.403 1.00 1.66 H new ATOM 0 HB3 SER A 40 -10.931 11.130 1.568 1.00 1.66 H new ATOM 0 HG SER A 40 -11.450 10.400 -1.113 1.00 2.06 H new ATOM 631 N ARG A 41 -13.369 12.741 1.233 1.00 1.87 N ATOM 632 CA ARG A 41 -14.801 12.666 1.520 1.00 2.15 C ATOM 633 C ARG A 41 -15.306 11.226 1.482 1.00 1.92 C ATOM 634 O ARG A 41 -16.510 10.986 1.563 1.00 2.12 O ATOM 635 CB ARG A 41 -15.620 13.523 0.550 1.00 3.07 C ATOM 636 CG ARG A 41 -15.149 14.966 0.446 1.00 3.62 C ATOM 637 CD ARG A 41 -15.234 15.688 1.778 1.00 4.44 C ATOM 638 NE ARG A 41 -14.444 16.919 1.778 1.00 4.95 N ATOM 639 CZ ARG A 41 -13.948 17.487 2.875 1.00 5.91 C ATOM 640 NH1 ARG A 41 -14.266 17.013 4.073 1.00 6.46 N ATOM 641 NH2 ARG A 41 -13.159 18.549 2.777 1.00 6.61 N ATOM 0 H ARG A 41 -12.811 13.043 2.031 1.00 1.87 H new ATOM 0 HA ARG A 41 -14.935 13.058 2.528 1.00 2.15 H new ATOM 0 HB2 ARG A 41 -15.583 13.068 -0.440 1.00 3.07 H new ATOM 0 HB3 ARG A 41 -16.663 13.514 0.866 1.00 3.07 H new ATOM 0 HG2 ARG A 41 -14.120 14.987 0.087 1.00 3.62 H new ATOM 0 HG3 ARG A 41 -15.754 15.493 -0.292 1.00 3.62 H new ATOM 0 HD2 ARG A 41 -16.275 15.924 1.998 1.00 4.44 H new ATOM 0 HD3 ARG A 41 -14.882 15.030 2.572 1.00 4.44 H new ATOM 0 HE ARG A 41 -14.262 17.370 0.882 1.00 4.95 H new ATOM 0 HH11 ARG A 41 -14.892 16.212 4.155 1.00 6.46 H new ATOM 0 HH12 ARG A 41 -13.885 17.450 4.912 1.00 6.46 H new ATOM 0 HH21 ARG A 41 -12.931 18.932 1.860 1.00 6.61 H new ATOM 0 HH22 ARG A 41 -12.780 18.982 3.619 1.00 6.61 H new ATOM 655 N LYS A 42 -14.388 10.265 1.379 1.00 1.99 N ATOM 656 CA LYS A 42 -14.771 8.860 1.313 1.00 2.62 C ATOM 657 C LYS A 42 -15.306 8.367 2.651 1.00 2.59 C ATOM 658 O LYS A 42 -15.933 7.309 2.719 1.00 3.13 O ATOM 659 CB LYS A 42 -13.595 7.979 0.854 1.00 3.24 C ATOM 660 CG LYS A 42 -12.613 7.547 1.948 1.00 3.85 C ATOM 661 CD LYS A 42 -11.845 8.713 2.553 1.00 4.70 C ATOM 662 CE LYS A 42 -10.435 8.305 2.969 1.00 5.56 C ATOM 663 NZ LYS A 42 -10.429 7.126 3.879 1.00 6.46 N ATOM 0 H LYS A 42 -13.383 10.434 1.340 1.00 1.99 H new ATOM 0 HA LYS A 42 -15.568 8.780 0.574 1.00 2.62 H new ATOM 0 HB2 LYS A 42 -14.000 7.084 0.383 1.00 3.24 H new ATOM 0 HB3 LYS A 42 -13.040 8.519 0.087 1.00 3.24 H new ATOM 0 HG2 LYS A 42 -13.161 7.032 2.737 1.00 3.85 H new ATOM 0 HG3 LYS A 42 -11.905 6.831 1.531 1.00 3.85 H new ATOM 0 HD2 LYS A 42 -11.790 9.527 1.830 1.00 4.70 H new ATOM 0 HD3 LYS A 42 -12.385 9.093 3.420 1.00 4.70 H new ATOM 0 HE2 LYS A 42 -9.849 8.076 2.079 1.00 5.56 H new ATOM 0 HE3 LYS A 42 -9.948 9.145 3.464 1.00 5.56 H new ATOM 0 HZ1 LYS A 42 -9.486 7.022 4.306 1.00 6.46 H new ATOM 0 HZ2 LYS A 42 -11.136 7.263 4.629 1.00 6.46 H new ATOM 0 HZ3 LYS A 42 -10.660 6.269 3.338 1.00 6.46 H new ATOM 677 N PHE A 43 -15.080 9.139 3.714 1.00 2.24 N ATOM 678 CA PHE A 43 -15.489 8.707 5.040 1.00 2.56 C ATOM 679 C PHE A 43 -15.241 9.806 6.061 1.00 2.44 C ATOM 680 O PHE A 43 -16.172 10.451 6.533 1.00 3.00 O ATOM 681 CB PHE A 43 -14.723 7.442 5.446 1.00 3.06 C ATOM 682 CG PHE A 43 -15.444 6.598 6.465 1.00 3.83 C ATOM 683 CD1 PHE A 43 -15.690 7.089 7.735 1.00 4.19 C ATOM 684 CD2 PHE A 43 -15.870 5.314 6.156 1.00 4.52 C ATOM 685 CE1 PHE A 43 -16.344 6.320 8.677 1.00 5.06 C ATOM 686 CE2 PHE A 43 -16.526 4.540 7.097 1.00 5.45 C ATOM 687 CZ PHE A 43 -16.789 5.035 8.332 1.00 5.65 C ATOM 0 H PHE A 43 -14.624 10.051 3.680 1.00 2.24 H new ATOM 0 HA PHE A 43 -16.556 8.486 5.013 1.00 2.56 H new ATOM 0 HB2 PHE A 43 -14.535 6.841 4.557 1.00 3.06 H new ATOM 0 HB3 PHE A 43 -13.751 7.730 5.847 1.00 3.06 H new ATOM 0 HD1 PHE A 43 -15.366 8.087 7.993 1.00 4.19 H new ATOM 0 HD2 PHE A 43 -15.687 4.914 5.170 1.00 4.52 H new ATOM 0 HE1 PHE A 43 -16.512 6.705 9.672 1.00 5.06 H new ATOM 0 HE2 PHE A 43 -16.831 3.535 6.846 1.00 5.45 H new ATOM 0 HZ PHE A 43 -17.339 4.442 9.048 1.00 5.65 H new ATOM 697 N HIS A 44 -13.974 10.028 6.381 1.00 2.18 N ATOM 698 CA HIS A 44 -13.616 10.982 7.415 1.00 2.43 C ATOM 699 C HIS A 44 -13.081 12.271 6.798 1.00 1.88 C ATOM 700 O HIS A 44 -12.135 12.881 7.294 1.00 2.06 O ATOM 701 CB HIS A 44 -12.600 10.352 8.378 1.00 3.27 C ATOM 702 CG HIS A 44 -12.237 11.201 9.565 1.00 4.01 C ATOM 703 ND1 HIS A 44 -13.137 11.564 10.539 1.00 4.55 N ATOM 704 CD2 HIS A 44 -11.053 11.746 9.929 1.00 4.75 C ATOM 705 CE1 HIS A 44 -12.523 12.294 11.451 1.00 5.43 C ATOM 706 NE2 HIS A 44 -11.255 12.419 11.105 1.00 5.56 N ATOM 0 H HIS A 44 -13.181 9.561 5.940 1.00 2.18 H new ATOM 0 HA HIS A 44 -14.508 11.242 7.985 1.00 2.43 H new ATOM 0 HB2 HIS A 44 -13.002 9.405 8.737 1.00 3.27 H new ATOM 0 HB3 HIS A 44 -11.690 10.122 7.823 1.00 3.27 H new ATOM 0 HD2 HIS A 44 -10.120 11.665 9.391 1.00 4.75 H new ATOM 0 HE1 HIS A 44 -12.981 12.718 12.332 1.00 5.43 H new ATOM 0 HE2 HIS A 44 -10.544 12.932 11.627 1.00 5.56 H new ATOM 715 N GLY A 45 -13.684 12.659 5.694 1.00 1.56 N ATOM 716 CA GLY A 45 -13.373 13.926 5.075 1.00 1.46 C ATOM 717 C GLY A 45 -12.077 13.927 4.300 1.00 1.27 C ATOM 718 O GLY A 45 -12.051 14.304 3.131 1.00 1.42 O ATOM 0 H GLY A 45 -14.394 12.112 5.207 1.00 1.56 H new ATOM 0 HA2 GLY A 45 -14.187 14.201 4.404 1.00 1.46 H new ATOM 0 HA3 GLY A 45 -13.324 14.694 5.847 1.00 1.46 H new ATOM 722 N ASN A 46 -11.005 13.478 4.925 1.00 1.06 N ATOM 723 CA ASN A 46 -9.683 13.704 4.377 1.00 0.90 C ATOM 724 C ASN A 46 -9.074 12.456 3.757 1.00 0.81 C ATOM 725 O ASN A 46 -9.592 11.345 3.896 1.00 0.95 O ATOM 726 CB ASN A 46 -8.756 14.251 5.458 1.00 0.91 C ATOM 727 CG ASN A 46 -9.062 15.692 5.829 1.00 1.32 C ATOM 728 OD1 ASN A 46 -10.219 16.120 5.846 1.00 2.05 O ATOM 729 ND2 ASN A 46 -8.019 16.459 6.109 1.00 1.87 N ATOM 0 H ASN A 46 -11.023 12.960 5.803 1.00 1.06 H new ATOM 0 HA ASN A 46 -9.796 14.434 3.575 1.00 0.90 H new ATOM 0 HB2 ASN A 46 -8.837 13.627 6.348 1.00 0.91 H new ATOM 0 HB3 ASN A 46 -7.724 14.182 5.113 1.00 0.91 H new ATOM 0 HD21 ASN A 46 -8.158 17.441 6.349 1.00 1.87 H new ATOM 0 HD22 ASN A 46 -7.077 16.068 6.084 1.00 1.87 H new ATOM 736 N LEU A 47 -7.969 12.679 3.065 1.00 0.70 N ATOM 737 CA LEU A 47 -7.196 11.633 2.415 1.00 0.62 C ATOM 738 C LEU A 47 -5.749 11.795 2.847 1.00 0.54 C ATOM 739 O LEU A 47 -5.304 12.921 3.077 1.00 0.58 O ATOM 740 CB LEU A 47 -7.347 11.761 0.894 1.00 0.66 C ATOM 741 CG LEU A 47 -6.617 10.718 0.048 1.00 0.70 C ATOM 742 CD1 LEU A 47 -7.328 10.552 -1.280 1.00 0.77 C ATOM 743 CD2 LEU A 47 -5.171 11.132 -0.187 1.00 0.87 C ATOM 0 H LEU A 47 -7.576 13.611 2.937 1.00 0.70 H new ATOM 0 HA LEU A 47 -7.548 10.641 2.699 1.00 0.62 H new ATOM 0 HB2 LEU A 47 -8.409 11.716 0.651 1.00 0.66 H new ATOM 0 HB3 LEU A 47 -6.994 12.749 0.598 1.00 0.66 H new ATOM 0 HG LEU A 47 -6.620 9.769 0.584 1.00 0.70 H new ATOM 0 HD11 LEU A 47 -6.806 9.808 -1.882 1.00 0.77 H new ATOM 0 HD12 LEU A 47 -8.353 10.224 -1.106 1.00 0.77 H new ATOM 0 HD13 LEU A 47 -7.337 11.505 -1.809 1.00 0.77 H new ATOM 0 HD21 LEU A 47 -4.670 10.376 -0.791 1.00 0.87 H new ATOM 0 HD22 LEU A 47 -5.147 12.088 -0.709 1.00 0.87 H new ATOM 0 HD23 LEU A 47 -4.660 11.229 0.771 1.00 0.87 H new ATOM 755 N TYR A 48 -5.009 10.700 2.955 1.00 0.48 N ATOM 756 CA TYR A 48 -3.690 10.767 3.563 1.00 0.45 C ATOM 757 C TYR A 48 -2.616 10.264 2.621 1.00 0.46 C ATOM 758 O TYR A 48 -2.781 9.231 1.971 1.00 0.54 O ATOM 759 CB TYR A 48 -3.679 9.976 4.867 1.00 0.48 C ATOM 760 CG TYR A 48 -4.572 10.572 5.929 1.00 0.53 C ATOM 761 CD1 TYR A 48 -5.921 10.249 5.993 1.00 0.63 C ATOM 762 CD2 TYR A 48 -4.067 11.471 6.857 1.00 0.64 C ATOM 763 CE1 TYR A 48 -6.740 10.805 6.953 1.00 0.76 C ATOM 764 CE2 TYR A 48 -4.882 12.032 7.820 1.00 0.78 C ATOM 765 CZ TYR A 48 -6.216 11.696 7.863 1.00 0.82 C ATOM 766 OH TYR A 48 -7.028 12.258 8.818 1.00 0.99 O ATOM 0 H TYR A 48 -5.293 9.773 2.637 1.00 0.48 H new ATOM 0 HA TYR A 48 -3.468 11.812 3.779 1.00 0.45 H new ATOM 0 HB2 TYR A 48 -3.996 8.952 4.667 1.00 0.48 H new ATOM 0 HB3 TYR A 48 -2.658 9.925 5.246 1.00 0.48 H new ATOM 0 HD1 TYR A 48 -6.335 9.552 5.280 1.00 0.63 H new ATOM 0 HD2 TYR A 48 -3.021 11.736 6.826 1.00 0.64 H new ATOM 0 HE1 TYR A 48 -7.787 10.543 6.991 1.00 0.76 H new ATOM 0 HE2 TYR A 48 -4.475 12.731 8.536 1.00 0.78 H new ATOM 0 HH TYR A 48 -6.501 12.863 9.381 1.00 0.99 H new ATOM 776 N ARG A 49 -1.526 11.013 2.536 1.00 0.45 N ATOM 777 CA ARG A 49 -0.424 10.655 1.656 1.00 0.48 C ATOM 778 C ARG A 49 0.918 10.707 2.403 1.00 0.40 C ATOM 779 O ARG A 49 1.322 11.759 2.882 1.00 0.48 O ATOM 780 CB ARG A 49 -0.437 11.596 0.439 1.00 0.59 C ATOM 781 CG ARG A 49 0.728 11.436 -0.531 1.00 0.71 C ATOM 782 CD ARG A 49 1.850 12.413 -0.221 1.00 1.32 C ATOM 783 NE ARG A 49 2.809 12.531 -1.317 1.00 1.69 N ATOM 784 CZ ARG A 49 3.961 13.191 -1.219 1.00 2.18 C ATOM 785 NH1 ARG A 49 4.278 13.812 -0.091 1.00 2.54 N ATOM 786 NH2 ARG A 49 4.790 13.260 -2.251 1.00 2.92 N ATOM 0 H ARG A 49 -1.381 11.872 3.066 1.00 0.45 H new ATOM 0 HA ARG A 49 -0.548 9.629 1.311 1.00 0.48 H new ATOM 0 HB2 ARG A 49 -1.366 11.439 -0.109 1.00 0.59 H new ATOM 0 HB3 ARG A 49 -0.448 12.625 0.798 1.00 0.59 H new ATOM 0 HG2 ARG A 49 1.108 10.416 -0.479 1.00 0.71 H new ATOM 0 HG3 ARG A 49 0.378 11.594 -1.551 1.00 0.71 H new ATOM 0 HD2 ARG A 49 1.425 13.394 -0.008 1.00 1.32 H new ATOM 0 HD3 ARG A 49 2.371 12.089 0.680 1.00 1.32 H new ATOM 0 HE ARG A 49 2.584 12.083 -2.205 1.00 1.69 H new ATOM 0 HH11 ARG A 49 3.639 13.784 0.703 1.00 2.54 H new ATOM 0 HH12 ARG A 49 5.161 14.317 -0.018 1.00 2.54 H new ATOM 0 HH21 ARG A 49 4.548 12.805 -3.131 1.00 2.92 H new ATOM 0 HH22 ARG A 49 5.670 13.768 -2.165 1.00 2.92 H new ATOM 800 N VAL A 50 1.599 9.568 2.488 1.00 0.37 N ATOM 801 CA VAL A 50 2.888 9.472 3.167 1.00 0.42 C ATOM 802 C VAL A 50 4.024 9.682 2.188 1.00 0.46 C ATOM 803 O VAL A 50 3.887 9.422 0.994 1.00 0.62 O ATOM 804 CB VAL A 50 3.133 8.113 3.867 1.00 0.63 C ATOM 805 CG1 VAL A 50 3.342 8.306 5.355 1.00 1.29 C ATOM 806 CG2 VAL A 50 2.011 7.129 3.612 1.00 1.33 C ATOM 0 H VAL A 50 1.274 8.687 2.089 1.00 0.37 H new ATOM 0 HA VAL A 50 2.858 10.250 3.929 1.00 0.42 H new ATOM 0 HB VAL A 50 4.040 7.690 3.436 1.00 0.63 H new ATOM 0 HG11 VAL A 50 3.512 7.338 5.827 1.00 1.29 H new ATOM 0 HG12 VAL A 50 4.207 8.948 5.521 1.00 1.29 H new ATOM 0 HG13 VAL A 50 2.457 8.771 5.789 1.00 1.29 H new ATOM 0 HG21 VAL A 50 2.227 6.191 4.123 1.00 1.33 H new ATOM 0 HG22 VAL A 50 1.074 7.540 3.988 1.00 1.33 H new ATOM 0 HG23 VAL A 50 1.923 6.947 2.541 1.00 1.33 H new ATOM 816 N GLU A 51 5.136 10.154 2.709 1.00 0.37 N ATOM 817 CA GLU A 51 6.329 10.378 1.921 1.00 0.37 C ATOM 818 C GLU A 51 7.539 10.270 2.834 1.00 0.38 C ATOM 819 O GLU A 51 7.797 11.163 3.631 1.00 0.56 O ATOM 820 CB GLU A 51 6.292 11.770 1.288 1.00 0.40 C ATOM 821 CG GLU A 51 7.387 12.002 0.264 1.00 0.47 C ATOM 822 CD GLU A 51 7.650 13.469 0.003 1.00 0.52 C ATOM 823 OE1 GLU A 51 6.985 14.051 -0.879 1.00 1.07 O ATOM 824 OE2 GLU A 51 8.541 14.039 0.664 1.00 1.02 O ATOM 0 H GLU A 51 5.239 10.394 3.695 1.00 0.37 H new ATOM 0 HA GLU A 51 6.386 9.634 1.126 1.00 0.37 H new ATOM 0 HB2 GLU A 51 5.323 11.917 0.811 1.00 0.40 H new ATOM 0 HB3 GLU A 51 6.377 12.520 2.075 1.00 0.40 H new ATOM 0 HG2 GLU A 51 8.306 11.529 0.610 1.00 0.47 H new ATOM 0 HG3 GLU A 51 7.111 11.516 -0.672 1.00 0.47 H new ATOM 831 N GLY A 52 8.280 9.191 2.719 1.00 0.27 N ATOM 832 CA GLY A 52 9.422 9.000 3.577 1.00 0.29 C ATOM 833 C GLY A 52 10.573 8.394 2.834 1.00 0.25 C ATOM 834 O GLY A 52 10.378 7.542 1.976 1.00 0.29 O ATOM 0 H GLY A 52 8.114 8.442 2.047 1.00 0.27 H new ATOM 0 HA2 GLY A 52 9.725 9.958 4.000 1.00 0.29 H new ATOM 0 HA3 GLY A 52 9.147 8.356 4.412 1.00 0.29 H new ATOM 838 N ILE A 53 11.770 8.840 3.130 1.00 0.24 N ATOM 839 CA ILE A 53 12.930 8.305 2.460 1.00 0.23 C ATOM 840 C ILE A 53 13.465 7.086 3.193 1.00 0.23 C ATOM 841 O ILE A 53 13.804 7.152 4.374 1.00 0.30 O ATOM 842 CB ILE A 53 14.040 9.356 2.317 1.00 0.29 C ATOM 843 CG1 ILE A 53 13.494 10.590 1.593 1.00 0.37 C ATOM 844 CG2 ILE A 53 15.219 8.764 1.559 1.00 0.27 C ATOM 845 CD1 ILE A 53 14.497 11.711 1.462 1.00 0.58 C ATOM 0 H ILE A 53 11.965 9.563 3.822 1.00 0.24 H new ATOM 0 HA ILE A 53 12.613 8.008 1.460 1.00 0.23 H new ATOM 0 HB ILE A 53 14.383 9.658 3.306 1.00 0.29 H new ATOM 0 HG12 ILE A 53 13.158 10.297 0.598 1.00 0.37 H new ATOM 0 HG13 ILE A 53 12.620 10.958 2.130 1.00 0.37 H new ATOM 0 HG21 ILE A 53 16.003 9.515 1.461 1.00 0.27 H new ATOM 0 HG22 ILE A 53 15.607 7.904 2.104 1.00 0.27 H new ATOM 0 HG23 ILE A 53 14.893 8.449 0.568 1.00 0.27 H new ATOM 0 HD11 ILE A 53 14.038 12.550 0.939 1.00 0.58 H new ATOM 0 HD12 ILE A 53 14.816 12.032 2.454 1.00 0.58 H new ATOM 0 HD13 ILE A 53 15.362 11.361 0.899 1.00 0.58 H new ATOM 857 N ILE A 54 13.498 5.965 2.496 1.00 0.24 N ATOM 858 CA ILE A 54 14.109 4.767 3.020 1.00 0.26 C ATOM 859 C ILE A 54 15.545 4.674 2.509 1.00 0.29 C ATOM 860 O ILE A 54 15.786 4.695 1.307 1.00 0.31 O ATOM 861 CB ILE A 54 13.288 3.505 2.648 1.00 0.26 C ATOM 862 CG1 ILE A 54 11.962 3.527 3.412 1.00 0.32 C ATOM 863 CG2 ILE A 54 14.065 2.234 2.970 1.00 0.32 C ATOM 864 CD1 ILE A 54 10.894 2.637 2.830 1.00 0.35 C ATOM 0 H ILE A 54 13.105 5.864 1.560 1.00 0.24 H new ATOM 0 HA ILE A 54 14.123 4.819 4.109 1.00 0.26 H new ATOM 0 HB ILE A 54 13.093 3.512 1.576 1.00 0.26 H new ATOM 0 HG12 ILE A 54 12.146 3.227 4.444 1.00 0.32 H new ATOM 0 HG13 ILE A 54 11.589 4.551 3.440 1.00 0.32 H new ATOM 0 HG21 ILE A 54 13.467 1.364 2.700 1.00 0.32 H new ATOM 0 HG22 ILE A 54 14.997 2.224 2.404 1.00 0.32 H new ATOM 0 HG23 ILE A 54 14.288 2.204 4.037 1.00 0.32 H new ATOM 0 HD11 ILE A 54 9.989 2.713 3.432 1.00 0.35 H new ATOM 0 HD12 ILE A 54 10.677 2.949 1.808 1.00 0.35 H new ATOM 0 HD13 ILE A 54 11.242 1.604 2.828 1.00 0.35 H new ATOM 876 N PRO A 55 16.512 4.671 3.437 1.00 0.36 N ATOM 877 CA PRO A 55 17.949 4.572 3.131 1.00 0.44 C ATOM 878 C PRO A 55 18.332 3.237 2.491 1.00 0.47 C ATOM 879 O PRO A 55 19.156 2.487 3.018 1.00 0.62 O ATOM 880 CB PRO A 55 18.622 4.729 4.502 1.00 0.54 C ATOM 881 CG PRO A 55 17.584 5.348 5.371 1.00 0.53 C ATOM 882 CD PRO A 55 16.272 4.827 4.867 1.00 0.42 C ATOM 0 HA PRO A 55 18.255 5.323 2.403 1.00 0.44 H new ATOM 0 HB2 PRO A 55 18.944 3.765 4.897 1.00 0.54 H new ATOM 0 HB3 PRO A 55 19.509 5.359 4.437 1.00 0.54 H new ATOM 0 HG2 PRO A 55 17.737 5.079 6.416 1.00 0.53 H new ATOM 0 HG3 PRO A 55 17.622 6.436 5.313 1.00 0.53 H new ATOM 0 HD2 PRO A 55 16.005 3.881 5.338 1.00 0.42 H new ATOM 0 HD3 PRO A 55 15.457 5.523 5.066 1.00 0.42 H new ATOM 890 N GLU A 56 17.721 2.963 1.353 1.00 0.43 N ATOM 891 CA GLU A 56 17.983 1.776 0.574 1.00 0.49 C ATOM 892 C GLU A 56 17.587 2.082 -0.864 1.00 0.46 C ATOM 893 O GLU A 56 17.078 3.167 -1.141 1.00 0.60 O ATOM 894 CB GLU A 56 17.185 0.597 1.150 1.00 0.66 C ATOM 895 CG GLU A 56 17.300 -0.696 0.356 1.00 0.77 C ATOM 896 CD GLU A 56 18.736 -1.137 0.128 1.00 1.18 C ATOM 897 OE1 GLU A 56 19.440 -1.460 1.104 1.00 1.38 O ATOM 898 OE2 GLU A 56 19.169 -1.154 -1.048 1.00 1.68 O ATOM 0 H GLU A 56 17.016 3.574 0.940 1.00 0.43 H new ATOM 0 HA GLU A 56 19.036 1.496 0.607 1.00 0.49 H new ATOM 0 HB2 GLU A 56 17.521 0.412 2.170 1.00 0.66 H new ATOM 0 HB3 GLU A 56 16.134 0.880 1.207 1.00 0.66 H new ATOM 0 HG2 GLU A 56 16.764 -1.486 0.882 1.00 0.77 H new ATOM 0 HG3 GLU A 56 16.810 -0.566 -0.609 1.00 0.77 H new ATOM 905 N SER A 57 17.822 1.158 -1.770 1.00 0.45 N ATOM 906 CA SER A 57 17.501 1.362 -3.147 1.00 0.45 C ATOM 907 C SER A 57 16.076 0.917 -3.425 1.00 0.43 C ATOM 908 O SER A 57 15.589 -0.073 -2.870 1.00 0.43 O ATOM 909 CB SER A 57 18.493 0.592 -4.024 1.00 0.53 C ATOM 910 OG SER A 57 18.544 -0.777 -3.653 1.00 1.18 O ATOM 0 H SER A 57 18.240 0.251 -1.564 1.00 0.45 H new ATOM 0 HA SER A 57 17.576 2.424 -3.383 1.00 0.45 H new ATOM 0 HB2 SER A 57 18.201 0.678 -5.071 1.00 0.53 H new ATOM 0 HB3 SER A 57 19.485 1.035 -3.932 1.00 0.53 H new ATOM 0 HG SER A 57 18.913 -0.857 -2.749 1.00 1.18 H new ATOM 916 N PRO A 58 15.397 1.688 -4.280 1.00 0.44 N ATOM 917 CA PRO A 58 14.061 1.387 -4.804 1.00 0.43 C ATOM 918 C PRO A 58 13.951 -0.038 -5.349 1.00 0.46 C ATOM 919 O PRO A 58 12.852 -0.543 -5.577 1.00 0.46 O ATOM 920 CB PRO A 58 13.879 2.414 -5.940 1.00 0.44 C ATOM 921 CG PRO A 58 15.212 3.071 -6.112 1.00 0.49 C ATOM 922 CD PRO A 58 15.889 2.962 -4.783 1.00 0.52 C ATOM 0 HA PRO A 58 13.299 1.451 -4.027 1.00 0.43 H new ATOM 0 HB2 PRO A 58 13.562 1.926 -6.861 1.00 0.44 H new ATOM 0 HB3 PRO A 58 13.112 3.146 -5.687 1.00 0.44 H new ATOM 0 HG2 PRO A 58 15.795 2.578 -6.890 1.00 0.49 H new ATOM 0 HG3 PRO A 58 15.100 4.113 -6.410 1.00 0.49 H new ATOM 0 HD2 PRO A 58 16.975 2.968 -4.879 1.00 0.52 H new ATOM 0 HD3 PRO A 58 15.623 3.788 -4.124 1.00 0.52 H new ATOM 930 N ALA A 59 15.098 -0.674 -5.558 1.00 0.50 N ATOM 931 CA ALA A 59 15.149 -2.057 -5.995 1.00 0.54 C ATOM 932 C ALA A 59 14.807 -3.001 -4.864 1.00 0.50 C ATOM 933 O ALA A 59 13.993 -3.904 -5.027 1.00 0.51 O ATOM 934 CB ALA A 59 16.525 -2.387 -6.527 1.00 0.64 C ATOM 0 H ALA A 59 16.014 -0.244 -5.429 1.00 0.50 H new ATOM 0 HA ALA A 59 14.411 -2.183 -6.787 1.00 0.54 H new ATOM 0 HB1 ALA A 59 16.550 -3.427 -6.851 1.00 0.64 H new ATOM 0 HB2 ALA A 59 16.754 -1.738 -7.372 1.00 0.64 H new ATOM 0 HB3 ALA A 59 17.265 -2.234 -5.741 1.00 0.64 H new ATOM 940 N LYS A 60 15.424 -2.782 -3.713 1.00 0.49 N ATOM 941 CA LYS A 60 15.169 -3.607 -2.552 1.00 0.49 C ATOM 942 C LYS A 60 13.750 -3.346 -2.101 1.00 0.42 C ATOM 943 O LYS A 60 13.065 -4.220 -1.573 1.00 0.43 O ATOM 944 CB LYS A 60 16.161 -3.266 -1.438 1.00 0.58 C ATOM 945 CG LYS A 60 16.038 -4.128 -0.188 1.00 0.65 C ATOM 946 CD LYS A 60 16.805 -5.427 -0.310 1.00 1.35 C ATOM 947 CE LYS A 60 16.162 -6.384 -1.296 1.00 2.45 C ATOM 948 NZ LYS A 60 16.841 -7.706 -1.306 1.00 3.30 N ATOM 0 H LYS A 60 16.105 -2.038 -3.562 1.00 0.49 H new ATOM 0 HA LYS A 60 15.294 -4.662 -2.797 1.00 0.49 H new ATOM 0 HB2 LYS A 60 17.173 -3.362 -1.830 1.00 0.58 H new ATOM 0 HB3 LYS A 60 16.025 -2.222 -1.157 1.00 0.58 H new ATOM 0 HG2 LYS A 60 16.406 -3.570 0.673 1.00 0.65 H new ATOM 0 HG3 LYS A 60 14.986 -4.345 -0.001 1.00 0.65 H new ATOM 0 HD2 LYS A 60 17.826 -5.215 -0.626 1.00 1.35 H new ATOM 0 HD3 LYS A 60 16.866 -5.904 0.668 1.00 1.35 H new ATOM 0 HE2 LYS A 60 15.111 -6.517 -1.040 1.00 2.45 H new ATOM 0 HE3 LYS A 60 16.194 -5.951 -2.296 1.00 2.45 H new ATOM 0 HZ1 LYS A 60 16.157 -8.445 -1.566 1.00 3.30 H new ATOM 0 HZ2 LYS A 60 17.617 -7.693 -1.999 1.00 3.30 H new ATOM 0 HZ3 LYS A 60 17.225 -7.906 -0.360 1.00 3.30 H new ATOM 962 N LEU A 61 13.328 -2.115 -2.336 1.00 0.37 N ATOM 963 CA LEU A 61 11.974 -1.695 -2.062 1.00 0.35 C ATOM 964 C LEU A 61 10.985 -2.468 -2.921 1.00 0.38 C ATOM 965 O LEU A 61 10.091 -3.131 -2.403 1.00 0.41 O ATOM 966 CB LEU A 61 11.843 -0.199 -2.302 1.00 0.34 C ATOM 967 CG LEU A 61 12.585 0.679 -1.289 1.00 0.31 C ATOM 968 CD1 LEU A 61 12.455 2.137 -1.663 1.00 0.34 C ATOM 969 CD2 LEU A 61 12.035 0.446 0.102 1.00 0.30 C ATOM 0 H LEU A 61 13.920 -1.381 -2.723 1.00 0.37 H new ATOM 0 HA LEU A 61 11.743 -1.906 -1.018 1.00 0.35 H new ATOM 0 HB2 LEU A 61 12.215 0.029 -3.301 1.00 0.34 H new ATOM 0 HB3 LEU A 61 10.786 0.066 -2.287 1.00 0.34 H new ATOM 0 HG LEU A 61 13.641 0.410 -1.301 1.00 0.31 H new ATOM 0 HD11 LEU A 61 12.987 2.748 -0.934 1.00 0.34 H new ATOM 0 HD12 LEU A 61 12.882 2.298 -2.653 1.00 0.34 H new ATOM 0 HD13 LEU A 61 11.402 2.418 -1.672 1.00 0.34 H new ATOM 0 HD21 LEU A 61 12.569 1.075 0.814 1.00 0.30 H new ATOM 0 HD22 LEU A 61 10.974 0.697 0.121 1.00 0.30 H new ATOM 0 HD23 LEU A 61 12.165 -0.602 0.374 1.00 0.30 H new ATOM 981 N SER A 62 11.166 -2.414 -4.230 1.00 0.41 N ATOM 982 CA SER A 62 10.316 -3.167 -5.142 1.00 0.46 C ATOM 983 C SER A 62 10.469 -4.669 -4.902 1.00 0.46 C ATOM 984 O SER A 62 9.678 -5.469 -5.403 1.00 0.50 O ATOM 985 CB SER A 62 10.657 -2.826 -6.597 1.00 0.53 C ATOM 986 OG SER A 62 9.798 -3.500 -7.499 1.00 1.29 O ATOM 0 H SER A 62 11.891 -1.859 -4.685 1.00 0.41 H new ATOM 0 HA SER A 62 9.279 -2.889 -4.952 1.00 0.46 H new ATOM 0 HB2 SER A 62 10.575 -1.750 -6.749 1.00 0.53 H new ATOM 0 HB3 SER A 62 11.692 -3.099 -6.804 1.00 0.53 H new ATOM 0 HG SER A 62 9.498 -4.342 -7.098 1.00 1.29 H new ATOM 992 N ASP A 63 11.484 -5.043 -4.130 1.00 0.44 N ATOM 993 CA ASP A 63 11.734 -6.452 -3.829 1.00 0.48 C ATOM 994 C ASP A 63 10.887 -6.946 -2.657 1.00 0.49 C ATOM 995 O ASP A 63 10.337 -8.046 -2.700 1.00 0.60 O ATOM 996 CB ASP A 63 13.218 -6.677 -3.524 1.00 0.53 C ATOM 997 CG ASP A 63 13.515 -8.074 -3.006 1.00 0.87 C ATOM 998 OD1 ASP A 63 13.526 -9.023 -3.813 1.00 1.10 O ATOM 999 OD2 ASP A 63 13.742 -8.226 -1.785 1.00 1.32 O ATOM 0 H ASP A 63 12.145 -4.395 -3.702 1.00 0.44 H new ATOM 0 HA ASP A 63 11.451 -7.025 -4.712 1.00 0.48 H new ATOM 0 HB2 ASP A 63 13.800 -6.500 -4.429 1.00 0.53 H new ATOM 0 HB3 ASP A 63 13.546 -5.945 -2.786 1.00 0.53 H new ATOM 1004 N PHE A 64 10.766 -6.134 -1.616 1.00 0.44 N ATOM 1005 CA PHE A 64 10.155 -6.600 -0.377 1.00 0.48 C ATOM 1006 C PHE A 64 8.625 -6.465 -0.392 1.00 0.51 C ATOM 1007 O PHE A 64 7.925 -7.380 0.043 1.00 0.61 O ATOM 1008 CB PHE A 64 10.753 -5.869 0.843 1.00 0.51 C ATOM 1009 CG PHE A 64 10.198 -4.493 1.053 1.00 0.46 C ATOM 1010 CD1 PHE A 64 10.646 -3.436 0.305 1.00 0.50 C ATOM 1011 CD2 PHE A 64 9.197 -4.271 1.974 1.00 0.59 C ATOM 1012 CE1 PHE A 64 10.104 -2.181 0.463 1.00 0.50 C ATOM 1013 CE2 PHE A 64 8.655 -3.020 2.145 1.00 0.59 C ATOM 1014 CZ PHE A 64 9.109 -1.974 1.381 1.00 0.47 C ATOM 0 H PHE A 64 11.077 -5.163 -1.602 1.00 0.44 H new ATOM 0 HA PHE A 64 10.383 -7.663 -0.294 1.00 0.48 H new ATOM 0 HB2 PHE A 64 10.571 -6.465 1.737 1.00 0.51 H new ATOM 0 HB3 PHE A 64 11.834 -5.800 0.720 1.00 0.51 H new ATOM 0 HD1 PHE A 64 11.434 -3.590 -0.417 1.00 0.50 H new ATOM 0 HD2 PHE A 64 8.833 -5.094 2.571 1.00 0.59 H new ATOM 0 HE1 PHE A 64 10.464 -1.359 -0.138 1.00 0.50 H new ATOM 0 HE2 PHE A 64 7.876 -2.861 2.876 1.00 0.59 H new ATOM 0 HZ PHE A 64 8.682 -0.989 1.504 1.00 0.47 H new ATOM 1024 N LEU A 65 8.097 -5.348 -0.904 1.00 0.49 N ATOM 1025 CA LEU A 65 6.668 -5.057 -0.756 1.00 0.58 C ATOM 1026 C LEU A 65 5.849 -5.625 -1.909 1.00 0.64 C ATOM 1027 O LEU A 65 4.631 -5.463 -1.924 1.00 0.81 O ATOM 1028 CB LEU A 65 6.447 -3.525 -0.613 1.00 0.66 C ATOM 1029 CG LEU A 65 6.326 -2.652 -1.896 1.00 0.78 C ATOM 1030 CD1 LEU A 65 7.272 -3.083 -3.003 1.00 1.25 C ATOM 1031 CD2 LEU A 65 4.892 -2.605 -2.408 1.00 1.50 C ATOM 0 H LEU A 65 8.627 -4.642 -1.416 1.00 0.49 H new ATOM 0 HA LEU A 65 6.318 -5.548 0.152 1.00 0.58 H new ATOM 0 HB2 LEU A 65 5.538 -3.378 -0.029 1.00 0.66 H new ATOM 0 HB3 LEU A 65 7.273 -3.128 -0.023 1.00 0.66 H new ATOM 0 HG LEU A 65 6.623 -1.646 -1.598 1.00 0.78 H new ATOM 0 HD11 LEU A 65 7.138 -2.435 -3.869 1.00 1.25 H new ATOM 0 HD12 LEU A 65 8.301 -3.010 -2.651 1.00 1.25 H new ATOM 0 HD13 LEU A 65 7.057 -4.114 -3.285 1.00 1.25 H new ATOM 0 HD21 LEU A 65 4.846 -1.987 -3.304 1.00 1.50 H new ATOM 0 HD22 LEU A 65 4.557 -3.615 -2.646 1.00 1.50 H new ATOM 0 HD23 LEU A 65 4.245 -2.180 -1.640 1.00 1.50 H new ATOM 1043 N TYR A 66 6.510 -6.359 -2.803 1.00 0.58 N ATOM 1044 CA TYR A 66 5.938 -6.729 -4.100 1.00 0.64 C ATOM 1045 C TYR A 66 4.461 -7.149 -4.007 1.00 0.72 C ATOM 1046 O TYR A 66 3.582 -6.383 -4.378 1.00 0.89 O ATOM 1047 CB TYR A 66 6.768 -7.853 -4.732 1.00 0.73 C ATOM 1048 CG TYR A 66 6.338 -8.230 -6.137 1.00 0.88 C ATOM 1049 CD1 TYR A 66 6.626 -7.405 -7.215 1.00 0.82 C ATOM 1050 CD2 TYR A 66 5.655 -9.416 -6.381 1.00 1.27 C ATOM 1051 CE1 TYR A 66 6.244 -7.748 -8.499 1.00 1.01 C ATOM 1052 CE2 TYR A 66 5.269 -9.765 -7.662 1.00 1.47 C ATOM 1053 CZ TYR A 66 5.566 -8.929 -8.718 1.00 1.29 C ATOM 1054 OH TYR A 66 5.185 -9.275 -9.994 1.00 1.52 O ATOM 0 H TYR A 66 7.454 -6.714 -2.651 1.00 0.58 H new ATOM 0 HA TYR A 66 5.972 -5.840 -4.730 1.00 0.64 H new ATOM 0 HB2 TYR A 66 7.814 -7.548 -4.754 1.00 0.73 H new ATOM 0 HB3 TYR A 66 6.707 -8.736 -4.096 1.00 0.73 H new ATOM 0 HD1 TYR A 66 7.157 -6.480 -7.048 1.00 0.82 H new ATOM 0 HD2 TYR A 66 5.422 -10.075 -5.557 1.00 1.27 H new ATOM 0 HE1 TYR A 66 6.476 -7.094 -9.327 1.00 1.01 H new ATOM 0 HE2 TYR A 66 4.737 -10.689 -7.835 1.00 1.47 H new ATOM 0 HH TYR A 66 4.262 -8.984 -10.150 1.00 1.52 H new ATOM 1064 N GLN A 67 4.192 -8.337 -3.463 1.00 0.89 N ATOM 1065 CA GLN A 67 2.819 -8.858 -3.357 1.00 1.13 C ATOM 1066 C GLN A 67 2.781 -10.078 -2.444 1.00 1.10 C ATOM 1067 O GLN A 67 2.135 -10.083 -1.402 1.00 1.76 O ATOM 1068 CB GLN A 67 2.266 -9.256 -4.735 1.00 1.54 C ATOM 1069 CG GLN A 67 1.675 -8.107 -5.536 1.00 2.13 C ATOM 1070 CD GLN A 67 1.234 -8.523 -6.922 1.00 2.94 C ATOM 1071 OE1 GLN A 67 0.212 -7.864 -7.434 1.00 3.50 O flip ATOM 1072 NE2 GLN A 67 1.800 -9.432 -7.524 1.00 3.60 N flip ATOM 0 H GLN A 67 4.906 -8.961 -3.087 1.00 0.89 H new ATOM 0 HA GLN A 67 2.201 -8.062 -2.940 1.00 1.13 H new ATOM 0 HB2 GLN A 67 3.068 -9.712 -5.316 1.00 1.54 H new ATOM 0 HB3 GLN A 67 1.499 -10.018 -4.598 1.00 1.54 H new ATOM 0 HG2 GLN A 67 0.822 -7.695 -4.997 1.00 2.13 H new ATOM 0 HG3 GLN A 67 2.414 -7.310 -5.619 1.00 2.13 H new ATOM 0 HE21 GLN A 67 2.587 -9.917 -7.093 1.00 3.60 H new ATOM 0 HE22 GLN A 67 1.483 -9.702 -8.455 1.00 3.60 H new ATOM 1081 N THR A 68 3.501 -11.099 -2.857 1.00 0.83 N ATOM 1082 CA THR A 68 3.616 -12.346 -2.118 1.00 0.93 C ATOM 1083 C THR A 68 5.099 -12.618 -1.928 1.00 1.09 C ATOM 1084 O THR A 68 5.548 -13.745 -1.737 1.00 1.39 O ATOM 1085 CB THR A 68 2.934 -13.513 -2.877 1.00 1.18 C ATOM 1086 OG1 THR A 68 3.020 -14.731 -2.125 1.00 1.48 O ATOM 1087 CG2 THR A 68 3.544 -13.709 -4.259 1.00 1.29 C ATOM 0 H THR A 68 4.032 -11.090 -3.728 1.00 0.83 H new ATOM 0 HA THR A 68 3.112 -12.264 -1.155 1.00 0.93 H new ATOM 0 HB THR A 68 1.884 -13.250 -3.002 1.00 1.18 H new ATOM 0 HG1 THR A 68 3.910 -14.805 -1.722 1.00 1.48 H new ATOM 0 HG21 THR A 68 3.043 -14.535 -4.764 1.00 1.29 H new ATOM 0 HG22 THR A 68 3.421 -12.797 -4.844 1.00 1.29 H new ATOM 0 HG23 THR A 68 4.606 -13.935 -4.159 1.00 1.29 H new ATOM 1095 N GLY A 69 5.844 -11.521 -1.938 1.00 1.06 N ATOM 1096 CA GLY A 69 7.284 -11.573 -2.006 1.00 1.39 C ATOM 1097 C GLY A 69 7.908 -12.047 -0.727 1.00 1.17 C ATOM 1098 O GLY A 69 9.082 -12.413 -0.719 1.00 1.46 O ATOM 0 H GLY A 69 5.461 -10.576 -1.899 1.00 1.06 H new ATOM 0 HA2 GLY A 69 7.581 -12.236 -2.818 1.00 1.39 H new ATOM 0 HA3 GLY A 69 7.668 -10.582 -2.247 1.00 1.39 H new ATOM 1102 N ASP A 70 7.079 -12.051 0.323 1.00 0.84 N ATOM 1103 CA ASP A 70 7.476 -12.290 1.717 1.00 0.83 C ATOM 1104 C ASP A 70 6.819 -11.209 2.559 1.00 0.65 C ATOM 1105 O ASP A 70 6.788 -11.271 3.778 1.00 0.61 O ATOM 1106 CB ASP A 70 8.997 -12.227 1.916 1.00 1.12 C ATOM 1107 CG ASP A 70 9.481 -12.909 3.176 1.00 1.45 C ATOM 1108 OD1 ASP A 70 9.311 -14.144 3.295 1.00 2.19 O ATOM 1109 OD2 ASP A 70 10.075 -12.220 4.029 1.00 1.68 O ATOM 0 H ASP A 70 6.078 -11.882 0.223 1.00 0.84 H new ATOM 0 HA ASP A 70 7.160 -13.292 2.007 1.00 0.83 H new ATOM 0 HB2 ASP A 70 9.485 -12.686 1.056 1.00 1.12 H new ATOM 0 HB3 ASP A 70 9.307 -11.182 1.938 1.00 1.12 H new ATOM 1114 N ARG A 71 6.234 -10.241 1.857 1.00 0.60 N ATOM 1115 CA ARG A 71 5.733 -9.018 2.438 1.00 0.51 C ATOM 1116 C ARG A 71 4.677 -9.300 3.481 1.00 0.43 C ATOM 1117 O ARG A 71 4.613 -8.628 4.493 1.00 0.49 O ATOM 1118 CB ARG A 71 5.160 -8.116 1.338 1.00 0.59 C ATOM 1119 CG ARG A 71 3.985 -8.710 0.611 1.00 0.83 C ATOM 1120 CD ARG A 71 2.800 -7.772 0.620 1.00 0.87 C ATOM 1121 NE ARG A 71 3.159 -6.391 0.265 1.00 1.77 N ATOM 1122 CZ ARG A 71 3.239 -5.376 1.139 1.00 2.46 C ATOM 1123 NH1 ARG A 71 3.099 -5.595 2.442 1.00 2.69 N ATOM 1124 NH2 ARG A 71 3.492 -4.149 0.703 1.00 3.38 N ATOM 0 H ARG A 71 6.097 -10.295 0.848 1.00 0.60 H new ATOM 0 HA ARG A 71 6.562 -8.509 2.929 1.00 0.51 H new ATOM 0 HB2 ARG A 71 4.858 -7.167 1.781 1.00 0.59 H new ATOM 0 HB3 ARG A 71 5.947 -7.895 0.617 1.00 0.59 H new ATOM 0 HG2 ARG A 71 4.267 -8.933 -0.418 1.00 0.83 H new ATOM 0 HG3 ARG A 71 3.707 -9.655 1.077 1.00 0.83 H new ATOM 0 HD2 ARG A 71 2.049 -8.138 -0.080 1.00 0.87 H new ATOM 0 HD3 ARG A 71 2.344 -7.780 1.610 1.00 0.87 H new ATOM 0 HE ARG A 71 3.361 -6.190 -0.714 1.00 1.77 H new ATOM 0 HH11 ARG A 71 2.929 -6.541 2.785 1.00 2.69 H new ATOM 0 HH12 ARG A 71 3.161 -4.818 3.099 1.00 2.69 H new ATOM 0 HH21 ARG A 71 3.625 -3.979 -0.294 1.00 3.38 H new ATOM 0 HH22 ARG A 71 3.553 -3.375 1.365 1.00 3.38 H new ATOM 1138 N ILE A 72 3.868 -10.313 3.239 1.00 0.44 N ATOM 1139 CA ILE A 72 2.761 -10.609 4.139 1.00 0.44 C ATOM 1140 C ILE A 72 3.240 -11.379 5.353 1.00 0.54 C ATOM 1141 O ILE A 72 2.528 -11.484 6.350 1.00 0.64 O ATOM 1142 CB ILE A 72 1.620 -11.407 3.458 1.00 0.45 C ATOM 1143 CG1 ILE A 72 2.040 -12.841 3.129 1.00 0.62 C ATOM 1144 CG2 ILE A 72 1.167 -10.709 2.201 1.00 0.47 C ATOM 1145 CD1 ILE A 72 2.900 -12.989 1.884 1.00 0.71 C ATOM 0 H ILE A 72 3.951 -10.940 2.439 1.00 0.44 H new ATOM 0 HA ILE A 72 2.360 -9.641 4.441 1.00 0.44 H new ATOM 0 HB ILE A 72 0.794 -11.454 4.167 1.00 0.45 H new ATOM 0 HG12 ILE A 72 2.586 -13.248 3.980 1.00 0.62 H new ATOM 0 HG13 ILE A 72 1.143 -13.447 3.007 1.00 0.62 H new ATOM 0 HG21 ILE A 72 0.366 -11.282 1.735 1.00 0.47 H new ATOM 0 HG22 ILE A 72 0.803 -9.712 2.449 1.00 0.47 H new ATOM 0 HG23 ILE A 72 2.005 -10.627 1.508 1.00 0.47 H new ATOM 0 HD11 ILE A 72 3.146 -14.040 1.735 1.00 0.71 H new ATOM 0 HD12 ILE A 72 2.353 -12.618 1.018 1.00 0.71 H new ATOM 0 HD13 ILE A 72 3.819 -12.415 2.006 1.00 0.71 H new ATOM 1157 N THR A 73 4.452 -11.903 5.283 1.00 0.59 N ATOM 1158 CA THR A 73 4.951 -12.709 6.367 1.00 0.72 C ATOM 1159 C THR A 73 5.634 -11.827 7.406 1.00 0.74 C ATOM 1160 O THR A 73 5.617 -12.134 8.598 1.00 0.88 O ATOM 1161 CB THR A 73 5.927 -13.816 5.891 1.00 0.81 C ATOM 1162 OG1 THR A 73 5.877 -14.926 6.798 1.00 0.97 O ATOM 1163 CG2 THR A 73 7.364 -13.306 5.817 1.00 0.80 C ATOM 0 H THR A 73 5.093 -11.784 4.499 1.00 0.59 H new ATOM 0 HA THR A 73 4.091 -13.209 6.812 1.00 0.72 H new ATOM 0 HB THR A 73 5.616 -14.123 4.892 1.00 0.81 H new ATOM 0 HG1 THR A 73 6.493 -15.625 6.494 1.00 0.97 H new ATOM 0 HG21 THR A 73 8.018 -14.110 5.480 1.00 0.80 H new ATOM 0 HG22 THR A 73 7.419 -12.474 5.115 1.00 0.80 H new ATOM 0 HG23 THR A 73 7.682 -12.969 6.804 1.00 0.80 H new ATOM 1171 N TRP A 74 6.238 -10.730 6.950 1.00 0.64 N ATOM 1172 CA TRP A 74 6.920 -9.827 7.869 1.00 0.66 C ATOM 1173 C TRP A 74 6.058 -8.612 8.181 1.00 0.63 C ATOM 1174 O TRP A 74 6.402 -7.803 9.044 1.00 0.75 O ATOM 1175 CB TRP A 74 8.297 -9.401 7.323 1.00 0.66 C ATOM 1176 CG TRP A 74 8.282 -8.834 5.931 1.00 0.59 C ATOM 1177 CD1 TRP A 74 8.788 -9.418 4.804 1.00 0.66 C ATOM 1178 CD2 TRP A 74 7.753 -7.568 5.515 1.00 0.53 C ATOM 1179 NE1 TRP A 74 8.597 -8.599 3.720 1.00 0.65 N ATOM 1180 CE2 TRP A 74 7.962 -7.461 4.133 1.00 0.58 C ATOM 1181 CE3 TRP A 74 7.118 -6.520 6.177 1.00 0.52 C ATOM 1182 CZ2 TRP A 74 7.557 -6.351 3.404 1.00 0.62 C ATOM 1183 CZ3 TRP A 74 6.720 -5.422 5.452 1.00 0.56 C ATOM 1184 CH2 TRP A 74 6.937 -5.339 4.078 1.00 0.61 C ATOM 0 H TRP A 74 6.268 -10.451 5.969 1.00 0.64 H new ATOM 0 HA TRP A 74 7.088 -10.370 8.799 1.00 0.66 H new ATOM 0 HB2 TRP A 74 8.724 -8.658 7.997 1.00 0.66 H new ATOM 0 HB3 TRP A 74 8.961 -10.265 7.340 1.00 0.66 H new ATOM 0 HD1 TRP A 74 9.269 -10.385 4.771 1.00 0.66 H new ATOM 0 HE1 TRP A 74 8.882 -8.805 2.763 1.00 0.65 H new ATOM 0 HE3 TRP A 74 6.941 -6.569 7.241 1.00 0.52 H new ATOM 0 HZ2 TRP A 74 7.727 -6.290 2.339 1.00 0.62 H new ATOM 0 HZ3 TRP A 74 6.228 -4.605 5.959 1.00 0.56 H new ATOM 0 HH2 TRP A 74 6.610 -4.462 3.539 1.00 0.61 H new ATOM 1195 N ASP A 75 4.937 -8.495 7.479 1.00 0.55 N ATOM 1196 CA ASP A 75 4.053 -7.345 7.635 1.00 0.58 C ATOM 1197 C ASP A 75 3.297 -7.437 8.949 1.00 0.58 C ATOM 1198 O ASP A 75 3.260 -8.487 9.600 1.00 0.73 O ATOM 1199 CB ASP A 75 3.058 -7.260 6.475 1.00 0.83 C ATOM 1200 CG ASP A 75 2.501 -5.859 6.246 1.00 1.44 C ATOM 1201 OD1 ASP A 75 1.705 -5.379 7.088 1.00 1.44 O ATOM 1202 OD2 ASP A 75 2.844 -5.242 5.210 1.00 2.19 O ATOM 0 H ASP A 75 4.618 -9.182 6.796 1.00 0.55 H new ATOM 0 HA ASP A 75 4.668 -6.445 7.635 1.00 0.58 H new ATOM 0 HB2 ASP A 75 3.548 -7.600 5.563 1.00 0.83 H new ATOM 0 HB3 ASP A 75 2.231 -7.943 6.667 1.00 0.83 H new ATOM 1207 N LYS A 76 2.667 -6.344 9.301 1.00 0.58 N ATOM 1208 CA LYS A 76 2.019 -6.196 10.587 1.00 0.65 C ATOM 1209 C LYS A 76 0.508 -6.107 10.443 1.00 0.62 C ATOM 1210 O LYS A 76 -0.232 -6.261 11.415 1.00 0.75 O ATOM 1211 CB LYS A 76 2.555 -4.956 11.287 1.00 0.88 C ATOM 1212 CG LYS A 76 2.638 -3.731 10.385 1.00 0.78 C ATOM 1213 CD LYS A 76 1.380 -2.897 10.474 1.00 1.63 C ATOM 1214 CE LYS A 76 1.411 -1.983 11.676 1.00 1.97 C ATOM 1215 NZ LYS A 76 0.137 -1.231 11.844 1.00 3.19 N ATOM 0 H LYS A 76 2.587 -5.523 8.700 1.00 0.58 H new ATOM 0 HA LYS A 76 2.241 -7.079 11.186 1.00 0.65 H new ATOM 0 HB2 LYS A 76 1.916 -4.726 12.139 1.00 0.88 H new ATOM 0 HB3 LYS A 76 3.547 -5.173 11.682 1.00 0.88 H new ATOM 0 HG2 LYS A 76 3.499 -3.126 10.669 1.00 0.78 H new ATOM 0 HG3 LYS A 76 2.796 -4.046 9.354 1.00 0.78 H new ATOM 0 HD2 LYS A 76 1.270 -2.304 9.566 1.00 1.63 H new ATOM 0 HD3 LYS A 76 0.511 -3.552 10.535 1.00 1.63 H new ATOM 0 HE2 LYS A 76 1.604 -2.572 12.573 1.00 1.97 H new ATOM 0 HE3 LYS A 76 2.236 -1.278 11.573 1.00 1.97 H new ATOM 0 HZ1 LYS A 76 0.319 -0.352 12.370 1.00 3.19 H new ATOM 0 HZ2 LYS A 76 -0.256 -1.000 10.909 1.00 3.19 H new ATOM 0 HZ3 LYS A 76 -0.544 -1.815 12.371 1.00 3.19 H new ATOM 1229 N SER A 77 0.057 -5.844 9.233 1.00 0.61 N ATOM 1230 CA SER A 77 -1.361 -5.747 8.958 1.00 0.72 C ATOM 1231 C SER A 77 -1.749 -6.793 7.932 1.00 0.61 C ATOM 1232 O SER A 77 -2.873 -6.817 7.438 1.00 0.65 O ATOM 1233 CB SER A 77 -1.705 -4.343 8.458 1.00 0.91 C ATOM 1234 OG SER A 77 -3.093 -4.192 8.225 1.00 1.58 O ATOM 0 H SER A 77 0.656 -5.693 8.421 1.00 0.61 H new ATOM 0 HA SER A 77 -1.923 -5.928 9.875 1.00 0.72 H new ATOM 0 HB2 SER A 77 -1.377 -3.606 9.191 1.00 0.91 H new ATOM 0 HB3 SER A 77 -1.158 -4.141 7.537 1.00 0.91 H new ATOM 0 HG SER A 77 -3.487 -5.066 8.021 1.00 1.58 H new ATOM 1240 N LEU A 78 -0.817 -7.677 7.639 1.00 0.54 N ATOM 1241 CA LEU A 78 -1.036 -8.667 6.588 1.00 0.50 C ATOM 1242 C LEU A 78 -1.201 -10.067 7.139 1.00 0.53 C ATOM 1243 O LEU A 78 -0.805 -10.363 8.262 1.00 0.71 O ATOM 1244 CB LEU A 78 0.104 -8.658 5.573 1.00 0.45 C ATOM 1245 CG LEU A 78 0.110 -7.476 4.610 1.00 0.45 C ATOM 1246 CD1 LEU A 78 1.154 -7.688 3.522 1.00 0.49 C ATOM 1247 CD2 LEU A 78 -1.274 -7.279 4.008 1.00 0.51 C ATOM 0 H LEU A 78 0.090 -7.736 8.103 1.00 0.54 H new ATOM 0 HA LEU A 78 -1.965 -8.383 6.094 1.00 0.50 H new ATOM 0 HB2 LEU A 78 1.050 -8.669 6.114 1.00 0.45 H new ATOM 0 HB3 LEU A 78 0.058 -9.579 4.992 1.00 0.45 H new ATOM 0 HG LEU A 78 0.372 -6.572 5.161 1.00 0.45 H new ATOM 0 HD11 LEU A 78 1.148 -6.837 2.841 1.00 0.49 H new ATOM 0 HD12 LEU A 78 2.140 -7.782 3.977 1.00 0.49 H new ATOM 0 HD13 LEU A 78 0.922 -8.598 2.968 1.00 0.49 H new ATOM 0 HD21 LEU A 78 -1.255 -6.432 3.322 1.00 0.51 H new ATOM 0 HD22 LEU A 78 -1.566 -8.178 3.466 1.00 0.51 H new ATOM 0 HD23 LEU A 78 -1.993 -7.086 4.804 1.00 0.51 H new ATOM 1259 N GLN A 79 -1.807 -10.919 6.322 1.00 0.46 N ATOM 1260 CA GLN A 79 -2.026 -12.310 6.669 1.00 0.50 C ATOM 1261 C GLN A 79 -1.597 -13.212 5.532 1.00 0.48 C ATOM 1262 O GLN A 79 -0.604 -13.928 5.618 1.00 0.55 O ATOM 1263 CB GLN A 79 -3.507 -12.590 6.961 1.00 0.56 C ATOM 1264 CG GLN A 79 -4.024 -11.939 8.214 1.00 0.55 C ATOM 1265 CD GLN A 79 -5.245 -12.629 8.794 1.00 1.03 C ATOM 1266 OE1 GLN A 79 -6.088 -11.996 9.430 1.00 1.66 O ATOM 1267 NE2 GLN A 79 -5.337 -13.935 8.595 1.00 1.73 N ATOM 0 H GLN A 79 -2.159 -10.661 5.400 1.00 0.46 H new ATOM 0 HA GLN A 79 -1.434 -12.512 7.562 1.00 0.50 H new ATOM 0 HB2 GLN A 79 -4.103 -12.248 6.115 1.00 0.56 H new ATOM 0 HB3 GLN A 79 -3.653 -13.667 7.039 1.00 0.56 H new ATOM 0 HG2 GLN A 79 -3.232 -11.929 8.963 1.00 0.55 H new ATOM 0 HG3 GLN A 79 -4.272 -10.900 7.999 1.00 0.55 H new ATOM 0 HE21 GLN A 79 -4.616 -14.422 8.062 1.00 1.73 H new ATOM 0 HE22 GLN A 79 -6.129 -14.454 8.975 1.00 1.73 H new ATOM 1276 N VAL A 80 -2.366 -13.155 4.455 1.00 0.41 N ATOM 1277 CA VAL A 80 -2.301 -14.160 3.409 1.00 0.43 C ATOM 1278 C VAL A 80 -2.485 -13.510 2.039 1.00 0.39 C ATOM 1279 O VAL A 80 -3.351 -12.654 1.878 1.00 0.45 O ATOM 1280 CB VAL A 80 -3.422 -15.208 3.622 1.00 0.48 C ATOM 1281 CG1 VAL A 80 -3.258 -16.381 2.671 1.00 0.78 C ATOM 1282 CG2 VAL A 80 -3.470 -15.676 5.080 1.00 0.74 C ATOM 0 H VAL A 80 -3.048 -12.416 4.284 1.00 0.41 H new ATOM 0 HA VAL A 80 -1.325 -14.644 3.452 1.00 0.43 H new ATOM 0 HB VAL A 80 -4.376 -14.730 3.398 1.00 0.48 H new ATOM 0 HG11 VAL A 80 -4.058 -17.102 2.841 1.00 0.78 H new ATOM 0 HG12 VAL A 80 -3.304 -16.024 1.642 1.00 0.78 H new ATOM 0 HG13 VAL A 80 -2.294 -16.860 2.846 1.00 0.78 H new ATOM 0 HG21 VAL A 80 -4.266 -16.411 5.200 1.00 0.74 H new ATOM 0 HG22 VAL A 80 -2.515 -16.128 5.349 1.00 0.74 H new ATOM 0 HG23 VAL A 80 -3.663 -14.823 5.730 1.00 0.74 H new ATOM 1292 N TYR A 81 -1.678 -13.900 1.062 1.00 0.42 N ATOM 1293 CA TYR A 81 -1.823 -13.366 -0.286 1.00 0.46 C ATOM 1294 C TYR A 81 -2.185 -14.466 -1.284 1.00 0.51 C ATOM 1295 O TYR A 81 -1.749 -15.613 -1.153 1.00 0.78 O ATOM 1296 CB TYR A 81 -0.533 -12.668 -0.736 1.00 0.74 C ATOM 1297 CG TYR A 81 -0.607 -12.134 -2.152 1.00 1.91 C ATOM 1298 CD1 TYR A 81 -1.148 -10.881 -2.418 1.00 3.05 C ATOM 1299 CD2 TYR A 81 -0.117 -12.872 -3.218 1.00 2.02 C ATOM 1300 CE1 TYR A 81 -1.196 -10.382 -3.703 1.00 4.21 C ATOM 1301 CE2 TYR A 81 -0.166 -12.379 -4.506 1.00 3.15 C ATOM 1302 CZ TYR A 81 -0.781 -11.179 -4.757 1.00 4.24 C ATOM 1303 OH TYR A 81 -0.747 -10.636 -6.026 1.00 5.40 O ATOM 0 H TYR A 81 -0.923 -14.577 1.175 1.00 0.42 H new ATOM 0 HA TYR A 81 -2.634 -12.638 -0.262 1.00 0.46 H new ATOM 0 HB2 TYR A 81 -0.316 -11.845 -0.055 1.00 0.74 H new ATOM 0 HB3 TYR A 81 0.297 -13.370 -0.662 1.00 0.74 H new ATOM 0 HD1 TYR A 81 -1.538 -10.288 -1.604 1.00 3.05 H new ATOM 0 HD2 TYR A 81 0.310 -13.848 -3.038 1.00 2.02 H new ATOM 0 HE1 TYR A 81 -1.554 -9.379 -3.886 1.00 4.21 H new ATOM 0 HE2 TYR A 81 0.280 -12.938 -5.316 1.00 3.15 H new ATOM 0 HH TYR A 81 -1.258 -9.800 -6.038 1.00 5.40 H new ATOM 1313 N ASN A 82 -2.976 -14.092 -2.282 1.00 0.42 N ATOM 1314 CA ASN A 82 -3.346 -14.974 -3.373 1.00 0.46 C ATOM 1315 C ASN A 82 -3.400 -14.172 -4.662 1.00 0.44 C ATOM 1316 O ASN A 82 -4.104 -13.160 -4.754 1.00 0.45 O ATOM 1317 CB ASN A 82 -4.700 -15.643 -3.126 1.00 0.50 C ATOM 1318 CG ASN A 82 -4.651 -16.743 -2.080 1.00 0.93 C ATOM 1319 OD1 ASN A 82 -4.815 -16.492 -0.886 1.00 1.69 O ATOM 1320 ND2 ASN A 82 -4.451 -17.973 -2.525 1.00 1.40 N ATOM 0 H ASN A 82 -3.381 -13.158 -2.354 1.00 0.42 H new ATOM 0 HA ASN A 82 -2.596 -15.762 -3.446 1.00 0.46 H new ATOM 0 HB2 ASN A 82 -5.418 -14.886 -2.812 1.00 0.50 H new ATOM 0 HB3 ASN A 82 -5.066 -16.061 -4.064 1.00 0.50 H new ATOM 0 HD21 ASN A 82 -4.429 -18.755 -1.870 1.00 1.40 H new ATOM 0 HD22 ASN A 82 -4.319 -18.139 -3.523 1.00 1.40 H new ATOM 1327 N MET A 83 -2.642 -14.617 -5.639 1.00 0.47 N ATOM 1328 CA MET A 83 -2.544 -13.946 -6.922 1.00 0.48 C ATOM 1329 C MET A 83 -3.734 -14.365 -7.783 1.00 0.47 C ATOM 1330 O MET A 83 -3.719 -15.426 -8.408 1.00 0.57 O ATOM 1331 CB MET A 83 -1.217 -14.353 -7.563 1.00 0.58 C ATOM 1332 CG MET A 83 -0.476 -13.237 -8.291 1.00 0.63 C ATOM 1333 SD MET A 83 1.118 -13.790 -8.934 1.00 1.66 S ATOM 1334 CE MET A 83 1.925 -12.221 -9.239 1.00 2.05 C ATOM 0 H MET A 83 -2.072 -15.460 -5.568 1.00 0.47 H new ATOM 0 HA MET A 83 -2.567 -12.861 -6.815 1.00 0.48 H new ATOM 0 HB2 MET A 83 -0.565 -14.753 -6.787 1.00 0.58 H new ATOM 0 HB3 MET A 83 -1.406 -15.162 -8.269 1.00 0.58 H new ATOM 0 HG2 MET A 83 -1.091 -12.870 -9.113 1.00 0.63 H new ATOM 0 HG3 MET A 83 -0.321 -12.400 -7.610 1.00 0.63 H new ATOM 0 HE1 MET A 83 2.554 -12.302 -10.126 1.00 2.05 H new ATOM 0 HE2 MET A 83 1.172 -11.449 -9.397 1.00 2.05 H new ATOM 0 HE3 MET A 83 2.542 -11.956 -8.380 1.00 2.05 H new ATOM 1344 N VAL A 84 -4.770 -13.526 -7.793 1.00 0.38 N ATOM 1345 CA VAL A 84 -6.070 -13.909 -8.355 1.00 0.39 C ATOM 1346 C VAL A 84 -6.036 -13.969 -9.870 1.00 0.42 C ATOM 1347 O VAL A 84 -5.927 -15.038 -10.463 1.00 0.64 O ATOM 1348 CB VAL A 84 -7.207 -12.941 -7.950 1.00 0.38 C ATOM 1349 CG1 VAL A 84 -8.436 -13.709 -7.500 1.00 0.55 C ATOM 1350 CG2 VAL A 84 -6.761 -11.959 -6.883 1.00 0.42 C ATOM 0 H VAL A 84 -4.737 -12.577 -7.419 1.00 0.38 H new ATOM 0 HA VAL A 84 -6.273 -14.897 -7.942 1.00 0.39 H new ATOM 0 HB VAL A 84 -7.469 -12.360 -8.834 1.00 0.38 H new ATOM 0 HG11 VAL A 84 -9.222 -13.007 -7.220 1.00 0.55 H new ATOM 0 HG12 VAL A 84 -8.788 -14.342 -8.315 1.00 0.55 H new ATOM 0 HG13 VAL A 84 -8.182 -14.331 -6.641 1.00 0.55 H new ATOM 0 HG21 VAL A 84 -7.589 -11.298 -6.628 1.00 0.42 H new ATOM 0 HG22 VAL A 84 -6.446 -12.506 -5.994 1.00 0.42 H new ATOM 0 HG23 VAL A 84 -5.927 -11.367 -7.259 1.00 0.42 H new ATOM 1360 N HIS A 85 -6.140 -12.811 -10.493 1.00 0.30 N ATOM 1361 CA HIS A 85 -6.182 -12.730 -11.937 1.00 0.31 C ATOM 1362 C HIS A 85 -5.103 -11.774 -12.409 1.00 0.32 C ATOM 1363 O HIS A 85 -5.103 -10.596 -12.054 1.00 0.38 O ATOM 1364 CB HIS A 85 -7.568 -12.272 -12.407 1.00 0.37 C ATOM 1365 CG HIS A 85 -7.835 -12.537 -13.857 1.00 0.80 C ATOM 1366 ND1 HIS A 85 -8.557 -13.627 -14.305 1.00 1.36 N ATOM 1367 CD2 HIS A 85 -7.482 -11.843 -14.966 1.00 1.71 C ATOM 1368 CE1 HIS A 85 -8.632 -13.589 -15.622 1.00 1.75 C ATOM 1369 NE2 HIS A 85 -7.988 -12.519 -16.046 1.00 1.96 N ATOM 0 H HIS A 85 -6.197 -11.910 -10.018 1.00 0.30 H new ATOM 0 HA HIS A 85 -5.998 -13.715 -12.366 1.00 0.31 H new ATOM 0 HB2 HIS A 85 -8.328 -12.775 -11.810 1.00 0.37 H new ATOM 0 HB3 HIS A 85 -7.670 -11.203 -12.218 1.00 0.37 H new ATOM 0 HD1 HIS A 85 -8.967 -14.348 -13.711 1.00 1.36 H new ATOM 0 HD2 HIS A 85 -6.909 -10.928 -14.994 1.00 1.71 H new ATOM 0 HE1 HIS A 85 -9.136 -14.312 -16.247 1.00 1.75 H new ATOM 1378 N ARG A 86 -4.175 -12.291 -13.185 1.00 0.34 N ATOM 1379 CA ARG A 86 -3.036 -11.514 -13.632 1.00 0.36 C ATOM 1380 C ARG A 86 -3.243 -11.102 -15.079 1.00 0.38 C ATOM 1381 O ARG A 86 -3.096 -11.908 -16.001 1.00 0.52 O ATOM 1382 CB ARG A 86 -1.759 -12.333 -13.463 1.00 0.40 C ATOM 1383 CG ARG A 86 -1.699 -13.082 -12.135 1.00 0.45 C ATOM 1384 CD ARG A 86 -0.348 -13.744 -11.932 1.00 0.69 C ATOM 1385 NE ARG A 86 -0.059 -14.738 -12.962 1.00 1.15 N ATOM 1386 CZ ARG A 86 1.077 -15.425 -13.034 1.00 1.68 C ATOM 1387 NH1 ARG A 86 2.012 -15.270 -12.105 1.00 1.98 N ATOM 1388 NH2 ARG A 86 1.272 -16.284 -14.025 1.00 2.44 N ATOM 0 H ARG A 86 -4.187 -13.254 -13.522 1.00 0.34 H new ATOM 0 HA ARG A 86 -2.940 -10.610 -13.030 1.00 0.36 H new ATOM 0 HB2 ARG A 86 -1.683 -13.049 -14.281 1.00 0.40 H new ATOM 0 HB3 ARG A 86 -0.897 -11.670 -13.539 1.00 0.40 H new ATOM 0 HG2 ARG A 86 -1.893 -12.389 -11.316 1.00 0.45 H new ATOM 0 HG3 ARG A 86 -2.484 -13.838 -12.106 1.00 0.45 H new ATOM 0 HD2 ARG A 86 0.432 -12.982 -11.936 1.00 0.69 H new ATOM 0 HD3 ARG A 86 -0.323 -14.221 -10.952 1.00 0.69 H new ATOM 0 HE ARG A 86 -0.772 -14.916 -13.669 1.00 1.15 H new ATOM 0 HH11 ARG A 86 1.860 -14.622 -11.332 1.00 1.98 H new ATOM 0 HH12 ARG A 86 2.882 -15.799 -12.164 1.00 1.98 H new ATOM 0 HH21 ARG A 86 0.550 -16.418 -14.733 1.00 2.44 H new ATOM 0 HH22 ARG A 86 2.144 -16.811 -14.079 1.00 2.44 H new ATOM 1402 N ILE A 87 -3.608 -9.842 -15.257 1.00 0.35 N ATOM 1403 CA ILE A 87 -3.983 -9.311 -16.561 1.00 0.36 C ATOM 1404 C ILE A 87 -2.779 -9.270 -17.481 1.00 0.39 C ATOM 1405 O ILE A 87 -2.867 -9.592 -18.666 1.00 0.47 O ATOM 1406 CB ILE A 87 -4.574 -7.881 -16.473 1.00 0.38 C ATOM 1407 CG1 ILE A 87 -4.676 -7.376 -15.020 1.00 0.32 C ATOM 1408 CG2 ILE A 87 -5.931 -7.831 -17.152 1.00 0.44 C ATOM 1409 CD1 ILE A 87 -5.662 -8.117 -14.135 1.00 0.27 C ATOM 0 H ILE A 87 -3.653 -9.157 -14.502 1.00 0.35 H new ATOM 0 HA ILE A 87 -4.749 -9.979 -16.955 1.00 0.36 H new ATOM 0 HB ILE A 87 -3.887 -7.214 -16.994 1.00 0.38 H new ATOM 0 HG12 ILE A 87 -3.688 -7.437 -14.563 1.00 0.32 H new ATOM 0 HG13 ILE A 87 -4.954 -6.322 -15.039 1.00 0.32 H new ATOM 0 HG21 ILE A 87 -6.335 -6.821 -17.083 1.00 0.44 H new ATOM 0 HG22 ILE A 87 -5.824 -8.108 -18.201 1.00 0.44 H new ATOM 0 HG23 ILE A 87 -6.610 -8.528 -16.660 1.00 0.44 H new ATOM 0 HD11 ILE A 87 -5.654 -7.681 -13.136 1.00 0.27 H new ATOM 0 HD12 ILE A 87 -6.663 -8.035 -14.558 1.00 0.27 H new ATOM 0 HD13 ILE A 87 -5.378 -9.168 -14.074 1.00 0.27 H new ATOM 1421 N ASP A 88 -1.659 -8.866 -16.919 1.00 0.42 N ATOM 1422 CA ASP A 88 -0.410 -8.798 -17.649 1.00 0.56 C ATOM 1423 C ASP A 88 0.719 -9.081 -16.670 1.00 0.67 C ATOM 1424 O ASP A 88 0.479 -9.626 -15.592 1.00 1.18 O ATOM 1425 CB ASP A 88 -0.244 -7.412 -18.290 1.00 0.65 C ATOM 1426 CG ASP A 88 0.633 -7.428 -19.533 1.00 1.16 C ATOM 1427 OD1 ASP A 88 1.868 -7.556 -19.395 1.00 1.86 O ATOM 1428 OD2 ASP A 88 0.093 -7.327 -20.656 1.00 1.35 O ATOM 0 H ASP A 88 -1.589 -8.576 -15.944 1.00 0.42 H new ATOM 0 HA ASP A 88 -0.397 -9.534 -18.453 1.00 0.56 H new ATOM 0 HB2 ASP A 88 -1.227 -7.020 -18.552 1.00 0.65 H new ATOM 0 HB3 ASP A 88 0.187 -6.729 -17.558 1.00 0.65 H new ATOM 1433 N SER A 89 1.928 -8.709 -17.020 1.00 0.65 N ATOM 1434 CA SER A 89 3.049 -8.849 -16.111 1.00 0.70 C ATOM 1435 C SER A 89 3.248 -7.557 -15.330 1.00 0.53 C ATOM 1436 O SER A 89 4.178 -7.433 -14.534 1.00 0.59 O ATOM 1437 CB SER A 89 4.310 -9.188 -16.895 1.00 0.94 C ATOM 1438 OG SER A 89 4.114 -10.350 -17.685 1.00 1.44 O ATOM 0 H SER A 89 2.164 -8.307 -17.927 1.00 0.65 H new ATOM 0 HA SER A 89 2.842 -9.656 -15.408 1.00 0.70 H new ATOM 0 HB2 SER A 89 4.582 -8.349 -17.535 1.00 0.94 H new ATOM 0 HB3 SER A 89 5.140 -9.346 -16.207 1.00 0.94 H new ATOM 0 HG SER A 89 4.935 -10.550 -18.182 1.00 1.44 H new ATOM 1444 N ASP A 90 2.351 -6.603 -15.548 1.00 0.47 N ATOM 1445 CA ASP A 90 2.480 -5.289 -14.951 1.00 0.48 C ATOM 1446 C ASP A 90 1.219 -4.969 -14.186 1.00 0.39 C ATOM 1447 O ASP A 90 1.110 -3.928 -13.542 1.00 0.41 O ATOM 1448 CB ASP A 90 2.701 -4.221 -16.029 1.00 0.73 C ATOM 1449 CG ASP A 90 3.974 -4.427 -16.821 1.00 1.21 C ATOM 1450 OD1 ASP A 90 3.940 -5.175 -17.818 1.00 1.87 O ATOM 1451 OD2 ASP A 90 5.021 -3.863 -16.438 1.00 1.70 O ATOM 0 H ASP A 90 1.526 -6.720 -16.136 1.00 0.47 H new ATOM 0 HA ASP A 90 3.340 -5.291 -14.281 1.00 0.48 H new ATOM 0 HB2 ASP A 90 1.852 -4.223 -16.712 1.00 0.73 H new ATOM 0 HB3 ASP A 90 2.729 -3.239 -15.558 1.00 0.73 H new ATOM 1456 N THR A 91 0.252 -5.872 -14.262 1.00 0.35 N ATOM 1457 CA THR A 91 -1.046 -5.605 -13.730 1.00 0.32 C ATOM 1458 C THR A 91 -1.636 -6.889 -13.181 1.00 0.28 C ATOM 1459 O THR A 91 -1.840 -7.857 -13.919 1.00 0.30 O ATOM 1460 CB THR A 91 -1.956 -5.032 -14.829 1.00 0.36 C ATOM 1461 OG1 THR A 91 -1.202 -4.156 -15.674 1.00 0.46 O ATOM 1462 CG2 THR A 91 -3.102 -4.262 -14.226 1.00 0.35 C ATOM 0 H THR A 91 0.357 -6.792 -14.690 1.00 0.35 H new ATOM 0 HA THR A 91 -0.966 -4.872 -12.927 1.00 0.32 H new ATOM 0 HB THR A 91 -2.353 -5.864 -15.411 1.00 0.36 H new ATOM 0 HG1 THR A 91 -1.372 -3.226 -15.416 1.00 0.46 H new ATOM 0 HG21 THR A 91 -3.733 -3.866 -15.022 1.00 0.35 H new ATOM 0 HG22 THR A 91 -3.691 -4.924 -13.592 1.00 0.35 H new ATOM 0 HG23 THR A 91 -2.712 -3.438 -13.628 1.00 0.35 H new ATOM 1470 N PHE A 92 -1.866 -6.907 -11.888 1.00 0.25 N ATOM 1471 CA PHE A 92 -2.385 -8.082 -11.222 1.00 0.25 C ATOM 1472 C PHE A 92 -3.571 -7.688 -10.373 1.00 0.22 C ATOM 1473 O PHE A 92 -3.908 -6.515 -10.278 1.00 0.21 O ATOM 1474 CB PHE A 92 -1.327 -8.704 -10.305 1.00 0.30 C ATOM 1475 CG PHE A 92 0.039 -8.814 -10.910 1.00 0.32 C ATOM 1476 CD1 PHE A 92 0.911 -7.743 -10.885 1.00 0.33 C ATOM 1477 CD2 PHE A 92 0.441 -9.990 -11.518 1.00 0.39 C ATOM 1478 CE1 PHE A 92 2.162 -7.842 -11.453 1.00 0.38 C ATOM 1479 CE2 PHE A 92 1.689 -10.100 -12.088 1.00 0.43 C ATOM 1480 CZ PHE A 92 2.580 -9.012 -12.004 1.00 0.41 C ATOM 0 H PHE A 92 -1.700 -6.113 -11.270 1.00 0.25 H new ATOM 0 HA PHE A 92 -2.672 -8.807 -11.983 1.00 0.25 H new ATOM 0 HB2 PHE A 92 -1.259 -8.108 -9.395 1.00 0.30 H new ATOM 0 HB3 PHE A 92 -1.660 -9.699 -10.011 1.00 0.30 H new ATOM 0 HD1 PHE A 92 0.609 -6.819 -10.415 1.00 0.33 H new ATOM 0 HD2 PHE A 92 -0.234 -10.833 -11.546 1.00 0.39 H new ATOM 0 HE1 PHE A 92 2.816 -6.983 -11.461 1.00 0.38 H new ATOM 0 HE2 PHE A 92 1.981 -11.009 -12.593 1.00 0.43 H new ATOM 0 HZ PHE A 92 3.590 -9.107 -12.375 1.00 0.41 H new ATOM 1490 N ILE A 93 -4.194 -8.660 -9.752 1.00 0.23 N ATOM 1491 CA ILE A 93 -5.184 -8.395 -8.731 1.00 0.23 C ATOM 1492 C ILE A 93 -4.735 -9.088 -7.456 1.00 0.28 C ATOM 1493 O ILE A 93 -4.344 -10.257 -7.492 1.00 0.33 O ATOM 1494 CB ILE A 93 -6.583 -8.891 -9.140 1.00 0.23 C ATOM 1495 CG1 ILE A 93 -6.982 -8.303 -10.498 1.00 0.24 C ATOM 1496 CG2 ILE A 93 -7.599 -8.515 -8.071 1.00 0.26 C ATOM 1497 CD1 ILE A 93 -7.970 -7.166 -10.410 1.00 0.41 C ATOM 0 H ILE A 93 -4.033 -9.650 -9.936 1.00 0.23 H new ATOM 0 HA ILE A 93 -5.264 -7.318 -8.583 1.00 0.23 H new ATOM 0 HB ILE A 93 -6.561 -9.977 -9.233 1.00 0.23 H new ATOM 0 HG12 ILE A 93 -6.085 -7.952 -11.008 1.00 0.24 H new ATOM 0 HG13 ILE A 93 -7.409 -9.095 -11.113 1.00 0.24 H new ATOM 0 HG21 ILE A 93 -8.586 -8.869 -8.367 1.00 0.26 H new ATOM 0 HG22 ILE A 93 -7.318 -8.975 -7.124 1.00 0.26 H new ATOM 0 HG23 ILE A 93 -7.622 -7.431 -7.956 1.00 0.26 H new ATOM 0 HD11 ILE A 93 -8.201 -6.806 -11.413 1.00 0.41 H new ATOM 0 HD12 ILE A 93 -8.885 -7.515 -9.930 1.00 0.41 H new ATOM 0 HD13 ILE A 93 -7.540 -6.355 -9.823 1.00 0.41 H new ATOM 1509 N CYS A 94 -4.757 -8.376 -6.343 1.00 0.36 N ATOM 1510 CA CYS A 94 -4.211 -8.906 -5.111 1.00 0.48 C ATOM 1511 C CYS A 94 -5.307 -9.281 -4.128 1.00 0.39 C ATOM 1512 O CYS A 94 -5.974 -8.410 -3.569 1.00 0.47 O ATOM 1513 CB CYS A 94 -3.246 -7.897 -4.473 1.00 0.74 C ATOM 1514 SG CYS A 94 -3.940 -6.253 -4.198 1.00 2.01 S ATOM 0 H CYS A 94 -5.145 -7.436 -6.269 1.00 0.36 H new ATOM 0 HA CYS A 94 -3.662 -9.814 -5.359 1.00 0.48 H new ATOM 0 HB2 CYS A 94 -2.905 -8.296 -3.518 1.00 0.74 H new ATOM 0 HB3 CYS A 94 -2.367 -7.803 -5.111 1.00 0.74 H new ATOM 0 HG CYS A 94 -4.651 -5.904 -5.229 1.00 2.01 H new ATOM 1520 N HIS A 95 -5.512 -10.585 -3.962 1.00 0.37 N ATOM 1521 CA HIS A 95 -6.320 -11.097 -2.868 1.00 0.36 C ATOM 1522 C HIS A 95 -5.455 -11.150 -1.616 1.00 0.39 C ATOM 1523 O HIS A 95 -4.605 -12.028 -1.473 1.00 0.56 O ATOM 1524 CB HIS A 95 -6.893 -12.482 -3.204 1.00 0.41 C ATOM 1525 CG HIS A 95 -7.511 -13.205 -2.036 1.00 0.50 C ATOM 1526 ND1 HIS A 95 -7.179 -14.383 -1.460 1.00 1.20 N flip ATOM 1527 CD2 HIS A 95 -8.599 -12.738 -1.330 1.00 1.23 C flip ATOM 1528 CE1 HIS A 95 -8.060 -14.609 -0.438 1.00 0.99 C flip ATOM 1529 NE2 HIS A 95 -8.906 -13.601 -0.379 1.00 0.95 N flip ATOM 0 H HIS A 95 -5.127 -11.304 -4.574 1.00 0.37 H new ATOM 0 HA HIS A 95 -7.170 -10.436 -2.699 1.00 0.36 H new ATOM 0 HB2 HIS A 95 -7.646 -12.370 -3.984 1.00 0.41 H new ATOM 0 HB3 HIS A 95 -6.096 -13.100 -3.617 1.00 0.41 H new ATOM 0 HD2 HIS A 95 -9.119 -11.811 -1.524 1.00 1.23 H new ATOM 0 HE1 HIS A 95 -8.062 -15.471 0.213 1.00 0.99 H new ATOM 0 HE2 HIS A 95 -9.670 -13.503 0.289 1.00 0.95 H new ATOM 1538 N THR A 96 -5.663 -10.198 -0.734 1.00 0.35 N ATOM 1539 CA THR A 96 -4.784 -9.998 0.404 1.00 0.38 C ATOM 1540 C THR A 96 -5.552 -10.012 1.720 1.00 0.36 C ATOM 1541 O THR A 96 -6.304 -9.089 2.014 1.00 0.41 O ATOM 1542 CB THR A 96 -4.058 -8.650 0.262 1.00 0.43 C ATOM 1543 OG1 THR A 96 -3.407 -8.584 -1.014 1.00 0.50 O ATOM 1544 CG2 THR A 96 -3.038 -8.451 1.377 1.00 0.47 C ATOM 0 H THR A 96 -6.442 -9.541 -0.782 1.00 0.35 H new ATOM 0 HA THR A 96 -4.067 -10.819 0.418 1.00 0.38 H new ATOM 0 HB THR A 96 -4.799 -7.854 0.337 1.00 0.43 H new ATOM 0 HG1 THR A 96 -2.947 -7.723 -1.102 1.00 0.50 H new ATOM 0 HG21 THR A 96 -2.542 -7.489 1.249 1.00 0.47 H new ATOM 0 HG22 THR A 96 -3.545 -8.472 2.342 1.00 0.47 H new ATOM 0 HG23 THR A 96 -2.297 -9.250 1.339 1.00 0.47 H new ATOM 1552 N ILE A 97 -5.346 -11.036 2.530 1.00 0.38 N ATOM 1553 CA ILE A 97 -6.001 -11.085 3.823 1.00 0.40 C ATOM 1554 C ILE A 97 -5.291 -10.149 4.796 1.00 0.41 C ATOM 1555 O ILE A 97 -4.059 -10.096 4.851 1.00 0.42 O ATOM 1556 CB ILE A 97 -6.053 -12.507 4.418 1.00 0.47 C ATOM 1557 CG1 ILE A 97 -6.599 -13.500 3.388 1.00 0.56 C ATOM 1558 CG2 ILE A 97 -6.924 -12.509 5.670 1.00 0.51 C ATOM 1559 CD1 ILE A 97 -8.031 -13.231 2.974 1.00 1.03 C ATOM 0 H ILE A 97 -4.742 -11.831 2.320 1.00 0.38 H new ATOM 0 HA ILE A 97 -7.031 -10.765 3.669 1.00 0.40 H new ATOM 0 HB ILE A 97 -5.042 -12.815 4.686 1.00 0.47 H new ATOM 0 HG12 ILE A 97 -5.964 -13.475 2.502 1.00 0.56 H new ATOM 0 HG13 ILE A 97 -6.533 -14.507 3.799 1.00 0.56 H new ATOM 0 HG21 ILE A 97 -6.958 -13.515 6.088 1.00 0.51 H new ATOM 0 HG22 ILE A 97 -6.504 -11.825 6.407 1.00 0.51 H new ATOM 0 HG23 ILE A 97 -7.933 -12.189 5.412 1.00 0.51 H new ATOM 0 HD11 ILE A 97 -8.345 -13.976 2.243 1.00 1.03 H new ATOM 0 HD12 ILE A 97 -8.679 -13.286 3.849 1.00 1.03 H new ATOM 0 HD13 ILE A 97 -8.101 -12.237 2.532 1.00 1.03 H new ATOM 1571 N THR A 98 -6.088 -9.417 5.545 1.00 0.49 N ATOM 1572 CA THR A 98 -5.621 -8.352 6.402 1.00 0.56 C ATOM 1573 C THR A 98 -5.831 -8.729 7.858 1.00 0.63 C ATOM 1574 O THR A 98 -6.809 -9.399 8.200 1.00 0.77 O ATOM 1575 CB THR A 98 -6.391 -7.054 6.103 1.00 0.71 C ATOM 1576 OG1 THR A 98 -6.656 -6.963 4.700 1.00 1.38 O ATOM 1577 CG2 THR A 98 -5.597 -5.839 6.542 1.00 0.86 C ATOM 0 H THR A 98 -7.099 -9.550 5.575 1.00 0.49 H new ATOM 0 HA THR A 98 -4.559 -8.195 6.213 1.00 0.56 H new ATOM 0 HB THR A 98 -7.329 -7.078 6.658 1.00 0.71 H new ATOM 0 HG1 THR A 98 -6.168 -6.201 4.324 1.00 1.38 H new ATOM 0 HG21 THR A 98 -6.163 -4.935 6.320 1.00 0.86 H new ATOM 0 HG22 THR A 98 -5.409 -5.895 7.614 1.00 0.86 H new ATOM 0 HG23 THR A 98 -4.647 -5.813 6.008 1.00 0.86 H new ATOM 1585 N GLN A 99 -4.934 -8.272 8.707 1.00 0.59 N ATOM 1586 CA GLN A 99 -4.991 -8.589 10.121 1.00 0.72 C ATOM 1587 C GLN A 99 -5.838 -7.567 10.859 1.00 0.99 C ATOM 1588 O GLN A 99 -6.022 -6.444 10.393 1.00 1.32 O ATOM 1589 CB GLN A 99 -3.584 -8.638 10.724 1.00 0.61 C ATOM 1590 CG GLN A 99 -3.017 -10.045 10.822 1.00 0.80 C ATOM 1591 CD GLN A 99 -1.637 -10.091 11.456 1.00 1.04 C ATOM 1592 OE1 GLN A 99 -1.336 -9.124 12.309 1.00 1.62 O flip ATOM 1593 NE2 GLN A 99 -0.847 -10.991 11.179 1.00 1.82 N flip ATOM 0 H GLN A 99 -4.151 -7.675 8.441 1.00 0.59 H new ATOM 0 HA GLN A 99 -5.449 -9.572 10.230 1.00 0.72 H new ATOM 0 HB2 GLN A 99 -2.916 -8.026 10.118 1.00 0.61 H new ATOM 0 HB3 GLN A 99 -3.608 -8.194 11.719 1.00 0.61 H new ATOM 0 HG2 GLN A 99 -3.698 -10.665 11.405 1.00 0.80 H new ATOM 0 HG3 GLN A 99 -2.966 -10.480 9.824 1.00 0.80 H new ATOM 0 HE21 GLN A 99 -1.115 -11.719 10.517 1.00 1.82 H new ATOM 0 HE22 GLN A 99 0.077 -11.010 11.611 1.00 1.82 H new ATOM 1602 N SER A 100 -6.353 -7.972 12.005 1.00 1.67 N ATOM 1603 CA SER A 100 -7.175 -7.109 12.828 1.00 2.03 C ATOM 1604 C SER A 100 -6.298 -6.114 13.575 1.00 1.60 C ATOM 1605 O SER A 100 -5.904 -6.345 14.722 1.00 2.41 O ATOM 1606 CB SER A 100 -7.978 -7.952 13.814 1.00 3.23 C ATOM 1607 OG SER A 100 -8.618 -9.030 13.151 1.00 3.91 O ATOM 0 H SER A 100 -6.213 -8.906 12.390 1.00 1.67 H new ATOM 0 HA SER A 100 -7.866 -6.556 12.192 1.00 2.03 H new ATOM 0 HB2 SER A 100 -7.318 -8.338 14.591 1.00 3.23 H new ATOM 0 HB3 SER A 100 -8.724 -7.329 14.309 1.00 3.23 H new ATOM 0 HG SER A 100 -9.126 -9.559 13.801 1.00 3.91 H new ATOM 1613 N PHE A 101 -5.975 -5.018 12.911 1.00 0.91 N ATOM 1614 CA PHE A 101 -5.152 -3.997 13.486 1.00 1.37 C ATOM 1615 C PHE A 101 -6.031 -2.958 14.150 1.00 1.09 C ATOM 1616 O PHE A 101 -7.262 -3.041 14.097 1.00 1.69 O ATOM 1617 CB PHE A 101 -4.230 -3.363 12.430 1.00 2.29 C ATOM 1618 CG PHE A 101 -4.938 -2.677 11.292 1.00 2.99 C ATOM 1619 CD1 PHE A 101 -5.589 -3.419 10.321 1.00 3.48 C ATOM 1620 CD2 PHE A 101 -4.967 -1.295 11.201 1.00 3.67 C ATOM 1621 CE1 PHE A 101 -6.250 -2.797 9.280 1.00 4.58 C ATOM 1622 CE2 PHE A 101 -5.626 -0.667 10.164 1.00 4.71 C ATOM 1623 CZ PHE A 101 -6.219 -1.401 9.179 1.00 5.16 C ATOM 0 H PHE A 101 -6.282 -4.821 11.958 1.00 0.91 H new ATOM 0 HA PHE A 101 -4.506 -4.445 14.241 1.00 1.37 H new ATOM 0 HB2 PHE A 101 -3.582 -2.639 12.924 1.00 2.29 H new ATOM 0 HB3 PHE A 101 -3.585 -4.140 12.020 1.00 2.29 H new ATOM 0 HD1 PHE A 101 -5.580 -4.497 10.378 1.00 3.48 H new ATOM 0 HD2 PHE A 101 -4.467 -0.701 11.952 1.00 3.67 H new ATOM 0 HE1 PHE A 101 -6.787 -3.383 8.549 1.00 4.58 H new ATOM 0 HE2 PHE A 101 -5.673 0.412 10.132 1.00 4.71 H new ATOM 0 HZ PHE A 101 -6.662 -0.908 8.326 1.00 5.16 H new ATOM 1633 N ALA A 102 -5.386 -2.014 14.801 1.00 1.17 N ATOM 1634 CA ALA A 102 -6.065 -1.005 15.609 1.00 1.07 C ATOM 1635 C ALA A 102 -6.739 -1.670 16.802 1.00 1.42 C ATOM 1636 O ALA A 102 -7.877 -1.353 17.142 1.00 1.98 O ATOM 1637 CB ALA A 102 -7.072 -0.218 14.776 1.00 0.98 C ATOM 0 H ALA A 102 -4.371 -1.918 14.789 1.00 1.17 H new ATOM 0 HA ALA A 102 -5.324 -0.294 15.976 1.00 1.07 H new ATOM 0 HB1 ALA A 102 -7.562 0.526 15.404 1.00 0.98 H new ATOM 0 HB2 ALA A 102 -6.555 0.283 13.957 1.00 0.98 H new ATOM 0 HB3 ALA A 102 -7.820 -0.899 14.370 1.00 0.98 H new ATOM 1643 N VAL A 103 -6.018 -2.636 17.385 1.00 1.54 N ATOM 1644 CA VAL A 103 -6.427 -3.386 18.583 1.00 2.05 C ATOM 1645 C VAL A 103 -7.600 -4.337 18.312 1.00 1.79 C ATOM 1646 O VAL A 103 -7.748 -5.355 18.990 1.00 2.21 O ATOM 1647 CB VAL A 103 -6.743 -2.463 19.797 1.00 2.56 C ATOM 1648 CG1 VAL A 103 -8.231 -2.157 19.933 1.00 3.03 C ATOM 1649 CG2 VAL A 103 -6.208 -3.083 21.077 1.00 3.17 C ATOM 0 H VAL A 103 -5.108 -2.927 17.027 1.00 1.54 H new ATOM 0 HA VAL A 103 -5.561 -3.992 18.848 1.00 2.05 H new ATOM 0 HB VAL A 103 -6.243 -1.512 19.616 1.00 2.56 H new ATOM 0 HG11 VAL A 103 -8.392 -1.510 20.795 1.00 3.03 H new ATOM 0 HG12 VAL A 103 -8.583 -1.655 19.032 1.00 3.03 H new ATOM 0 HG13 VAL A 103 -8.783 -3.087 20.069 1.00 3.03 H new ATOM 0 HG21 VAL A 103 -6.434 -2.430 21.920 1.00 3.17 H new ATOM 0 HG22 VAL A 103 -6.677 -4.054 21.235 1.00 3.17 H new ATOM 0 HG23 VAL A 103 -5.128 -3.210 20.996 1.00 3.17 H new ATOM 1659 N GLY A 104 -8.405 -4.036 17.304 1.00 1.47 N ATOM 1660 CA GLY A 104 -9.573 -4.848 17.034 1.00 1.84 C ATOM 1661 C GLY A 104 -10.770 -4.018 16.622 1.00 1.67 C ATOM 1662 O GLY A 104 -11.849 -4.556 16.365 1.00 1.96 O ATOM 0 H GLY A 104 -8.271 -3.248 16.671 1.00 1.47 H new ATOM 0 HA2 GLY A 104 -9.341 -5.563 16.244 1.00 1.84 H new ATOM 0 HA3 GLY A 104 -9.824 -5.426 17.923 1.00 1.84 H new ATOM 1666 N SER A 105 -10.585 -2.701 16.578 1.00 1.38 N ATOM 1667 CA SER A 105 -11.615 -1.799 16.076 1.00 1.39 C ATOM 1668 C SER A 105 -11.872 -2.073 14.598 1.00 1.19 C ATOM 1669 O SER A 105 -12.949 -1.801 14.067 1.00 1.34 O ATOM 1670 CB SER A 105 -11.166 -0.348 16.252 1.00 1.59 C ATOM 1671 OG SER A 105 -10.766 -0.085 17.590 1.00 1.88 O ATOM 0 H SER A 105 -9.731 -2.236 16.884 1.00 1.38 H new ATOM 0 HA SER A 105 -12.533 -1.965 16.639 1.00 1.39 H new ATOM 0 HB2 SER A 105 -10.338 -0.138 15.576 1.00 1.59 H new ATOM 0 HB3 SER A 105 -11.980 0.322 15.976 1.00 1.59 H new ATOM 0 HG SER A 105 -9.849 -0.403 17.726 1.00 1.88 H new ATOM 1677 N ILE A 106 -10.861 -2.617 13.947 1.00 1.05 N ATOM 1678 CA ILE A 106 -10.917 -2.904 12.532 1.00 0.96 C ATOM 1679 C ILE A 106 -10.903 -4.413 12.312 1.00 0.94 C ATOM 1680 O ILE A 106 -9.911 -5.087 12.593 1.00 1.12 O ATOM 1681 CB ILE A 106 -9.739 -2.214 11.817 1.00 0.93 C ATOM 1682 CG1 ILE A 106 -9.825 -0.705 12.077 1.00 1.01 C ATOM 1683 CG2 ILE A 106 -9.756 -2.512 10.325 1.00 0.98 C ATOM 1684 CD1 ILE A 106 -8.525 0.039 11.887 1.00 0.94 C ATOM 0 H ILE A 106 -9.977 -2.872 14.388 1.00 1.05 H new ATOM 0 HA ILE A 106 -11.842 -2.513 12.109 1.00 0.96 H new ATOM 0 HB ILE A 106 -8.798 -2.599 12.210 1.00 0.93 H new ATOM 0 HG12 ILE A 106 -10.574 -0.277 11.411 1.00 1.01 H new ATOM 0 HG13 ILE A 106 -10.175 -0.544 13.097 1.00 1.01 H new ATOM 0 HG21 ILE A 106 -8.914 -2.013 9.845 1.00 0.98 H new ATOM 0 HG22 ILE A 106 -9.678 -3.588 10.168 1.00 0.98 H new ATOM 0 HG23 ILE A 106 -10.688 -2.149 9.892 1.00 0.98 H new ATOM 0 HD11 ILE A 106 -8.679 1.098 12.092 1.00 0.94 H new ATOM 0 HD12 ILE A 106 -7.775 -0.358 12.572 1.00 0.94 H new ATOM 0 HD13 ILE A 106 -8.181 -0.086 10.860 1.00 0.94 H new ATOM 1696 N SER A 107 -12.031 -4.931 11.840 1.00 0.84 N ATOM 1697 CA SER A 107 -12.241 -6.367 11.722 1.00 0.86 C ATOM 1698 C SER A 107 -11.344 -6.989 10.653 1.00 0.79 C ATOM 1699 O SER A 107 -10.883 -6.290 9.742 1.00 0.77 O ATOM 1700 CB SER A 107 -13.715 -6.626 11.397 1.00 0.97 C ATOM 1701 OG SER A 107 -14.164 -5.789 10.339 1.00 1.35 O ATOM 0 H SER A 107 -12.823 -4.368 11.529 1.00 0.84 H new ATOM 0 HA SER A 107 -11.977 -6.835 12.670 1.00 0.86 H new ATOM 0 HB2 SER A 107 -13.850 -7.671 11.119 1.00 0.97 H new ATOM 0 HB3 SER A 107 -14.322 -6.451 12.285 1.00 0.97 H new ATOM 0 HG SER A 107 -15.107 -5.977 10.151 1.00 1.35 H new ATOM 1707 N PRO A 108 -11.090 -8.316 10.759 1.00 0.82 N ATOM 1708 CA PRO A 108 -10.324 -9.070 9.762 1.00 0.82 C ATOM 1709 C PRO A 108 -10.779 -8.720 8.354 1.00 0.73 C ATOM 1710 O PRO A 108 -11.962 -8.826 8.033 1.00 0.81 O ATOM 1711 CB PRO A 108 -10.659 -10.524 10.087 1.00 0.91 C ATOM 1712 CG PRO A 108 -10.952 -10.525 11.546 1.00 1.07 C ATOM 1713 CD PRO A 108 -11.558 -9.182 11.860 1.00 0.92 C ATOM 0 HA PRO A 108 -9.256 -8.857 9.796 1.00 0.82 H new ATOM 0 HB2 PRO A 108 -11.516 -10.872 9.510 1.00 0.91 H new ATOM 0 HB3 PRO A 108 -9.826 -11.185 9.850 1.00 0.91 H new ATOM 0 HG2 PRO A 108 -11.639 -11.331 11.803 1.00 1.07 H new ATOM 0 HG3 PRO A 108 -10.042 -10.685 12.125 1.00 1.07 H new ATOM 0 HD2 PRO A 108 -12.646 -9.233 11.894 1.00 0.92 H new ATOM 0 HD3 PRO A 108 -11.226 -8.811 12.829 1.00 0.92 H new ATOM 1721 N ARG A 109 -9.857 -8.294 7.516 1.00 0.61 N ATOM 1722 CA ARG A 109 -10.254 -7.701 6.256 1.00 0.56 C ATOM 1723 C ARG A 109 -9.642 -8.461 5.093 1.00 0.52 C ATOM 1724 O ARG A 109 -8.660 -9.171 5.266 1.00 0.66 O ATOM 1725 CB ARG A 109 -9.850 -6.222 6.258 1.00 0.64 C ATOM 1726 CG ARG A 109 -10.541 -5.378 5.211 1.00 1.05 C ATOM 1727 CD ARG A 109 -11.014 -4.064 5.816 1.00 0.88 C ATOM 1728 NE ARG A 109 -11.725 -4.276 7.085 1.00 1.89 N ATOM 1729 CZ ARG A 109 -12.148 -3.302 7.897 1.00 2.34 C ATOM 1730 NH1 ARG A 109 -11.898 -2.027 7.611 1.00 2.06 N ATOM 1731 NH2 ARG A 109 -12.803 -3.609 9.013 1.00 3.45 N ATOM 0 H ARG A 109 -8.851 -8.345 7.678 1.00 0.61 H new ATOM 0 HA ARG A 109 -11.335 -7.764 6.135 1.00 0.56 H new ATOM 0 HB2 ARG A 109 -10.062 -5.803 7.241 1.00 0.64 H new ATOM 0 HB3 ARG A 109 -8.773 -6.153 6.108 1.00 0.64 H new ATOM 0 HG2 ARG A 109 -9.858 -5.180 4.385 1.00 1.05 H new ATOM 0 HG3 ARG A 109 -11.390 -5.922 4.799 1.00 1.05 H new ATOM 0 HD2 ARG A 109 -10.158 -3.411 5.983 1.00 0.88 H new ATOM 0 HD3 ARG A 109 -11.671 -3.554 5.111 1.00 0.88 H new ATOM 0 HE ARG A 109 -11.909 -5.239 7.367 1.00 1.89 H new ATOM 0 HH11 ARG A 109 -11.380 -1.786 6.766 1.00 2.06 H new ATOM 0 HH12 ARG A 109 -12.225 -1.290 8.236 1.00 2.06 H new ATOM 0 HH21 ARG A 109 -12.981 -4.586 9.247 1.00 3.45 H new ATOM 0 HH22 ARG A 109 -13.127 -2.868 9.635 1.00 3.45 H new ATOM 1745 N ASP A 110 -10.251 -8.353 3.925 1.00 0.46 N ATOM 1746 CA ASP A 110 -9.705 -8.977 2.730 1.00 0.47 C ATOM 1747 C ASP A 110 -9.567 -7.946 1.639 1.00 0.44 C ATOM 1748 O ASP A 110 -10.492 -7.198 1.375 1.00 0.64 O ATOM 1749 CB ASP A 110 -10.589 -10.126 2.240 1.00 0.62 C ATOM 1750 CG ASP A 110 -10.125 -10.682 0.902 1.00 0.83 C ATOM 1751 OD1 ASP A 110 -8.901 -10.848 0.712 1.00 1.37 O ATOM 1752 OD2 ASP A 110 -10.985 -10.960 0.041 1.00 1.32 O ATOM 0 H ASP A 110 -11.121 -7.841 3.778 1.00 0.46 H new ATOM 0 HA ASP A 110 -8.727 -9.388 2.982 1.00 0.47 H new ATOM 0 HB2 ASP A 110 -10.588 -10.924 2.982 1.00 0.62 H new ATOM 0 HB3 ASP A 110 -11.617 -9.777 2.149 1.00 0.62 H new ATOM 1757 N PHE A 111 -8.416 -7.895 1.018 1.00 0.39 N ATOM 1758 CA PHE A 111 -8.189 -6.948 -0.050 1.00 0.43 C ATOM 1759 C PHE A 111 -8.337 -7.624 -1.396 1.00 0.41 C ATOM 1760 O PHE A 111 -7.803 -8.707 -1.621 1.00 0.54 O ATOM 1761 CB PHE A 111 -6.798 -6.317 0.048 1.00 0.61 C ATOM 1762 CG PHE A 111 -6.620 -5.396 1.220 1.00 0.94 C ATOM 1763 CD1 PHE A 111 -7.603 -4.478 1.546 1.00 1.36 C ATOM 1764 CD2 PHE A 111 -5.477 -5.454 1.998 1.00 1.60 C ATOM 1765 CE1 PHE A 111 -7.448 -3.632 2.627 1.00 2.01 C ATOM 1766 CE2 PHE A 111 -5.314 -4.611 3.080 1.00 2.30 C ATOM 1767 CZ PHE A 111 -6.279 -3.686 3.381 1.00 2.41 C ATOM 0 H PHE A 111 -7.620 -8.497 1.231 1.00 0.39 H new ATOM 0 HA PHE A 111 -8.936 -6.160 0.049 1.00 0.43 H new ATOM 0 HB2 PHE A 111 -6.055 -7.112 0.109 1.00 0.61 H new ATOM 0 HB3 PHE A 111 -6.598 -5.763 -0.869 1.00 0.61 H new ATOM 0 HD1 PHE A 111 -8.501 -4.422 0.949 1.00 1.36 H new ATOM 0 HD2 PHE A 111 -4.703 -6.167 1.756 1.00 1.60 H new ATOM 0 HE1 PHE A 111 -8.229 -2.933 2.886 1.00 2.01 H new ATOM 0 HE2 PHE A 111 -4.425 -4.681 3.689 1.00 2.30 H new ATOM 0 HZ PHE A 111 -6.133 -3.000 4.202 1.00 2.41 H new ATOM 1777 N ILE A 112 -9.092 -6.988 -2.266 1.00 0.34 N ATOM 1778 CA ILE A 112 -9.146 -7.366 -3.666 1.00 0.33 C ATOM 1779 C ILE A 112 -8.933 -6.124 -4.497 1.00 0.35 C ATOM 1780 O ILE A 112 -9.871 -5.552 -5.067 1.00 0.43 O ATOM 1781 CB ILE A 112 -10.463 -8.040 -4.110 1.00 0.34 C ATOM 1782 CG1 ILE A 112 -10.790 -9.259 -3.249 1.00 0.40 C ATOM 1783 CG2 ILE A 112 -10.323 -8.457 -5.554 1.00 0.36 C ATOM 1784 CD1 ILE A 112 -9.871 -10.430 -3.506 1.00 0.42 C ATOM 0 H ILE A 112 -9.686 -6.195 -2.025 1.00 0.34 H new ATOM 0 HA ILE A 112 -8.367 -8.114 -3.813 1.00 0.33 H new ATOM 0 HB ILE A 112 -11.280 -7.328 -3.992 1.00 0.34 H new ATOM 0 HG12 ILE A 112 -10.728 -8.980 -2.197 1.00 0.40 H new ATOM 0 HG13 ILE A 112 -11.819 -9.564 -3.438 1.00 0.40 H new ATOM 0 HG21 ILE A 112 -11.245 -8.935 -5.886 1.00 0.36 H new ATOM 0 HG22 ILE A 112 -10.129 -7.578 -6.169 1.00 0.36 H new ATOM 0 HG23 ILE A 112 -9.495 -9.159 -5.651 1.00 0.36 H new ATOM 0 HD11 ILE A 112 -10.155 -11.264 -2.864 1.00 0.42 H new ATOM 0 HD12 ILE A 112 -9.951 -10.733 -4.550 1.00 0.42 H new ATOM 0 HD13 ILE A 112 -8.843 -10.140 -3.290 1.00 0.42 H new ATOM 1796 N ASP A 113 -7.703 -5.686 -4.529 1.00 0.36 N ATOM 1797 CA ASP A 113 -7.367 -4.488 -5.259 1.00 0.42 C ATOM 1798 C ASP A 113 -6.628 -4.863 -6.520 1.00 0.33 C ATOM 1799 O ASP A 113 -5.823 -5.795 -6.525 1.00 0.35 O ATOM 1800 CB ASP A 113 -6.517 -3.547 -4.405 1.00 0.58 C ATOM 1801 CG ASP A 113 -7.220 -3.105 -3.136 1.00 1.23 C ATOM 1802 OD1 ASP A 113 -8.217 -2.360 -3.239 1.00 1.86 O ATOM 1803 OD2 ASP A 113 -6.778 -3.502 -2.036 1.00 1.32 O ATOM 0 H ASP A 113 -6.917 -6.137 -4.060 1.00 0.36 H new ATOM 0 HA ASP A 113 -8.287 -3.964 -5.518 1.00 0.42 H new ATOM 0 HB2 ASP A 113 -5.584 -4.046 -4.143 1.00 0.58 H new ATOM 0 HB3 ASP A 113 -6.254 -2.668 -4.994 1.00 0.58 H new ATOM 1808 N LEU A 114 -6.928 -4.175 -7.596 1.00 0.28 N ATOM 1809 CA LEU A 114 -6.189 -4.378 -8.826 1.00 0.23 C ATOM 1810 C LEU A 114 -4.916 -3.589 -8.771 1.00 0.22 C ATOM 1811 O LEU A 114 -4.934 -2.388 -8.624 1.00 0.24 O ATOM 1812 CB LEU A 114 -6.992 -3.974 -10.039 1.00 0.23 C ATOM 1813 CG LEU A 114 -6.165 -3.746 -11.303 1.00 0.22 C ATOM 1814 CD1 LEU A 114 -5.915 -5.061 -12.021 1.00 0.21 C ATOM 1815 CD2 LEU A 114 -6.847 -2.735 -12.216 1.00 0.26 C ATOM 0 H LEU A 114 -7.670 -3.477 -7.649 1.00 0.28 H new ATOM 0 HA LEU A 114 -5.970 -5.442 -8.919 1.00 0.23 H new ATOM 0 HB2 LEU A 114 -7.734 -4.746 -10.241 1.00 0.23 H new ATOM 0 HB3 LEU A 114 -7.538 -3.059 -9.808 1.00 0.23 H new ATOM 0 HG LEU A 114 -5.198 -3.334 -11.016 1.00 0.22 H new ATOM 0 HD11 LEU A 114 -5.324 -4.879 -12.919 1.00 0.21 H new ATOM 0 HD12 LEU A 114 -5.373 -5.738 -11.361 1.00 0.21 H new ATOM 0 HD13 LEU A 114 -6.868 -5.511 -12.299 1.00 0.21 H new ATOM 0 HD21 LEU A 114 -6.242 -2.587 -13.111 1.00 0.26 H new ATOM 0 HD22 LEU A 114 -7.831 -3.108 -12.501 1.00 0.26 H new ATOM 0 HD23 LEU A 114 -6.957 -1.786 -11.691 1.00 0.26 H new ATOM 1827 N VAL A 115 -3.821 -4.263 -8.919 1.00 0.23 N ATOM 1828 CA VAL A 115 -2.552 -3.677 -8.610 1.00 0.23 C ATOM 1829 C VAL A 115 -1.667 -3.582 -9.820 1.00 0.23 C ATOM 1830 O VAL A 115 -1.392 -4.566 -10.514 1.00 0.24 O ATOM 1831 CB VAL A 115 -1.892 -4.452 -7.482 1.00 0.24 C ATOM 1832 CG1 VAL A 115 -2.421 -5.875 -7.481 1.00 0.25 C ATOM 1833 CG2 VAL A 115 -0.375 -4.398 -7.565 1.00 0.26 C ATOM 0 H VAL A 115 -3.778 -5.226 -9.254 1.00 0.23 H new ATOM 0 HA VAL A 115 -2.716 -2.652 -8.276 1.00 0.23 H new ATOM 0 HB VAL A 115 -2.149 -3.984 -6.531 1.00 0.24 H new ATOM 0 HG11 VAL A 115 -1.951 -6.437 -6.674 1.00 0.25 H new ATOM 0 HG12 VAL A 115 -3.501 -5.862 -7.334 1.00 0.25 H new ATOM 0 HG13 VAL A 115 -2.191 -6.349 -8.435 1.00 0.25 H new ATOM 0 HG21 VAL A 115 0.055 -4.965 -6.739 1.00 0.26 H new ATOM 0 HG22 VAL A 115 -0.047 -4.829 -8.511 1.00 0.26 H new ATOM 0 HG23 VAL A 115 -0.044 -3.361 -7.504 1.00 0.26 H new ATOM 1843 N TYR A 116 -1.246 -2.372 -10.064 1.00 0.25 N ATOM 1844 CA TYR A 116 -0.460 -2.055 -11.216 1.00 0.25 C ATOM 1845 C TYR A 116 0.938 -1.638 -10.793 1.00 0.26 C ATOM 1846 O TYR A 116 1.108 -0.662 -10.060 1.00 0.28 O ATOM 1847 CB TYR A 116 -1.157 -0.930 -12.001 1.00 0.31 C ATOM 1848 CG TYR A 116 -2.062 -0.123 -11.102 1.00 0.83 C ATOM 1849 CD1 TYR A 116 -3.288 -0.635 -10.687 1.00 1.31 C ATOM 1850 CD2 TYR A 116 -1.667 1.099 -10.607 1.00 1.10 C ATOM 1851 CE1 TYR A 116 -4.086 0.050 -9.811 1.00 1.87 C ATOM 1852 CE2 TYR A 116 -2.459 1.783 -9.718 1.00 1.65 C ATOM 1853 CZ TYR A 116 -3.664 1.252 -9.319 1.00 1.99 C ATOM 1854 OH TYR A 116 -4.444 1.929 -8.410 1.00 2.57 O ATOM 0 H TYR A 116 -1.443 -1.573 -9.461 1.00 0.25 H new ATOM 0 HA TYR A 116 -0.368 -2.931 -11.857 1.00 0.25 H new ATOM 0 HB2 TYR A 116 -0.408 -0.277 -12.450 1.00 0.31 H new ATOM 0 HB3 TYR A 116 -1.738 -1.358 -12.818 1.00 0.31 H new ATOM 0 HD1 TYR A 116 -3.616 -1.592 -11.064 1.00 1.31 H new ATOM 0 HD2 TYR A 116 -0.725 1.524 -10.921 1.00 1.10 H new ATOM 0 HE1 TYR A 116 -5.041 -0.356 -9.512 1.00 1.87 H new ATOM 0 HE2 TYR A 116 -2.136 2.738 -9.332 1.00 1.65 H new ATOM 0 HH TYR A 116 -4.241 2.887 -8.454 1.00 2.57 H new ATOM 1864 N ILE A 117 1.928 -2.393 -11.230 1.00 0.30 N ATOM 1865 CA ILE A 117 3.308 -2.080 -10.917 1.00 0.33 C ATOM 1866 C ILE A 117 3.990 -1.501 -12.147 1.00 0.38 C ATOM 1867 O ILE A 117 4.390 -2.228 -13.057 1.00 0.46 O ATOM 1868 CB ILE A 117 4.086 -3.316 -10.401 1.00 0.42 C ATOM 1869 CG1 ILE A 117 3.454 -3.847 -9.108 1.00 0.45 C ATOM 1870 CG2 ILE A 117 5.552 -2.983 -10.170 1.00 0.52 C ATOM 1871 CD1 ILE A 117 2.574 -5.057 -9.318 1.00 0.89 C ATOM 0 H ILE A 117 1.802 -3.227 -11.803 1.00 0.30 H new ATOM 0 HA ILE A 117 3.310 -1.344 -10.113 1.00 0.33 H new ATOM 0 HB ILE A 117 4.029 -4.091 -11.165 1.00 0.42 H new ATOM 0 HG12 ILE A 117 4.246 -4.102 -8.404 1.00 0.45 H new ATOM 0 HG13 ILE A 117 2.864 -3.054 -8.650 1.00 0.45 H new ATOM 0 HG21 ILE A 117 6.074 -3.869 -9.808 1.00 0.52 H new ATOM 0 HG22 ILE A 117 6.002 -2.654 -11.107 1.00 0.52 H new ATOM 0 HG23 ILE A 117 5.632 -2.187 -9.430 1.00 0.52 H new ATOM 0 HD11 ILE A 117 2.161 -5.377 -8.361 1.00 0.89 H new ATOM 0 HD12 ILE A 117 1.760 -4.802 -9.997 1.00 0.89 H new ATOM 0 HD13 ILE A 117 3.165 -5.866 -9.748 1.00 0.89 H new ATOM 1883 N LYS A 118 4.091 -0.183 -12.177 1.00 0.42 N ATOM 1884 CA LYS A 118 4.706 0.506 -13.296 1.00 0.52 C ATOM 1885 C LYS A 118 6.063 1.048 -12.881 1.00 0.39 C ATOM 1886 O LYS A 118 6.247 1.492 -11.748 1.00 0.34 O ATOM 1887 CB LYS A 118 3.808 1.642 -13.800 1.00 0.70 C ATOM 1888 CG LYS A 118 4.380 2.363 -15.013 1.00 0.93 C ATOM 1889 CD LYS A 118 3.452 3.450 -15.537 1.00 0.94 C ATOM 1890 CE LYS A 118 2.126 2.878 -16.008 1.00 0.72 C ATOM 1891 NZ LYS A 118 1.330 3.873 -16.776 1.00 1.20 N ATOM 0 H LYS A 118 3.754 0.432 -11.436 1.00 0.42 H new ATOM 0 HA LYS A 118 4.839 -0.204 -14.112 1.00 0.52 H new ATOM 0 HB2 LYS A 118 2.828 1.237 -14.054 1.00 0.70 H new ATOM 0 HB3 LYS A 118 3.657 2.361 -12.995 1.00 0.70 H new ATOM 0 HG2 LYS A 118 5.340 2.806 -14.749 1.00 0.93 H new ATOM 0 HG3 LYS A 118 4.570 1.639 -15.805 1.00 0.93 H new ATOM 0 HD2 LYS A 118 3.273 4.185 -14.752 1.00 0.94 H new ATOM 0 HD3 LYS A 118 3.935 3.975 -16.361 1.00 0.94 H new ATOM 0 HE2 LYS A 118 2.310 2.003 -16.631 1.00 0.72 H new ATOM 0 HE3 LYS A 118 1.550 2.541 -15.146 1.00 0.72 H new ATOM 0 HZ1 LYS A 118 0.345 3.861 -16.443 1.00 1.20 H new ATOM 0 HZ2 LYS A 118 1.731 4.822 -16.635 1.00 1.20 H new ATOM 0 HZ3 LYS A 118 1.357 3.633 -17.788 1.00 1.20 H new ATOM 1905 N ARG A 119 7.006 1.026 -13.799 1.00 0.52 N ATOM 1906 CA ARG A 119 8.345 1.440 -13.508 1.00 0.52 C ATOM 1907 C ARG A 119 8.696 2.581 -14.433 1.00 0.49 C ATOM 1908 O ARG A 119 9.082 2.380 -15.587 1.00 0.58 O ATOM 1909 CB ARG A 119 9.280 0.233 -13.670 1.00 0.79 C ATOM 1910 CG ARG A 119 10.733 0.472 -13.301 1.00 1.00 C ATOM 1911 CD ARG A 119 11.500 1.102 -14.445 1.00 1.25 C ATOM 1912 NE ARG A 119 12.943 0.969 -14.273 1.00 1.68 N ATOM 1913 CZ ARG A 119 13.834 1.183 -15.236 1.00 2.18 C ATOM 1914 NH1 ARG A 119 13.434 1.481 -16.465 1.00 2.57 N ATOM 1915 NH2 ARG A 119 15.124 1.067 -14.973 1.00 2.80 N ATOM 0 H ARG A 119 6.858 0.721 -14.761 1.00 0.52 H new ATOM 0 HA ARG A 119 8.450 1.796 -12.483 1.00 0.52 H new ATOM 0 HB2 ARG A 119 8.898 -0.584 -13.057 1.00 0.79 H new ATOM 0 HB3 ARG A 119 9.238 -0.100 -14.707 1.00 0.79 H new ATOM 0 HG2 ARG A 119 10.785 1.120 -12.426 1.00 1.00 H new ATOM 0 HG3 ARG A 119 11.200 -0.474 -13.026 1.00 1.00 H new ATOM 0 HD2 ARG A 119 11.202 0.634 -15.383 1.00 1.25 H new ATOM 0 HD3 ARG A 119 11.239 2.158 -14.519 1.00 1.25 H new ATOM 0 HE ARG A 119 13.290 0.694 -13.354 1.00 1.68 H new ATOM 0 HH11 ARG A 119 12.438 1.547 -16.675 1.00 2.57 H new ATOM 0 HH12 ARG A 119 14.122 1.644 -17.200 1.00 2.57 H new ATOM 0 HH21 ARG A 119 15.432 0.814 -14.034 1.00 2.80 H new ATOM 0 HH22 ARG A 119 15.811 1.230 -15.709 1.00 2.80 H new ATOM 1929 N TYR A 120 8.488 3.783 -13.936 1.00 0.43 N ATOM 1930 CA TYR A 120 8.922 4.959 -14.639 1.00 0.46 C ATOM 1931 C TYR A 120 10.429 4.894 -14.710 1.00 0.50 C ATOM 1932 O TYR A 120 11.086 4.862 -13.675 1.00 0.48 O ATOM 1933 CB TYR A 120 8.459 6.234 -13.931 1.00 0.46 C ATOM 1934 CG TYR A 120 6.957 6.405 -13.896 1.00 0.51 C ATOM 1935 CD1 TYR A 120 6.190 5.789 -12.916 1.00 0.58 C ATOM 1936 CD2 TYR A 120 6.307 7.187 -14.842 1.00 0.76 C ATOM 1937 CE1 TYR A 120 4.820 5.946 -12.881 1.00 0.66 C ATOM 1938 CE2 TYR A 120 4.934 7.351 -14.812 1.00 0.83 C ATOM 1939 CZ TYR A 120 4.197 6.727 -13.826 1.00 0.70 C ATOM 1940 OH TYR A 120 2.831 6.886 -13.783 1.00 0.81 O ATOM 0 H TYR A 120 8.021 3.965 -13.048 1.00 0.43 H new ATOM 0 HA TYR A 120 8.488 4.990 -15.638 1.00 0.46 H new ATOM 0 HB2 TYR A 120 8.838 6.228 -12.909 1.00 0.46 H new ATOM 0 HB3 TYR A 120 8.901 7.096 -14.430 1.00 0.46 H new ATOM 0 HD1 TYR A 120 6.674 5.177 -12.169 1.00 0.58 H new ATOM 0 HD2 TYR A 120 6.883 7.675 -15.614 1.00 0.76 H new ATOM 0 HE1 TYR A 120 4.238 5.457 -12.114 1.00 0.66 H new ATOM 0 HE2 TYR A 120 4.443 7.962 -15.554 1.00 0.83 H new ATOM 0 HH TYR A 120 2.523 6.823 -12.855 1.00 0.81 H new ATOM 1950 N GLU A 121 10.930 4.789 -15.933 1.00 0.61 N ATOM 1951 CA GLU A 121 12.344 4.523 -16.217 1.00 0.73 C ATOM 1952 C GLU A 121 13.291 5.420 -15.424 1.00 0.70 C ATOM 1953 O GLU A 121 13.749 6.456 -15.905 1.00 0.79 O ATOM 1954 CB GLU A 121 12.605 4.668 -17.717 1.00 0.96 C ATOM 1955 CG GLU A 121 11.617 3.882 -18.561 1.00 1.06 C ATOM 1956 CD GLU A 121 12.077 3.686 -19.988 1.00 1.69 C ATOM 1957 OE1 GLU A 121 11.943 4.623 -20.800 1.00 2.27 O ATOM 1958 OE2 GLU A 121 12.566 2.581 -20.305 1.00 2.28 O ATOM 0 H GLU A 121 10.360 4.887 -16.774 1.00 0.61 H new ATOM 0 HA GLU A 121 12.549 3.500 -15.900 1.00 0.73 H new ATOM 0 HB2 GLU A 121 12.553 5.722 -17.991 1.00 0.96 H new ATOM 0 HB3 GLU A 121 13.617 4.330 -17.940 1.00 0.96 H new ATOM 0 HG2 GLU A 121 11.452 2.907 -18.102 1.00 1.06 H new ATOM 0 HG3 GLU A 121 10.658 4.400 -18.563 1.00 1.06 H new ATOM 1965 N GLY A 122 13.585 4.984 -14.207 1.00 0.67 N ATOM 1966 CA GLY A 122 14.465 5.715 -13.321 1.00 0.71 C ATOM 1967 C GLY A 122 13.785 6.903 -12.681 1.00 0.66 C ATOM 1968 O GLY A 122 14.429 7.896 -12.343 1.00 0.76 O ATOM 0 H GLY A 122 13.220 4.117 -13.812 1.00 0.67 H new ATOM 0 HA2 GLY A 122 14.829 5.045 -12.542 1.00 0.71 H new ATOM 0 HA3 GLY A 122 15.336 6.057 -13.880 1.00 0.71 H new ATOM 1972 N ASN A 123 12.481 6.789 -12.504 1.00 0.57 N ATOM 1973 CA ASN A 123 11.699 7.836 -11.874 1.00 0.54 C ATOM 1974 C ASN A 123 10.912 7.274 -10.699 1.00 0.45 C ATOM 1975 O ASN A 123 10.995 7.802 -9.590 1.00 0.45 O ATOM 1976 CB ASN A 123 10.732 8.491 -12.866 1.00 0.60 C ATOM 1977 CG ASN A 123 11.399 8.946 -14.151 1.00 1.01 C ATOM 1978 OD1 ASN A 123 11.369 8.238 -15.158 1.00 1.65 O ATOM 1979 ND2 ASN A 123 12.018 10.116 -14.121 1.00 1.61 N ATOM 0 H ASN A 123 11.938 5.974 -12.791 1.00 0.57 H new ATOM 0 HA ASN A 123 12.396 8.595 -11.520 1.00 0.54 H new ATOM 0 HB2 ASN A 123 9.939 7.784 -13.108 1.00 0.60 H new ATOM 0 HB3 ASN A 123 10.259 9.349 -12.388 1.00 0.60 H new ATOM 0 HD21 ASN A 123 12.494 10.462 -14.954 1.00 1.61 H new ATOM 0 HD22 ASN A 123 12.018 10.671 -13.265 1.00 1.61 H new ATOM 1986 N MET A 124 10.176 6.180 -10.931 1.00 0.39 N ATOM 1987 CA MET A 124 9.279 5.632 -9.904 1.00 0.34 C ATOM 1988 C MET A 124 8.998 4.157 -10.147 1.00 0.33 C ATOM 1989 O MET A 124 8.660 3.756 -11.255 1.00 0.40 O ATOM 1990 CB MET A 124 7.923 6.372 -9.844 1.00 0.34 C ATOM 1991 CG MET A 124 7.972 7.760 -9.221 1.00 0.56 C ATOM 1992 SD MET A 124 8.158 9.073 -10.444 1.00 1.09 S ATOM 1993 CE MET A 124 8.347 10.505 -9.383 1.00 1.12 C ATOM 0 H MET A 124 10.182 5.662 -11.809 1.00 0.39 H new ATOM 0 HA MET A 124 9.801 5.769 -8.957 1.00 0.34 H new ATOM 0 HB2 MET A 124 7.529 6.459 -10.857 1.00 0.34 H new ATOM 0 HB3 MET A 124 7.218 5.762 -9.279 1.00 0.34 H new ATOM 0 HG2 MET A 124 7.059 7.929 -8.650 1.00 0.56 H new ATOM 0 HG3 MET A 124 8.802 7.807 -8.516 1.00 0.56 H new ATOM 0 HE1 MET A 124 7.508 11.184 -9.536 1.00 1.12 H new ATOM 0 HE2 MET A 124 8.370 10.185 -8.341 1.00 1.12 H new ATOM 0 HE3 MET A 124 9.278 11.017 -9.626 1.00 1.12 H new ATOM 2003 N ASN A 125 9.127 3.361 -9.099 1.00 0.34 N ATOM 2004 CA ASN A 125 8.716 1.972 -9.128 1.00 0.37 C ATOM 2005 C ASN A 125 7.433 1.856 -8.326 1.00 0.32 C ATOM 2006 O ASN A 125 7.444 1.479 -7.155 1.00 0.37 O ATOM 2007 CB ASN A 125 9.794 1.055 -8.531 1.00 0.50 C ATOM 2008 CG ASN A 125 11.138 1.188 -9.224 1.00 0.95 C ATOM 2009 OD1 ASN A 125 11.221 1.551 -10.396 1.00 1.58 O ATOM 2010 ND2 ASN A 125 12.207 0.877 -8.505 1.00 1.62 N ATOM 0 H ASN A 125 9.519 3.661 -8.207 1.00 0.34 H new ATOM 0 HA ASN A 125 8.562 1.658 -10.160 1.00 0.37 H new ATOM 0 HB2 ASN A 125 9.913 1.285 -7.472 1.00 0.50 H new ATOM 0 HB3 ASN A 125 9.459 0.020 -8.596 1.00 0.50 H new ATOM 0 HD21 ASN A 125 13.136 0.935 -8.921 1.00 1.62 H new ATOM 0 HD22 ASN A 125 12.100 0.580 -7.535 1.00 1.62 H new ATOM 2017 N ILE A 126 6.331 2.230 -8.951 1.00 0.26 N ATOM 2018 CA ILE A 126 5.056 2.314 -8.267 1.00 0.23 C ATOM 2019 C ILE A 126 4.292 1.008 -8.318 1.00 0.27 C ATOM 2020 O ILE A 126 4.044 0.453 -9.388 1.00 0.30 O ATOM 2021 CB ILE A 126 4.153 3.428 -8.863 1.00 0.22 C ATOM 2022 CG1 ILE A 126 2.666 3.116 -8.602 1.00 0.24 C ATOM 2023 CG2 ILE A 126 4.427 3.606 -10.346 1.00 0.24 C ATOM 2024 CD1 ILE A 126 1.691 4.049 -9.295 1.00 0.26 C ATOM 0 H ILE A 126 6.295 2.482 -9.939 1.00 0.26 H new ATOM 0 HA ILE A 126 5.297 2.551 -7.231 1.00 0.23 H new ATOM 0 HB ILE A 126 4.391 4.369 -8.367 1.00 0.22 H new ATOM 0 HG12 ILE A 126 2.461 2.095 -8.923 1.00 0.24 H new ATOM 0 HG13 ILE A 126 2.484 3.155 -7.528 1.00 0.24 H new ATOM 0 HG21 ILE A 126 3.784 4.391 -10.743 1.00 0.24 H new ATOM 0 HG22 ILE A 126 5.471 3.884 -10.492 1.00 0.24 H new ATOM 0 HG23 ILE A 126 4.223 2.671 -10.868 1.00 0.24 H new ATOM 0 HD11 ILE A 126 0.670 3.753 -9.054 1.00 0.26 H new ATOM 0 HD12 ILE A 126 1.862 5.071 -8.956 1.00 0.26 H new ATOM 0 HD13 ILE A 126 1.839 3.994 -10.373 1.00 0.26 H new ATOM 2036 N ILE A 127 3.931 0.524 -7.149 1.00 0.30 N ATOM 2037 CA ILE A 127 2.870 -0.444 -7.041 1.00 0.34 C ATOM 2038 C ILE A 127 1.668 0.261 -6.448 1.00 0.38 C ATOM 2039 O ILE A 127 1.724 0.818 -5.355 1.00 0.45 O ATOM 2040 CB ILE A 127 3.245 -1.701 -6.207 1.00 0.41 C ATOM 2041 CG1 ILE A 127 2.242 -1.939 -5.062 1.00 0.42 C ATOM 2042 CG2 ILE A 127 4.661 -1.579 -5.664 1.00 0.50 C ATOM 2043 CD1 ILE A 127 2.226 -3.362 -4.547 1.00 0.59 C ATOM 0 H ILE A 127 4.359 0.788 -6.262 1.00 0.30 H new ATOM 0 HA ILE A 127 2.655 -0.828 -8.038 1.00 0.34 H new ATOM 0 HB ILE A 127 3.200 -2.565 -6.870 1.00 0.41 H new ATOM 0 HG12 ILE A 127 2.481 -1.267 -4.237 1.00 0.42 H new ATOM 0 HG13 ILE A 127 1.242 -1.677 -5.408 1.00 0.42 H new ATOM 0 HG21 ILE A 127 4.906 -2.468 -5.083 1.00 0.50 H new ATOM 0 HG22 ILE A 127 5.362 -1.483 -6.493 1.00 0.50 H new ATOM 0 HG23 ILE A 127 4.731 -0.698 -5.026 1.00 0.50 H new ATOM 0 HD11 ILE A 127 1.495 -3.450 -3.743 1.00 0.59 H new ATOM 0 HD12 ILE A 127 1.957 -4.039 -5.357 1.00 0.59 H new ATOM 0 HD13 ILE A 127 3.214 -3.623 -4.169 1.00 0.59 H new ATOM 2055 N SER A 128 0.614 0.326 -7.207 1.00 0.39 N ATOM 2056 CA SER A 128 -0.616 0.869 -6.712 1.00 0.50 C ATOM 2057 C SER A 128 -1.720 -0.128 -6.979 1.00 0.55 C ATOM 2058 O SER A 128 -1.531 -1.083 -7.722 1.00 1.00 O ATOM 2059 CB SER A 128 -0.874 2.241 -7.324 1.00 0.68 C ATOM 2060 OG SER A 128 -2.062 2.826 -6.820 1.00 1.18 O ATOM 0 H SER A 128 0.582 0.008 -8.176 1.00 0.39 H new ATOM 0 HA SER A 128 -0.568 1.031 -5.635 1.00 0.50 H new ATOM 0 HB2 SER A 128 -0.029 2.897 -7.115 1.00 0.68 H new ATOM 0 HB3 SER A 128 -0.946 2.148 -8.408 1.00 0.68 H new ATOM 0 HG SER A 128 -2.827 2.523 -7.352 1.00 1.18 H new ATOM 2066 N SER A 129 -2.849 0.087 -6.370 1.00 0.30 N ATOM 2067 CA SER A 129 -3.907 -0.889 -6.340 1.00 0.31 C ATOM 2068 C SER A 129 -5.256 -0.183 -6.381 1.00 0.31 C ATOM 2069 O SER A 129 -5.452 0.841 -5.728 1.00 0.43 O ATOM 2070 CB SER A 129 -3.755 -1.754 -5.088 1.00 0.40 C ATOM 2071 OG SER A 129 -2.553 -2.504 -5.142 1.00 1.24 O ATOM 0 H SER A 129 -3.067 0.952 -5.875 1.00 0.30 H new ATOM 0 HA SER A 129 -3.849 -1.540 -7.212 1.00 0.31 H new ATOM 0 HB2 SER A 129 -3.756 -1.122 -4.200 1.00 0.40 H new ATOM 0 HB3 SER A 129 -4.607 -2.428 -5.000 1.00 0.40 H new ATOM 0 HG SER A 129 -2.472 -3.050 -4.332 1.00 1.24 H new ATOM 2077 N LYS A 130 -6.175 -0.722 -7.164 1.00 0.27 N ATOM 2078 CA LYS A 130 -7.423 -0.065 -7.425 1.00 0.32 C ATOM 2079 C LYS A 130 -8.514 -1.010 -7.032 1.00 0.37 C ATOM 2080 O LYS A 130 -8.629 -2.090 -7.609 1.00 0.41 O ATOM 2081 CB LYS A 130 -7.529 0.308 -8.907 1.00 0.40 C ATOM 2082 CG LYS A 130 -8.761 1.095 -9.266 1.00 0.90 C ATOM 2083 CD LYS A 130 -8.894 1.199 -10.771 1.00 0.80 C ATOM 2084 CE LYS A 130 -9.781 2.354 -11.145 1.00 1.42 C ATOM 2085 NZ LYS A 130 -11.206 2.118 -10.794 1.00 2.26 N ATOM 0 H LYS A 130 -6.068 -1.623 -7.630 1.00 0.27 H new ATOM 0 HA LYS A 130 -7.501 0.860 -6.854 1.00 0.32 H new ATOM 0 HB2 LYS A 130 -6.649 0.887 -9.187 1.00 0.40 H new ATOM 0 HB3 LYS A 130 -7.511 -0.606 -9.501 1.00 0.40 H new ATOM 0 HG2 LYS A 130 -9.644 0.613 -8.848 1.00 0.90 H new ATOM 0 HG3 LYS A 130 -8.705 2.092 -8.829 1.00 0.90 H new ATOM 0 HD2 LYS A 130 -7.910 1.329 -11.220 1.00 0.80 H new ATOM 0 HD3 LYS A 130 -9.307 0.272 -11.170 1.00 0.80 H new ATOM 0 HE2 LYS A 130 -9.431 3.254 -10.640 1.00 1.42 H new ATOM 0 HE3 LYS A 130 -9.700 2.537 -12.216 1.00 1.42 H new ATOM 0 HZ1 LYS A 130 -11.774 2.944 -11.073 1.00 2.26 H new ATOM 0 HZ2 LYS A 130 -11.552 1.275 -11.295 1.00 2.26 H new ATOM 0 HZ3 LYS A 130 -11.291 1.970 -9.768 1.00 2.26 H new ATOM 2099 N SER A 131 -9.280 -0.616 -6.044 1.00 0.41 N ATOM 2100 CA SER A 131 -10.272 -1.469 -5.462 1.00 0.44 C ATOM 2101 C SER A 131 -11.243 -1.895 -6.522 1.00 0.41 C ATOM 2102 O SER A 131 -12.119 -1.132 -6.936 1.00 0.47 O ATOM 2103 CB SER A 131 -10.962 -0.727 -4.347 1.00 0.56 C ATOM 2104 OG SER A 131 -11.335 0.578 -4.764 1.00 1.39 O ATOM 0 H SER A 131 -9.228 0.312 -5.623 1.00 0.41 H new ATOM 0 HA SER A 131 -9.812 -2.365 -5.046 1.00 0.44 H new ATOM 0 HB2 SER A 131 -11.847 -1.279 -4.030 1.00 0.56 H new ATOM 0 HB3 SER A 131 -10.300 -0.662 -3.483 1.00 0.56 H new ATOM 0 HG SER A 131 -12.311 0.664 -4.737 1.00 1.39 H new ATOM 2110 N VAL A 132 -11.057 -3.100 -6.986 1.00 0.35 N ATOM 2111 CA VAL A 132 -11.723 -3.526 -8.161 1.00 0.36 C ATOM 2112 C VAL A 132 -12.663 -4.668 -7.836 1.00 0.37 C ATOM 2113 O VAL A 132 -12.309 -5.624 -7.141 1.00 0.46 O ATOM 2114 CB VAL A 132 -10.701 -3.886 -9.265 1.00 0.40 C ATOM 2115 CG1 VAL A 132 -10.817 -5.305 -9.751 1.00 0.88 C ATOM 2116 CG2 VAL A 132 -10.816 -2.925 -10.431 1.00 1.05 C ATOM 0 H VAL A 132 -10.446 -3.797 -6.560 1.00 0.35 H new ATOM 0 HA VAL A 132 -12.330 -2.710 -8.554 1.00 0.36 H new ATOM 0 HB VAL A 132 -9.716 -3.794 -8.807 1.00 0.40 H new ATOM 0 HG11 VAL A 132 -10.070 -5.487 -10.524 1.00 0.88 H new ATOM 0 HG12 VAL A 132 -10.652 -5.989 -8.919 1.00 0.88 H new ATOM 0 HG13 VAL A 132 -11.813 -5.468 -10.163 1.00 0.88 H new ATOM 0 HG21 VAL A 132 -10.089 -3.194 -11.197 1.00 1.05 H new ATOM 0 HG22 VAL A 132 -11.821 -2.979 -10.849 1.00 1.05 H new ATOM 0 HG23 VAL A 132 -10.620 -1.910 -10.086 1.00 1.05 H new ATOM 2126 N ASP A 133 -13.865 -4.540 -8.322 1.00 0.39 N ATOM 2127 CA ASP A 133 -14.911 -5.489 -8.024 1.00 0.43 C ATOM 2128 C ASP A 133 -15.008 -6.462 -9.176 1.00 0.43 C ATOM 2129 O ASP A 133 -15.865 -6.333 -10.052 1.00 0.59 O ATOM 2130 CB ASP A 133 -16.223 -4.745 -7.803 1.00 0.54 C ATOM 2131 CG ASP A 133 -17.316 -5.613 -7.201 1.00 1.27 C ATOM 2132 OD1 ASP A 133 -17.749 -6.577 -7.868 1.00 1.39 O ATOM 2133 OD2 ASP A 133 -17.755 -5.335 -6.062 1.00 2.17 O ATOM 0 H ASP A 133 -14.152 -3.777 -8.936 1.00 0.39 H new ATOM 0 HA ASP A 133 -14.689 -6.044 -7.112 1.00 0.43 H new ATOM 0 HB2 ASP A 133 -16.043 -3.893 -7.147 1.00 0.54 H new ATOM 0 HB3 ASP A 133 -16.570 -4.345 -8.756 1.00 0.54 H new ATOM 2138 N PHE A 134 -14.090 -7.410 -9.195 1.00 0.35 N ATOM 2139 CA PHE A 134 -13.954 -8.300 -10.329 1.00 0.40 C ATOM 2140 C PHE A 134 -14.408 -9.715 -9.951 1.00 0.46 C ATOM 2141 O PHE A 134 -14.432 -10.079 -8.771 1.00 0.50 O ATOM 2142 CB PHE A 134 -12.501 -8.258 -10.835 1.00 0.39 C ATOM 2143 CG PHE A 134 -11.560 -9.140 -10.080 1.00 0.38 C ATOM 2144 CD1 PHE A 134 -11.639 -9.241 -8.707 1.00 0.36 C ATOM 2145 CD2 PHE A 134 -10.611 -9.885 -10.751 1.00 0.51 C ATOM 2146 CE1 PHE A 134 -10.804 -10.073 -8.016 1.00 0.42 C ATOM 2147 CE2 PHE A 134 -9.759 -10.715 -10.057 1.00 0.53 C ATOM 2148 CZ PHE A 134 -9.865 -10.810 -8.686 1.00 0.45 C ATOM 0 H PHE A 134 -13.429 -7.582 -8.438 1.00 0.35 H new ATOM 0 HA PHE A 134 -14.599 -7.973 -11.145 1.00 0.40 H new ATOM 0 HB2 PHE A 134 -12.486 -8.547 -11.886 1.00 0.39 H new ATOM 0 HB3 PHE A 134 -12.140 -7.231 -10.781 1.00 0.39 H new ATOM 0 HD1 PHE A 134 -12.371 -8.655 -8.171 1.00 0.36 H new ATOM 0 HD2 PHE A 134 -10.536 -9.817 -11.826 1.00 0.51 H new ATOM 0 HE1 PHE A 134 -10.885 -10.149 -6.942 1.00 0.42 H new ATOM 0 HE2 PHE A 134 -9.011 -11.289 -10.584 1.00 0.53 H new ATOM 0 HZ PHE A 134 -9.206 -11.468 -8.139 1.00 0.45 H new ATOM 2158 N PRO A 135 -14.796 -10.520 -10.952 1.00 0.61 N ATOM 2159 CA PRO A 135 -15.462 -11.804 -10.725 1.00 0.75 C ATOM 2160 C PRO A 135 -14.553 -12.935 -10.263 1.00 0.92 C ATOM 2161 O PRO A 135 -15.044 -13.944 -9.755 1.00 1.13 O ATOM 2162 CB PRO A 135 -16.010 -12.168 -12.089 1.00 1.28 C ATOM 2163 CG PRO A 135 -15.128 -11.475 -13.068 1.00 1.19 C ATOM 2164 CD PRO A 135 -14.640 -10.226 -12.391 1.00 0.76 C ATOM 0 HA PRO A 135 -16.195 -11.691 -9.926 1.00 0.75 H new ATOM 0 HB2 PRO A 135 -15.996 -13.247 -12.243 1.00 1.28 H new ATOM 0 HB3 PRO A 135 -17.045 -11.844 -12.195 1.00 1.28 H new ATOM 0 HG2 PRO A 135 -14.292 -12.112 -13.356 1.00 1.19 H new ATOM 0 HG3 PRO A 135 -15.674 -11.234 -13.980 1.00 1.19 H new ATOM 0 HD2 PRO A 135 -13.602 -10.013 -12.645 1.00 0.76 H new ATOM 0 HD3 PRO A 135 -15.226 -9.356 -12.687 1.00 0.76 H new ATOM 2172 N GLU A 136 -13.244 -12.781 -10.428 1.00 1.10 N ATOM 2173 CA GLU A 136 -12.321 -13.865 -10.188 1.00 1.59 C ATOM 2174 C GLU A 136 -12.261 -14.177 -8.706 1.00 1.68 C ATOM 2175 O GLU A 136 -11.804 -15.246 -8.294 1.00 2.17 O ATOM 2176 CB GLU A 136 -10.958 -13.463 -10.711 1.00 1.78 C ATOM 2177 CG GLU A 136 -9.935 -14.564 -10.728 1.00 2.38 C ATOM 2178 CD GLU A 136 -10.275 -15.656 -11.713 1.00 3.03 C ATOM 2179 OE1 GLU A 136 -10.977 -16.613 -11.327 1.00 3.30 O ATOM 2180 OE2 GLU A 136 -9.838 -15.563 -12.880 1.00 3.50 O ATOM 0 H GLU A 136 -12.805 -11.911 -10.728 1.00 1.10 H new ATOM 0 HA GLU A 136 -12.654 -14.765 -10.705 1.00 1.59 H new ATOM 0 HB2 GLU A 136 -11.073 -13.079 -11.724 1.00 1.78 H new ATOM 0 HB3 GLU A 136 -10.578 -12.644 -10.101 1.00 1.78 H new ATOM 0 HG2 GLU A 136 -8.960 -14.145 -10.977 1.00 2.38 H new ATOM 0 HG3 GLU A 136 -9.852 -14.993 -9.730 1.00 2.38 H new ATOM 2187 N TYR A 137 -12.749 -13.242 -7.907 1.00 1.38 N ATOM 2188 CA TYR A 137 -12.751 -13.430 -6.469 1.00 1.79 C ATOM 2189 C TYR A 137 -13.654 -12.430 -5.763 1.00 1.42 C ATOM 2190 O TYR A 137 -13.312 -11.255 -5.630 1.00 1.58 O ATOM 2191 CB TYR A 137 -11.337 -13.308 -5.925 1.00 2.49 C ATOM 2192 CG TYR A 137 -11.079 -14.202 -4.731 1.00 3.43 C ATOM 2193 CD1 TYR A 137 -11.629 -13.908 -3.490 1.00 3.49 C ATOM 2194 CD2 TYR A 137 -10.275 -15.330 -4.840 1.00 4.47 C ATOM 2195 CE1 TYR A 137 -11.389 -14.713 -2.393 1.00 4.37 C ATOM 2196 CE2 TYR A 137 -10.028 -16.140 -3.747 1.00 5.35 C ATOM 2197 CZ TYR A 137 -10.622 -15.864 -2.546 1.00 5.22 C ATOM 2198 OH TYR A 137 -10.348 -16.631 -1.433 1.00 6.12 O ATOM 0 H TYR A 137 -13.144 -12.357 -8.226 1.00 1.38 H new ATOM 0 HA TYR A 137 -13.140 -14.429 -6.274 1.00 1.79 H new ATOM 0 HB2 TYR A 137 -10.628 -13.554 -6.715 1.00 2.49 H new ATOM 0 HB3 TYR A 137 -11.152 -12.272 -5.642 1.00 2.49 H new ATOM 0 HD1 TYR A 137 -12.255 -13.035 -3.381 1.00 3.49 H new ATOM 0 HD2 TYR A 137 -9.836 -15.578 -5.795 1.00 4.47 H new ATOM 0 HE1 TYR A 137 -11.793 -14.451 -1.426 1.00 4.37 H new ATOM 0 HE2 TYR A 137 -9.367 -16.989 -3.841 1.00 5.35 H new ATOM 0 HH TYR A 137 -9.804 -17.403 -1.694 1.00 6.12 H new ATOM 2208 N PRO A 138 -14.827 -12.889 -5.315 1.00 1.33 N ATOM 2209 CA PRO A 138 -15.711 -12.118 -4.460 1.00 1.10 C ATOM 2210 C PRO A 138 -15.371 -12.340 -2.986 1.00 0.99 C ATOM 2211 O PRO A 138 -14.965 -13.437 -2.597 1.00 0.99 O ATOM 2212 CB PRO A 138 -17.103 -12.685 -4.781 1.00 0.97 C ATOM 2213 CG PRO A 138 -16.879 -13.945 -5.571 1.00 1.56 C ATOM 2214 CD PRO A 138 -15.395 -14.203 -5.605 1.00 1.77 C ATOM 0 HA PRO A 138 -15.635 -11.044 -4.631 1.00 1.10 H new ATOM 0 HB2 PRO A 138 -17.657 -12.894 -3.866 1.00 0.97 H new ATOM 0 HB3 PRO A 138 -17.692 -11.968 -5.353 1.00 0.97 H new ATOM 0 HG2 PRO A 138 -17.403 -14.783 -5.112 1.00 1.56 H new ATOM 0 HG3 PRO A 138 -17.272 -13.838 -6.582 1.00 1.56 H new ATOM 0 HD2 PRO A 138 -15.097 -14.944 -4.863 1.00 1.77 H new ATOM 0 HD3 PRO A 138 -15.072 -14.577 -6.577 1.00 1.77 H new ATOM 2222 N PRO A 139 -15.516 -11.302 -2.148 1.00 0.96 N ATOM 2223 CA PRO A 139 -15.252 -11.410 -0.710 1.00 0.91 C ATOM 2224 C PRO A 139 -16.305 -12.257 -0.004 1.00 1.00 C ATOM 2225 O PRO A 139 -17.109 -12.934 -0.647 1.00 1.25 O ATOM 2226 CB PRO A 139 -15.311 -9.965 -0.219 1.00 0.82 C ATOM 2227 CG PRO A 139 -16.152 -9.248 -1.217 1.00 0.89 C ATOM 2228 CD PRO A 139 -15.950 -9.951 -2.533 1.00 1.06 C ATOM 0 HA PRO A 139 -14.299 -11.897 -0.504 1.00 0.91 H new ATOM 0 HB2 PRO A 139 -15.747 -9.905 0.778 1.00 0.82 H new ATOM 0 HB3 PRO A 139 -14.314 -9.529 -0.158 1.00 0.82 H new ATOM 0 HG2 PRO A 139 -17.202 -9.267 -0.924 1.00 0.89 H new ATOM 0 HG3 PRO A 139 -15.860 -8.200 -1.288 1.00 0.89 H new ATOM 0 HD2 PRO A 139 -16.870 -9.978 -3.117 1.00 1.06 H new ATOM 0 HD3 PRO A 139 -15.199 -9.449 -3.143 1.00 1.06 H new ATOM 2236 N SER A 140 -16.325 -12.202 1.313 1.00 0.90 N ATOM 2237 CA SER A 140 -17.198 -13.051 2.087 1.00 1.01 C ATOM 2238 C SER A 140 -17.765 -12.252 3.243 1.00 1.01 C ATOM 2239 O SER A 140 -17.606 -11.037 3.284 1.00 1.13 O ATOM 2240 CB SER A 140 -16.420 -14.270 2.585 1.00 1.09 C ATOM 2241 OG SER A 140 -15.816 -14.964 1.502 1.00 1.60 O ATOM 0 H SER A 140 -15.743 -11.575 1.868 1.00 0.90 H new ATOM 0 HA SER A 140 -18.024 -13.407 1.471 1.00 1.01 H new ATOM 0 HB2 SER A 140 -15.653 -13.953 3.292 1.00 1.09 H new ATOM 0 HB3 SER A 140 -17.091 -14.940 3.122 1.00 1.09 H new ATOM 0 HG SER A 140 -15.323 -15.739 1.844 1.00 1.60 H new ATOM 2247 N SER A 141 -18.419 -12.906 4.177 1.00 1.07 N ATOM 2248 CA SER A 141 -18.982 -12.189 5.299 1.00 1.19 C ATOM 2249 C SER A 141 -17.895 -11.879 6.328 1.00 1.07 C ATOM 2250 O SER A 141 -17.874 -10.801 6.922 1.00 1.22 O ATOM 2251 CB SER A 141 -20.122 -12.995 5.923 1.00 1.47 C ATOM 2252 OG SER A 141 -20.919 -12.195 6.781 1.00 1.97 O ATOM 0 H SER A 141 -18.572 -13.914 4.184 1.00 1.07 H new ATOM 0 HA SER A 141 -19.392 -11.242 4.947 1.00 1.19 H new ATOM 0 HB2 SER A 141 -20.745 -13.415 5.134 1.00 1.47 H new ATOM 0 HB3 SER A 141 -19.710 -13.833 6.485 1.00 1.47 H new ATOM 0 HG SER A 141 -21.639 -12.740 7.162 1.00 1.97 H new ATOM 2258 N ASN A 142 -16.977 -12.822 6.513 1.00 0.97 N ATOM 2259 CA ASN A 142 -15.873 -12.643 7.452 1.00 0.95 C ATOM 2260 C ASN A 142 -14.742 -11.862 6.798 1.00 0.86 C ATOM 2261 O ASN A 142 -13.867 -11.327 7.474 1.00 1.07 O ATOM 2262 CB ASN A 142 -15.355 -14.002 7.918 1.00 1.01 C ATOM 2263 CG ASN A 142 -14.516 -13.923 9.183 1.00 1.37 C ATOM 2264 OD1 ASN A 142 -14.855 -13.001 10.072 1.00 2.18 O flip ATOM 2265 ND2 ASN A 142 -13.581 -14.702 9.368 1.00 1.73 N flip ATOM 0 H ASN A 142 -16.975 -13.718 6.026 1.00 0.97 H new ATOM 0 HA ASN A 142 -16.239 -12.083 8.313 1.00 0.95 H new ATOM 0 HB2 ASN A 142 -16.202 -14.666 8.093 1.00 1.01 H new ATOM 0 HB3 ASN A 142 -14.759 -14.448 7.122 1.00 1.01 H new ATOM 0 HD21 ASN A 142 -13.350 -15.399 8.660 1.00 1.73 H new ATOM 0 HD22 ASN A 142 -13.037 -14.651 10.229 1.00 1.73 H new ATOM 2272 N TYR A 143 -14.768 -11.807 5.474 1.00 0.71 N ATOM 2273 CA TYR A 143 -13.746 -11.099 4.715 1.00 0.67 C ATOM 2274 C TYR A 143 -14.354 -9.913 3.995 1.00 0.61 C ATOM 2275 O TYR A 143 -15.072 -10.076 3.009 1.00 0.67 O ATOM 2276 CB TYR A 143 -13.082 -12.032 3.699 1.00 0.76 C ATOM 2277 CG TYR A 143 -12.418 -13.242 4.319 1.00 0.84 C ATOM 2278 CD1 TYR A 143 -11.197 -13.134 4.973 1.00 0.91 C ATOM 2279 CD2 TYR A 143 -13.016 -14.492 4.248 1.00 0.97 C ATOM 2280 CE1 TYR A 143 -10.590 -14.240 5.538 1.00 1.02 C ATOM 2281 CE2 TYR A 143 -12.416 -15.603 4.811 1.00 1.09 C ATOM 2282 CZ TYR A 143 -11.190 -15.460 5.463 1.00 1.09 C ATOM 2283 OH TYR A 143 -10.605 -16.577 6.014 1.00 1.23 O ATOM 0 H TYR A 143 -15.489 -12.246 4.901 1.00 0.71 H new ATOM 0 HA TYR A 143 -12.989 -10.745 5.414 1.00 0.67 H new ATOM 0 HB2 TYR A 143 -13.833 -12.368 2.985 1.00 0.76 H new ATOM 0 HB3 TYR A 143 -12.337 -11.469 3.137 1.00 0.76 H new ATOM 0 HD1 TYR A 143 -10.714 -12.170 5.041 1.00 0.91 H new ATOM 0 HD2 TYR A 143 -13.966 -14.599 3.745 1.00 0.97 H new ATOM 0 HE1 TYR A 143 -9.639 -14.136 6.039 1.00 1.02 H new ATOM 0 HE2 TYR A 143 -12.891 -16.571 4.747 1.00 1.09 H new ATOM 0 HH TYR A 143 -11.180 -17.356 5.862 1.00 1.23 H new ATOM 2293 N ILE A 144 -14.041 -8.722 4.471 1.00 0.56 N ATOM 2294 CA ILE A 144 -14.587 -7.514 3.894 1.00 0.53 C ATOM 2295 C ILE A 144 -13.612 -6.938 2.878 1.00 0.46 C ATOM 2296 O ILE A 144 -12.561 -6.411 3.250 1.00 0.47 O ATOM 2297 CB ILE A 144 -14.915 -6.465 4.986 1.00 0.61 C ATOM 2298 CG1 ILE A 144 -15.107 -5.086 4.372 1.00 0.62 C ATOM 2299 CG2 ILE A 144 -13.840 -6.412 6.052 1.00 0.68 C ATOM 2300 CD1 ILE A 144 -16.480 -4.873 3.777 1.00 0.82 C ATOM 0 H ILE A 144 -13.410 -8.568 5.257 1.00 0.56 H new ATOM 0 HA ILE A 144 -15.519 -7.768 3.390 1.00 0.53 H new ATOM 0 HB ILE A 144 -15.846 -6.774 5.460 1.00 0.61 H new ATOM 0 HG12 ILE A 144 -14.930 -4.330 5.137 1.00 0.62 H new ATOM 0 HG13 ILE A 144 -14.357 -4.936 3.596 1.00 0.62 H new ATOM 0 HG21 ILE A 144 -14.106 -5.665 6.800 1.00 0.68 H new ATOM 0 HG22 ILE A 144 -13.752 -7.388 6.529 1.00 0.68 H new ATOM 0 HG23 ILE A 144 -12.887 -6.145 5.595 1.00 0.68 H new ATOM 0 HD11 ILE A 144 -16.543 -3.869 3.358 1.00 0.82 H new ATOM 0 HD12 ILE A 144 -16.653 -5.606 2.989 1.00 0.82 H new ATOM 0 HD13 ILE A 144 -17.235 -4.990 4.554 1.00 0.82 H new ATOM 2312 N ARG A 145 -13.953 -7.077 1.599 1.00 0.43 N ATOM 2313 CA ARG A 145 -13.131 -6.543 0.508 1.00 0.41 C ATOM 2314 C ARG A 145 -12.777 -5.081 0.751 1.00 0.45 C ATOM 2315 O ARG A 145 -13.623 -4.192 0.631 1.00 0.48 O ATOM 2316 CB ARG A 145 -13.832 -6.680 -0.849 1.00 0.44 C ATOM 2317 CG ARG A 145 -13.050 -6.036 -1.991 1.00 0.81 C ATOM 2318 CD ARG A 145 -13.823 -6.052 -3.301 1.00 2.08 C ATOM 2319 NE ARG A 145 -13.762 -7.346 -3.984 1.00 2.70 N ATOM 2320 CZ ARG A 145 -14.667 -7.750 -4.876 1.00 3.63 C ATOM 2321 NH1 ARG A 145 -15.772 -7.044 -5.060 1.00 4.14 N ATOM 2322 NH2 ARG A 145 -14.490 -8.876 -5.554 1.00 4.42 N ATOM 0 H ARG A 145 -14.797 -7.557 1.288 1.00 0.43 H new ATOM 0 HA ARG A 145 -12.215 -7.133 0.486 1.00 0.41 H new ATOM 0 HB2 ARG A 145 -13.982 -7.737 -1.069 1.00 0.44 H new ATOM 0 HB3 ARG A 145 -14.820 -6.223 -0.789 1.00 0.44 H new ATOM 0 HG2 ARG A 145 -12.808 -5.007 -1.727 1.00 0.81 H new ATOM 0 HG3 ARG A 145 -12.105 -6.562 -2.123 1.00 0.81 H new ATOM 0 HD2 ARG A 145 -14.865 -5.799 -3.105 1.00 2.08 H new ATOM 0 HD3 ARG A 145 -13.426 -5.280 -3.960 1.00 2.08 H new ATOM 0 HE ARG A 145 -12.986 -7.971 -3.766 1.00 2.70 H new ATOM 0 HH11 ARG A 145 -15.929 -6.193 -4.520 1.00 4.14 H new ATOM 0 HH12 ARG A 145 -16.466 -7.351 -5.742 1.00 4.14 H new ATOM 0 HH21 ARG A 145 -13.656 -9.441 -5.395 1.00 4.42 H new ATOM 0 HH22 ARG A 145 -15.188 -9.177 -6.234 1.00 4.42 H new ATOM 2336 N GLY A 146 -11.530 -4.856 1.129 1.00 0.62 N ATOM 2337 CA GLY A 146 -11.026 -3.524 1.319 1.00 0.79 C ATOM 2338 C GLY A 146 -11.010 -2.740 0.031 1.00 0.57 C ATOM 2339 O GLY A 146 -10.276 -3.068 -0.891 1.00 0.62 O ATOM 0 H GLY A 146 -10.849 -5.593 1.310 1.00 0.62 H new ATOM 0 HA2 GLY A 146 -11.642 -3.004 2.053 1.00 0.79 H new ATOM 0 HA3 GLY A 146 -10.016 -3.573 1.727 1.00 0.79 H new ATOM 2343 N TYR A 147 -11.846 -1.724 -0.037 1.00 0.58 N ATOM 2344 CA TYR A 147 -11.897 -0.872 -1.201 1.00 0.56 C ATOM 2345 C TYR A 147 -10.850 0.223 -1.086 1.00 0.54 C ATOM 2346 O TYR A 147 -11.079 1.256 -0.461 1.00 0.67 O ATOM 2347 CB TYR A 147 -13.301 -0.281 -1.364 1.00 0.86 C ATOM 2348 CG TYR A 147 -13.900 -0.472 -2.739 1.00 1.69 C ATOM 2349 CD1 TYR A 147 -14.255 -1.738 -3.195 1.00 2.19 C ATOM 2350 CD2 TYR A 147 -14.112 0.611 -3.583 1.00 2.23 C ATOM 2351 CE1 TYR A 147 -14.800 -1.916 -4.454 1.00 3.07 C ATOM 2352 CE2 TYR A 147 -14.657 0.441 -4.840 1.00 3.13 C ATOM 2353 CZ TYR A 147 -15.000 -0.823 -5.271 1.00 3.51 C ATOM 2354 OH TYR A 147 -15.536 -0.992 -6.529 1.00 4.44 O ATOM 0 H TYR A 147 -12.500 -1.470 0.704 1.00 0.58 H new ATOM 0 HA TYR A 147 -11.677 -1.463 -2.090 1.00 0.56 H new ATOM 0 HB2 TYR A 147 -13.962 -0.736 -0.626 1.00 0.86 H new ATOM 0 HB3 TYR A 147 -13.262 0.786 -1.142 1.00 0.86 H new ATOM 0 HD1 TYR A 147 -14.103 -2.595 -2.556 1.00 2.19 H new ATOM 0 HD2 TYR A 147 -13.846 1.603 -3.250 1.00 2.23 H new ATOM 0 HE1 TYR A 147 -15.067 -2.905 -4.795 1.00 3.07 H new ATOM 0 HE2 TYR A 147 -14.814 1.294 -5.483 1.00 3.13 H new ATOM 0 HH TYR A 147 -15.611 -0.121 -6.972 1.00 4.44 H new ATOM 2364 N ASN A 148 -9.685 -0.042 -1.645 1.00 0.46 N ATOM 2365 CA ASN A 148 -8.623 0.941 -1.710 1.00 0.47 C ATOM 2366 C ASN A 148 -8.764 1.768 -2.983 1.00 0.45 C ATOM 2367 O ASN A 148 -8.126 1.489 -3.998 1.00 0.58 O ATOM 2368 CB ASN A 148 -7.262 0.245 -1.649 1.00 0.49 C ATOM 2369 CG ASN A 148 -6.952 -0.286 -0.261 1.00 1.08 C ATOM 2370 OD1 ASN A 148 -7.186 0.392 0.746 1.00 1.45 O ATOM 2371 ND2 ASN A 148 -6.481 -1.522 -0.186 1.00 1.62 N ATOM 0 H ASN A 148 -9.449 -0.941 -2.065 1.00 0.46 H new ATOM 0 HA ASN A 148 -8.696 1.614 -0.856 1.00 0.47 H new ATOM 0 HB2 ASN A 148 -7.244 -0.578 -2.363 1.00 0.49 H new ATOM 0 HB3 ASN A 148 -6.483 0.946 -1.950 1.00 0.49 H new ATOM 0 HD21 ASN A 148 -6.300 -1.944 0.725 1.00 1.62 H new ATOM 0 HD22 ASN A 148 -6.300 -2.051 -1.039 1.00 1.62 H new ATOM 2378 N HIS A 149 -9.647 2.765 -2.916 1.00 0.43 N ATOM 2379 CA HIS A 149 -9.908 3.676 -4.032 1.00 0.45 C ATOM 2380 C HIS A 149 -8.591 4.185 -4.613 1.00 0.40 C ATOM 2381 O HIS A 149 -7.840 4.845 -3.902 1.00 0.69 O ATOM 2382 CB HIS A 149 -10.718 4.864 -3.528 1.00 0.60 C ATOM 2383 CG HIS A 149 -11.917 5.207 -4.361 1.00 1.08 C ATOM 2384 ND1 HIS A 149 -13.197 5.254 -3.848 1.00 1.67 N ATOM 2385 CD2 HIS A 149 -12.026 5.569 -5.661 1.00 1.88 C ATOM 2386 CE1 HIS A 149 -14.034 5.627 -4.792 1.00 2.14 C ATOM 2387 NE2 HIS A 149 -13.351 5.826 -5.903 1.00 2.32 N ATOM 0 H HIS A 149 -10.203 2.964 -2.084 1.00 0.43 H new ATOM 0 HA HIS A 149 -10.461 3.143 -4.806 1.00 0.45 H new ATOM 0 HB2 HIS A 149 -11.048 4.655 -2.510 1.00 0.60 H new ATOM 0 HB3 HIS A 149 -10.066 5.736 -3.479 1.00 0.60 H new ATOM 0 HD1 HIS A 149 -13.454 5.034 -2.886 1.00 1.67 H new ATOM 0 HD2 HIS A 149 -11.219 5.642 -6.375 1.00 1.88 H new ATOM 0 HE1 HIS A 149 -15.101 5.750 -4.677 1.00 2.14 H new ATOM 2396 N PRO A 150 -8.379 3.968 -5.940 1.00 0.32 N ATOM 2397 CA PRO A 150 -7.090 4.012 -6.642 1.00 0.32 C ATOM 2398 C PRO A 150 -5.945 4.655 -5.878 1.00 0.36 C ATOM 2399 O PRO A 150 -5.430 5.707 -6.257 1.00 0.47 O ATOM 2400 CB PRO A 150 -7.443 4.816 -7.887 1.00 0.41 C ATOM 2401 CG PRO A 150 -8.922 4.603 -8.090 1.00 0.53 C ATOM 2402 CD PRO A 150 -9.419 3.755 -6.934 1.00 0.46 C ATOM 0 HA PRO A 150 -6.702 3.009 -6.820 1.00 0.32 H new ATOM 0 HB2 PRO A 150 -7.212 5.873 -7.752 1.00 0.41 H new ATOM 0 HB3 PRO A 150 -6.874 4.474 -8.751 1.00 0.41 H new ATOM 0 HG2 PRO A 150 -9.447 5.558 -8.120 1.00 0.53 H new ATOM 0 HG3 PRO A 150 -9.112 4.105 -9.041 1.00 0.53 H new ATOM 0 HD2 PRO A 150 -10.397 4.081 -6.579 1.00 0.46 H new ATOM 0 HD3 PRO A 150 -9.513 2.704 -7.209 1.00 0.46 H new ATOM 2410 N CYS A 151 -5.535 3.985 -4.823 1.00 0.38 N ATOM 2411 CA CYS A 151 -4.458 4.452 -3.982 1.00 0.48 C ATOM 2412 C CYS A 151 -3.382 3.388 -3.900 1.00 0.43 C ATOM 2413 O CYS A 151 -3.677 2.194 -3.938 1.00 0.77 O ATOM 2414 CB CYS A 151 -4.990 4.797 -2.593 1.00 0.84 C ATOM 2415 SG CYS A 151 -5.843 3.441 -1.755 1.00 1.58 S ATOM 0 H CYS A 151 -5.941 3.098 -4.525 1.00 0.38 H new ATOM 0 HA CYS A 151 -4.024 5.355 -4.413 1.00 0.48 H new ATOM 0 HB2 CYS A 151 -4.157 5.125 -1.971 1.00 0.84 H new ATOM 0 HB3 CYS A 151 -5.675 5.641 -2.680 1.00 0.84 H new ATOM 0 HG CYS A 151 -5.571 3.477 -0.484 1.00 1.58 H new ATOM 2421 N GLY A 152 -2.132 3.797 -3.813 1.00 0.34 N ATOM 2422 CA GLY A 152 -1.077 2.822 -3.831 1.00 0.39 C ATOM 2423 C GLY A 152 0.154 3.241 -3.083 1.00 0.36 C ATOM 2424 O GLY A 152 0.075 3.803 -1.992 1.00 0.43 O ATOM 0 H GLY A 152 -1.834 4.769 -3.732 1.00 0.34 H new ATOM 0 HA2 GLY A 152 -1.450 1.891 -3.404 1.00 0.39 H new ATOM 0 HA3 GLY A 152 -0.807 2.613 -4.866 1.00 0.39 H new ATOM 2428 N PHE A 153 1.287 3.028 -3.716 1.00 0.32 N ATOM 2429 CA PHE A 153 2.546 2.919 -3.010 1.00 0.31 C ATOM 2430 C PHE A 153 3.676 3.134 -3.998 1.00 0.30 C ATOM 2431 O PHE A 153 4.262 2.178 -4.509 1.00 0.38 O ATOM 2432 CB PHE A 153 2.624 1.520 -2.380 1.00 0.36 C ATOM 2433 CG PHE A 153 3.698 1.326 -1.344 1.00 0.38 C ATOM 2434 CD1 PHE A 153 4.981 0.965 -1.722 1.00 0.49 C ATOM 2435 CD2 PHE A 153 3.434 1.540 -0.001 1.00 0.54 C ATOM 2436 CE1 PHE A 153 5.980 0.819 -0.780 1.00 0.55 C ATOM 2437 CE2 PHE A 153 4.429 1.391 0.945 1.00 0.60 C ATOM 2438 CZ PHE A 153 5.656 0.906 0.581 1.00 0.52 C ATOM 0 H PHE A 153 1.362 2.926 -4.728 1.00 0.32 H new ATOM 0 HA PHE A 153 2.626 3.668 -2.222 1.00 0.31 H new ATOM 0 HB2 PHE A 153 1.660 1.294 -1.923 1.00 0.36 H new ATOM 0 HB3 PHE A 153 2.778 0.792 -3.176 1.00 0.36 H new ATOM 0 HD1 PHE A 153 5.202 0.796 -2.765 1.00 0.49 H new ATOM 0 HD2 PHE A 153 2.440 1.826 0.309 1.00 0.54 H new ATOM 0 HE1 PHE A 153 6.999 0.640 -1.088 1.00 0.55 H new ATOM 0 HE2 PHE A 153 4.239 1.658 1.974 1.00 0.60 H new ATOM 0 HZ PHE A 153 6.366 0.594 1.333 1.00 0.52 H new ATOM 2448 N VAL A 154 3.961 4.382 -4.299 1.00 0.25 N ATOM 2449 CA VAL A 154 4.943 4.679 -5.312 1.00 0.25 C ATOM 2450 C VAL A 154 6.319 4.835 -4.691 1.00 0.24 C ATOM 2451 O VAL A 154 6.489 5.466 -3.649 1.00 0.31 O ATOM 2452 CB VAL A 154 4.597 5.932 -6.144 1.00 0.25 C ATOM 2453 CG1 VAL A 154 3.202 5.845 -6.722 1.00 0.27 C ATOM 2454 CG2 VAL A 154 4.757 7.213 -5.355 1.00 0.26 C ATOM 0 H VAL A 154 3.531 5.197 -3.861 1.00 0.25 H new ATOM 0 HA VAL A 154 4.941 3.831 -5.997 1.00 0.25 H new ATOM 0 HB VAL A 154 5.314 5.959 -6.965 1.00 0.25 H new ATOM 0 HG11 VAL A 154 2.992 6.744 -7.302 1.00 0.27 H new ATOM 0 HG12 VAL A 154 3.130 4.971 -7.369 1.00 0.27 H new ATOM 0 HG13 VAL A 154 2.477 5.758 -5.912 1.00 0.27 H new ATOM 0 HG21 VAL A 154 4.501 8.064 -5.987 1.00 0.26 H new ATOM 0 HG22 VAL A 154 4.095 7.192 -4.489 1.00 0.26 H new ATOM 0 HG23 VAL A 154 5.790 7.307 -5.020 1.00 0.26 H new ATOM 2464 N CYS A 155 7.291 4.235 -5.329 1.00 0.21 N ATOM 2465 CA CYS A 155 8.655 4.298 -4.863 1.00 0.23 C ATOM 2466 C CYS A 155 9.477 5.104 -5.844 1.00 0.27 C ATOM 2467 O CYS A 155 9.507 4.797 -7.023 1.00 0.42 O ATOM 2468 CB CYS A 155 9.215 2.890 -4.733 1.00 0.27 C ATOM 2469 SG CYS A 155 10.989 2.827 -4.432 1.00 1.55 S ATOM 0 H CYS A 155 7.162 3.691 -6.182 1.00 0.21 H new ATOM 0 HA CYS A 155 8.692 4.779 -3.886 1.00 0.23 H new ATOM 0 HB2 CYS A 155 8.701 2.380 -3.918 1.00 0.27 H new ATOM 0 HB3 CYS A 155 8.993 2.337 -5.645 1.00 0.27 H new ATOM 0 HG CYS A 155 11.322 3.771 -3.602 1.00 1.55 H new ATOM 2475 N SER A 156 10.133 6.139 -5.377 1.00 0.25 N ATOM 2476 CA SER A 156 10.838 7.025 -6.285 1.00 0.29 C ATOM 2477 C SER A 156 12.343 6.996 -6.044 1.00 0.30 C ATOM 2478 O SER A 156 12.818 7.443 -5.002 1.00 0.29 O ATOM 2479 CB SER A 156 10.300 8.447 -6.140 1.00 0.32 C ATOM 2480 OG SER A 156 8.881 8.447 -6.113 1.00 1.06 O ATOM 0 H SER A 156 10.196 6.390 -4.390 1.00 0.25 H new ATOM 0 HA SER A 156 10.665 6.676 -7.303 1.00 0.29 H new ATOM 0 HB2 SER A 156 10.686 8.895 -5.225 1.00 0.32 H new ATOM 0 HB3 SER A 156 10.653 9.061 -6.969 1.00 0.32 H new ATOM 0 HG SER A 156 8.556 9.367 -6.018 1.00 1.06 H new ATOM 2486 N PRO A 157 13.106 6.423 -6.986 1.00 0.36 N ATOM 2487 CA PRO A 157 14.559 6.544 -7.003 1.00 0.39 C ATOM 2488 C PRO A 157 14.981 8.003 -6.845 1.00 0.40 C ATOM 2489 O PRO A 157 14.659 8.842 -7.689 1.00 0.49 O ATOM 2490 CB PRO A 157 14.961 6.017 -8.393 1.00 0.51 C ATOM 2491 CG PRO A 157 13.690 5.701 -9.113 1.00 0.56 C ATOM 2492 CD PRO A 157 12.619 5.569 -8.072 1.00 0.45 C ATOM 0 HA PRO A 157 15.034 5.996 -6.189 1.00 0.39 H new ATOM 0 HB2 PRO A 157 15.540 6.763 -8.938 1.00 0.51 H new ATOM 0 HB3 PRO A 157 15.587 5.129 -8.305 1.00 0.51 H new ATOM 0 HG2 PRO A 157 13.443 6.490 -9.823 1.00 0.56 H new ATOM 0 HG3 PRO A 157 13.789 4.778 -9.684 1.00 0.56 H new ATOM 0 HD2 PRO A 157 11.651 5.903 -8.445 1.00 0.45 H new ATOM 0 HD3 PRO A 157 12.496 4.535 -7.748 1.00 0.45 H new ATOM 2500 N MET A 158 15.685 8.308 -5.760 1.00 0.37 N ATOM 2501 CA MET A 158 16.008 9.702 -5.446 1.00 0.43 C ATOM 2502 C MET A 158 17.222 10.180 -6.207 1.00 0.48 C ATOM 2503 O MET A 158 17.700 9.515 -7.128 1.00 0.49 O ATOM 2504 CB MET A 158 16.293 9.909 -3.964 1.00 0.43 C ATOM 2505 CG MET A 158 15.068 9.935 -3.078 1.00 0.50 C ATOM 2506 SD MET A 158 13.862 11.193 -3.559 1.00 0.95 S ATOM 2507 CE MET A 158 14.820 12.694 -3.365 1.00 1.16 C ATOM 0 H MET A 158 16.039 7.624 -5.091 1.00 0.37 H new ATOM 0 HA MET A 158 15.127 10.273 -5.737 1.00 0.43 H new ATOM 0 HB2 MET A 158 16.954 9.113 -3.621 1.00 0.43 H new ATOM 0 HB3 MET A 158 16.833 10.848 -3.840 1.00 0.43 H new ATOM 0 HG2 MET A 158 14.590 8.956 -3.102 1.00 0.50 H new ATOM 0 HG3 MET A 158 15.377 10.113 -2.048 1.00 0.50 H new ATOM 0 HE1 MET A 158 14.153 13.556 -3.382 1.00 1.16 H new ATOM 0 HE2 MET A 158 15.352 12.665 -2.414 1.00 1.16 H new ATOM 0 HE3 MET A 158 15.538 12.775 -4.181 1.00 1.16 H new ATOM 2517 N GLU A 159 17.742 11.326 -5.797 1.00 0.57 N ATOM 2518 CA GLU A 159 18.990 11.804 -6.339 1.00 0.62 C ATOM 2519 C GLU A 159 20.145 11.015 -5.739 1.00 0.54 C ATOM 2520 O GLU A 159 21.227 10.923 -6.316 1.00 0.59 O ATOM 2521 CB GLU A 159 19.161 13.301 -6.090 1.00 0.76 C ATOM 2522 CG GLU A 159 18.157 14.155 -6.843 1.00 1.38 C ATOM 2523 CD GLU A 159 18.200 13.909 -8.338 1.00 1.87 C ATOM 2524 OE1 GLU A 159 19.310 13.905 -8.914 1.00 2.63 O ATOM 2525 OE2 GLU A 159 17.128 13.703 -8.946 1.00 2.09 O ATOM 0 H GLU A 159 17.318 11.934 -5.096 1.00 0.57 H new ATOM 0 HA GLU A 159 18.984 11.653 -7.418 1.00 0.62 H new ATOM 0 HB2 GLU A 159 19.066 13.498 -5.022 1.00 0.76 H new ATOM 0 HB3 GLU A 159 20.169 13.597 -6.380 1.00 0.76 H new ATOM 0 HG2 GLU A 159 17.154 13.946 -6.471 1.00 1.38 H new ATOM 0 HG3 GLU A 159 18.357 15.208 -6.644 1.00 1.38 H new ATOM 2532 N GLU A 160 19.878 10.433 -4.579 1.00 0.52 N ATOM 2533 CA GLU A 160 20.805 9.524 -3.922 1.00 0.55 C ATOM 2534 C GLU A 160 20.307 8.101 -4.104 1.00 0.58 C ATOM 2535 O GLU A 160 20.549 7.233 -3.274 1.00 0.76 O ATOM 2536 CB GLU A 160 20.896 9.852 -2.441 1.00 0.63 C ATOM 2537 CG GLU A 160 21.399 11.258 -2.157 1.00 0.77 C ATOM 2538 CD GLU A 160 22.818 11.490 -2.646 1.00 1.32 C ATOM 2539 OE1 GLU A 160 23.396 10.564 -3.251 1.00 1.61 O ATOM 2540 OE2 GLU A 160 23.360 12.601 -2.443 1.00 2.05 O ATOM 0 H GLU A 160 19.009 10.579 -4.065 1.00 0.52 H new ATOM 0 HA GLU A 160 21.796 9.630 -4.363 1.00 0.55 H new ATOM 0 HB2 GLU A 160 19.911 9.730 -1.990 1.00 0.63 H new ATOM 0 HB3 GLU A 160 21.559 9.134 -1.959 1.00 0.63 H new ATOM 0 HG2 GLU A 160 20.734 11.979 -2.633 1.00 0.77 H new ATOM 0 HG3 GLU A 160 21.355 11.444 -1.084 1.00 0.77 H new ATOM 2547 N ASN A 161 19.583 7.939 -5.207 1.00 0.51 N ATOM 2548 CA ASN A 161 18.899 6.703 -5.636 1.00 0.65 C ATOM 2549 C ASN A 161 19.222 5.449 -4.797 1.00 0.53 C ATOM 2550 O ASN A 161 18.372 5.006 -4.027 1.00 0.53 O ATOM 2551 CB ASN A 161 19.184 6.463 -7.133 1.00 0.92 C ATOM 2552 CG ASN A 161 18.348 5.359 -7.770 1.00 1.07 C ATOM 2553 OD1 ASN A 161 17.956 4.390 -7.127 1.00 1.93 O ATOM 2554 ND2 ASN A 161 18.085 5.505 -9.060 1.00 1.62 N ATOM 0 H ASN A 161 19.444 8.703 -5.868 1.00 0.51 H new ATOM 0 HA ASN A 161 17.835 6.866 -5.467 1.00 0.65 H new ATOM 0 HB2 ASN A 161 19.009 7.392 -7.676 1.00 0.92 H new ATOM 0 HB3 ASN A 161 20.239 6.217 -7.253 1.00 0.92 H new ATOM 0 HD21 ASN A 161 17.539 4.798 -9.552 1.00 1.62 H new ATOM 0 HD22 ASN A 161 18.428 6.325 -9.561 1.00 1.62 H new ATOM 2561 N PRO A 162 20.427 4.844 -4.917 1.00 0.55 N ATOM 2562 CA PRO A 162 20.697 3.556 -4.281 1.00 0.57 C ATOM 2563 C PRO A 162 20.890 3.635 -2.763 1.00 0.55 C ATOM 2564 O PRO A 162 20.892 2.611 -2.077 1.00 0.63 O ATOM 2565 CB PRO A 162 21.989 3.093 -4.952 1.00 0.71 C ATOM 2566 CG PRO A 162 22.681 4.357 -5.311 1.00 0.73 C ATOM 2567 CD PRO A 162 21.593 5.321 -5.682 1.00 0.67 C ATOM 0 HA PRO A 162 19.852 2.879 -4.406 1.00 0.57 H new ATOM 0 HB2 PRO A 162 22.593 2.485 -4.278 1.00 0.71 H new ATOM 0 HB3 PRO A 162 21.785 2.485 -5.834 1.00 0.71 H new ATOM 0 HG2 PRO A 162 23.269 4.733 -4.474 1.00 0.73 H new ATOM 0 HG3 PRO A 162 23.370 4.205 -6.142 1.00 0.73 H new ATOM 0 HD2 PRO A 162 21.856 6.344 -5.414 1.00 0.67 H new ATOM 0 HD3 PRO A 162 21.399 5.312 -6.755 1.00 0.67 H new ATOM 2575 N ALA A 163 21.068 4.841 -2.245 1.00 0.53 N ATOM 2576 CA ALA A 163 21.327 5.030 -0.822 1.00 0.59 C ATOM 2577 C ALA A 163 20.124 5.647 -0.124 1.00 0.53 C ATOM 2578 O ALA A 163 19.932 5.471 1.076 1.00 0.58 O ATOM 2579 CB ALA A 163 22.561 5.898 -0.621 1.00 0.68 C ATOM 0 H ALA A 163 21.038 5.705 -2.787 1.00 0.53 H new ATOM 0 HA ALA A 163 21.509 4.052 -0.377 1.00 0.59 H new ATOM 0 HB1 ALA A 163 22.743 6.031 0.446 1.00 0.68 H new ATOM 0 HB2 ALA A 163 23.424 5.415 -1.079 1.00 0.68 H new ATOM 0 HB3 ALA A 163 22.401 6.871 -1.086 1.00 0.68 H new ATOM 2585 N TYR A 164 19.325 6.379 -0.883 1.00 0.45 N ATOM 2586 CA TYR A 164 18.116 6.999 -0.366 1.00 0.40 C ATOM 2587 C TYR A 164 17.004 6.880 -1.393 1.00 0.32 C ATOM 2588 O TYR A 164 17.176 7.272 -2.548 1.00 0.38 O ATOM 2589 CB TYR A 164 18.352 8.477 -0.043 1.00 0.46 C ATOM 2590 CG TYR A 164 19.273 8.724 1.134 1.00 0.56 C ATOM 2591 CD1 TYR A 164 18.798 8.650 2.437 1.00 0.61 C ATOM 2592 CD2 TYR A 164 20.612 9.041 0.941 1.00 0.67 C ATOM 2593 CE1 TYR A 164 19.631 8.882 3.513 1.00 0.73 C ATOM 2594 CE2 TYR A 164 21.451 9.276 2.013 1.00 0.78 C ATOM 2595 CZ TYR A 164 20.955 9.194 3.295 1.00 0.79 C ATOM 2596 OH TYR A 164 21.786 9.432 4.366 1.00 0.93 O ATOM 0 H TYR A 164 19.496 6.560 -1.872 1.00 0.45 H new ATOM 0 HA TYR A 164 17.833 6.484 0.552 1.00 0.40 H new ATOM 0 HB2 TYR A 164 18.769 8.966 -0.923 1.00 0.46 H new ATOM 0 HB3 TYR A 164 17.391 8.950 0.159 1.00 0.46 H new ATOM 0 HD1 TYR A 164 17.760 8.407 2.611 1.00 0.61 H new ATOM 0 HD2 TYR A 164 21.003 9.105 -0.064 1.00 0.67 H new ATOM 0 HE1 TYR A 164 19.247 8.819 4.520 1.00 0.73 H new ATOM 0 HE2 TYR A 164 22.489 9.522 1.847 1.00 0.78 H new ATOM 0 HH TYR A 164 22.688 9.637 4.041 1.00 0.93 H new ATOM 2606 N SER A 165 15.866 6.348 -0.983 1.00 0.26 N ATOM 2607 CA SER A 165 14.764 6.155 -1.905 1.00 0.24 C ATOM 2608 C SER A 165 13.501 6.835 -1.403 1.00 0.23 C ATOM 2609 O SER A 165 13.265 6.926 -0.199 1.00 0.26 O ATOM 2610 CB SER A 165 14.525 4.669 -2.107 1.00 0.30 C ATOM 2611 OG SER A 165 14.480 4.002 -0.864 1.00 1.41 O ATOM 0 H SER A 165 15.683 6.045 -0.026 1.00 0.26 H new ATOM 0 HA SER A 165 15.026 6.611 -2.860 1.00 0.24 H new ATOM 0 HB2 SER A 165 13.589 4.515 -2.643 1.00 0.30 H new ATOM 0 HB3 SER A 165 15.319 4.248 -2.724 1.00 0.30 H new ATOM 0 HG SER A 165 15.380 3.699 -0.622 1.00 1.41 H new ATOM 2617 N LYS A 166 12.692 7.320 -2.326 1.00 0.24 N ATOM 2618 CA LYS A 166 11.484 8.032 -1.970 1.00 0.26 C ATOM 2619 C LYS A 166 10.289 7.095 -1.889 1.00 0.28 C ATOM 2620 O LYS A 166 9.723 6.690 -2.896 1.00 0.43 O ATOM 2621 CB LYS A 166 11.222 9.164 -2.966 1.00 0.36 C ATOM 2622 CG LYS A 166 9.880 9.851 -2.790 1.00 0.32 C ATOM 2623 CD LYS A 166 9.603 10.202 -1.343 1.00 0.37 C ATOM 2624 CE LYS A 166 10.626 11.173 -0.785 1.00 0.47 C ATOM 2625 NZ LYS A 166 10.827 12.348 -1.680 1.00 0.74 N ATOM 0 H LYS A 166 12.852 7.232 -3.330 1.00 0.24 H new ATOM 0 HA LYS A 166 11.627 8.465 -0.980 1.00 0.26 H new ATOM 0 HB2 LYS A 166 12.013 9.907 -2.870 1.00 0.36 H new ATOM 0 HB3 LYS A 166 11.282 8.763 -3.978 1.00 0.36 H new ATOM 0 HG2 LYS A 166 9.856 10.759 -3.393 1.00 0.32 H new ATOM 0 HG3 LYS A 166 9.089 9.200 -3.162 1.00 0.32 H new ATOM 0 HD2 LYS A 166 8.607 10.638 -1.260 1.00 0.37 H new ATOM 0 HD3 LYS A 166 9.603 9.292 -0.743 1.00 0.37 H new ATOM 0 HE2 LYS A 166 10.302 11.517 0.197 1.00 0.47 H new ATOM 0 HE3 LYS A 166 11.576 10.658 -0.644 1.00 0.47 H new ATOM 0 HZ1 LYS A 166 11.089 13.178 -1.110 1.00 0.74 H new ATOM 0 HZ2 LYS A 166 11.587 12.141 -2.359 1.00 0.74 H new ATOM 0 HZ3 LYS A 166 9.946 12.546 -2.196 1.00 0.74 H new ATOM 2639 N LEU A 167 9.923 6.759 -0.678 1.00 0.20 N ATOM 2640 CA LEU A 167 8.756 5.949 -0.417 1.00 0.21 C ATOM 2641 C LEU A 167 7.543 6.855 -0.224 1.00 0.20 C ATOM 2642 O LEU A 167 7.434 7.535 0.793 1.00 0.24 O ATOM 2643 CB LEU A 167 9.007 5.128 0.848 1.00 0.23 C ATOM 2644 CG LEU A 167 8.183 3.851 0.997 1.00 0.24 C ATOM 2645 CD1 LEU A 167 6.695 4.145 1.074 1.00 0.27 C ATOM 2646 CD2 LEU A 167 8.494 2.904 -0.154 1.00 0.25 C ATOM 0 H LEU A 167 10.429 7.041 0.162 1.00 0.20 H new ATOM 0 HA LEU A 167 8.564 5.280 -1.255 1.00 0.21 H new ATOM 0 HB2 LEU A 167 10.063 4.860 0.879 1.00 0.23 H new ATOM 0 HB3 LEU A 167 8.814 5.763 1.713 1.00 0.23 H new ATOM 0 HG LEU A 167 8.459 3.373 1.937 1.00 0.24 H new ATOM 0 HD11 LEU A 167 6.144 3.210 1.180 1.00 0.27 H new ATOM 0 HD12 LEU A 167 6.494 4.783 1.934 1.00 0.27 H new ATOM 0 HD13 LEU A 167 6.377 4.653 0.163 1.00 0.27 H new ATOM 0 HD21 LEU A 167 7.905 1.993 -0.045 1.00 0.25 H new ATOM 0 HD22 LEU A 167 8.246 3.386 -1.099 1.00 0.25 H new ATOM 0 HD23 LEU A 167 9.555 2.653 -0.142 1.00 0.25 H new ATOM 2658 N VAL A 168 6.646 6.887 -1.195 1.00 0.19 N ATOM 2659 CA VAL A 168 5.436 7.705 -1.054 1.00 0.20 C ATOM 2660 C VAL A 168 4.166 6.904 -1.363 1.00 0.23 C ATOM 2661 O VAL A 168 4.047 6.263 -2.401 1.00 0.28 O ATOM 2662 CB VAL A 168 5.524 9.012 -1.893 1.00 0.20 C ATOM 2663 CG1 VAL A 168 6.488 8.855 -3.055 1.00 0.21 C ATOM 2664 CG2 VAL A 168 4.155 9.462 -2.389 1.00 0.26 C ATOM 0 H VAL A 168 6.721 6.372 -2.072 1.00 0.19 H new ATOM 0 HA VAL A 168 5.370 8.005 -0.008 1.00 0.20 H new ATOM 0 HB VAL A 168 5.907 9.789 -1.232 1.00 0.20 H new ATOM 0 HG11 VAL A 168 6.528 9.785 -3.623 1.00 0.21 H new ATOM 0 HG12 VAL A 168 7.482 8.619 -2.674 1.00 0.21 H new ATOM 0 HG13 VAL A 168 6.147 8.048 -3.704 1.00 0.21 H new ATOM 0 HG21 VAL A 168 4.262 10.378 -2.970 1.00 0.26 H new ATOM 0 HG22 VAL A 168 3.721 8.683 -3.016 1.00 0.26 H new ATOM 0 HG23 VAL A 168 3.502 9.647 -1.536 1.00 0.26 H new ATOM 2674 N MET A 169 3.222 6.960 -0.434 1.00 0.29 N ATOM 2675 CA MET A 169 2.012 6.149 -0.481 1.00 0.32 C ATOM 2676 C MET A 169 0.809 6.990 -0.080 1.00 0.34 C ATOM 2677 O MET A 169 0.878 7.743 0.873 1.00 0.45 O ATOM 2678 CB MET A 169 2.164 4.960 0.482 1.00 0.35 C ATOM 2679 CG MET A 169 0.847 4.305 0.889 1.00 0.40 C ATOM 2680 SD MET A 169 1.071 2.972 2.084 1.00 0.74 S ATOM 2681 CE MET A 169 -0.621 2.424 2.296 1.00 1.24 C ATOM 0 H MET A 169 3.274 7.573 0.379 1.00 0.29 H new ATOM 0 HA MET A 169 1.860 5.780 -1.495 1.00 0.32 H new ATOM 0 HB2 MET A 169 2.800 4.208 0.014 1.00 0.35 H new ATOM 0 HB3 MET A 169 2.680 5.300 1.380 1.00 0.35 H new ATOM 0 HG2 MET A 169 0.186 5.061 1.314 1.00 0.40 H new ATOM 0 HG3 MET A 169 0.352 3.912 0.001 1.00 0.40 H new ATOM 0 HE1 MET A 169 -0.628 1.428 2.738 1.00 1.24 H new ATOM 0 HE2 MET A 169 -1.148 3.116 2.953 1.00 1.24 H new ATOM 0 HE3 MET A 169 -1.118 2.394 1.326 1.00 1.24 H new ATOM 2691 N PHE A 170 -0.286 6.878 -0.800 1.00 0.36 N ATOM 2692 CA PHE A 170 -1.491 7.605 -0.421 1.00 0.42 C ATOM 2693 C PHE A 170 -2.663 6.645 -0.318 1.00 0.37 C ATOM 2694 O PHE A 170 -2.684 5.616 -1.004 1.00 0.38 O ATOM 2695 CB PHE A 170 -1.790 8.755 -1.406 1.00 0.69 C ATOM 2696 CG PHE A 170 -2.893 8.494 -2.403 1.00 1.26 C ATOM 2697 CD1 PHE A 170 -4.220 8.698 -2.060 1.00 2.02 C ATOM 2698 CD2 PHE A 170 -2.603 8.072 -3.684 1.00 1.74 C ATOM 2699 CE1 PHE A 170 -5.233 8.478 -2.970 1.00 3.07 C ATOM 2700 CE2 PHE A 170 -3.615 7.856 -4.602 1.00 2.73 C ATOM 2701 CZ PHE A 170 -4.930 8.059 -4.244 1.00 3.37 C ATOM 0 H PHE A 170 -0.373 6.303 -1.638 1.00 0.36 H new ATOM 0 HA PHE A 170 -1.328 8.059 0.556 1.00 0.42 H new ATOM 0 HB2 PHE A 170 -2.049 9.644 -0.830 1.00 0.69 H new ATOM 0 HB3 PHE A 170 -0.877 8.985 -1.955 1.00 0.69 H new ATOM 0 HD1 PHE A 170 -4.465 9.035 -1.064 1.00 2.02 H new ATOM 0 HD2 PHE A 170 -1.575 7.909 -3.973 1.00 1.74 H new ATOM 0 HE1 PHE A 170 -6.262 8.635 -2.682 1.00 3.07 H new ATOM 0 HE2 PHE A 170 -3.374 7.527 -5.602 1.00 2.73 H new ATOM 0 HZ PHE A 170 -5.720 7.890 -4.961 1.00 3.37 H new ATOM 2711 N VAL A 171 -3.626 6.979 0.545 1.00 0.43 N ATOM 2712 CA VAL A 171 -4.808 6.151 0.730 1.00 0.50 C ATOM 2713 C VAL A 171 -6.092 6.958 0.621 1.00 0.49 C ATOM 2714 O VAL A 171 -6.254 8.010 1.260 1.00 0.50 O ATOM 2715 CB VAL A 171 -4.817 5.412 2.086 1.00 0.66 C ATOM 2716 CG1 VAL A 171 -3.868 4.228 2.068 1.00 1.28 C ATOM 2717 CG2 VAL A 171 -4.476 6.356 3.227 1.00 1.40 C ATOM 0 H VAL A 171 -3.605 7.818 1.124 1.00 0.43 H new ATOM 0 HA VAL A 171 -4.763 5.416 -0.074 1.00 0.50 H new ATOM 0 HB VAL A 171 -5.826 5.035 2.250 1.00 0.66 H new ATOM 0 HG11 VAL A 171 -3.894 3.726 3.035 1.00 1.28 H new ATOM 0 HG12 VAL A 171 -4.172 3.530 1.288 1.00 1.28 H new ATOM 0 HG13 VAL A 171 -2.855 4.577 1.868 1.00 1.28 H new ATOM 0 HG21 VAL A 171 -4.490 5.808 4.169 1.00 1.40 H new ATOM 0 HG22 VAL A 171 -3.483 6.777 3.067 1.00 1.40 H new ATOM 0 HG23 VAL A 171 -5.210 7.161 3.265 1.00 1.40 H new ATOM 2727 N GLN A 172 -6.995 6.435 -0.197 1.00 0.57 N ATOM 2728 CA GLN A 172 -8.359 6.921 -0.294 1.00 0.65 C ATOM 2729 C GLN A 172 -9.258 5.754 0.081 1.00 0.65 C ATOM 2730 O GLN A 172 -10.325 5.527 -0.484 1.00 0.95 O ATOM 2731 CB GLN A 172 -8.663 7.444 -1.706 1.00 0.80 C ATOM 2732 CG GLN A 172 -10.063 8.021 -1.849 1.00 1.01 C ATOM 2733 CD GLN A 172 -10.221 8.929 -3.052 1.00 1.54 C ATOM 2734 OE1 GLN A 172 -10.052 10.142 -2.952 1.00 2.17 O ATOM 2735 NE2 GLN A 172 -10.542 8.349 -4.192 1.00 2.15 N ATOM 0 H GLN A 172 -6.795 5.651 -0.819 1.00 0.57 H new ATOM 0 HA GLN A 172 -8.526 7.764 0.376 1.00 0.65 H new ATOM 0 HB2 GLN A 172 -7.934 8.211 -1.966 1.00 0.80 H new ATOM 0 HB3 GLN A 172 -8.539 6.631 -2.421 1.00 0.80 H new ATOM 0 HG2 GLN A 172 -10.779 7.203 -1.925 1.00 1.01 H new ATOM 0 HG3 GLN A 172 -10.311 8.580 -0.947 1.00 1.01 H new ATOM 0 HE21 GLN A 172 -10.673 7.338 -4.231 1.00 2.15 H new ATOM 0 HE22 GLN A 172 -10.659 8.911 -5.035 1.00 2.15 H new ATOM 2744 N THR A 173 -8.764 5.005 1.054 1.00 0.59 N ATOM 2745 CA THR A 173 -9.389 3.767 1.500 1.00 0.66 C ATOM 2746 C THR A 173 -10.869 3.980 1.831 1.00 0.75 C ATOM 2747 O THR A 173 -11.215 4.902 2.573 1.00 1.01 O ATOM 2748 CB THR A 173 -8.657 3.218 2.733 1.00 0.93 C ATOM 2749 OG1 THR A 173 -7.244 3.295 2.521 1.00 1.65 O ATOM 2750 CG2 THR A 173 -9.049 1.776 2.986 1.00 1.12 C ATOM 0 H THR A 173 -7.911 5.240 1.561 1.00 0.59 H new ATOM 0 HA THR A 173 -9.320 3.046 0.686 1.00 0.66 H new ATOM 0 HB THR A 173 -8.936 3.816 3.601 1.00 0.93 H new ATOM 0 HG1 THR A 173 -6.779 2.805 3.231 1.00 1.65 H new ATOM 0 HG21 THR A 173 -8.520 1.404 3.864 1.00 1.12 H new ATOM 0 HG22 THR A 173 -10.124 1.716 3.157 1.00 1.12 H new ATOM 0 HG23 THR A 173 -8.785 1.170 2.119 1.00 1.12 H new ATOM 2758 N GLU A 174 -11.730 3.103 1.314 1.00 0.69 N ATOM 2759 CA GLU A 174 -13.171 3.321 1.359 1.00 0.87 C ATOM 2760 C GLU A 174 -13.767 2.923 2.702 1.00 0.99 C ATOM 2761 O GLU A 174 -14.772 3.490 3.120 1.00 1.32 O ATOM 2762 CB GLU A 174 -13.818 2.502 0.249 1.00 0.97 C ATOM 2763 CG GLU A 174 -15.222 2.929 -0.086 1.00 1.10 C ATOM 2764 CD GLU A 174 -15.312 3.589 -1.450 1.00 1.80 C ATOM 2765 OE1 GLU A 174 -14.665 4.639 -1.653 1.00 2.45 O ATOM 2766 OE2 GLU A 174 -16.053 3.079 -2.318 1.00 2.30 O ATOM 0 H GLU A 174 -11.451 2.234 0.859 1.00 0.69 H new ATOM 0 HA GLU A 174 -13.364 4.385 1.221 1.00 0.87 H new ATOM 0 HB2 GLU A 174 -13.203 2.575 -0.648 1.00 0.97 H new ATOM 0 HB3 GLU A 174 -13.829 1.453 0.544 1.00 0.97 H new ATOM 0 HG2 GLU A 174 -15.880 2.060 -0.061 1.00 1.10 H new ATOM 0 HG3 GLU A 174 -15.580 3.622 0.675 1.00 1.10 H new ATOM 2773 N MET A 175 -13.132 1.970 3.375 1.00 1.04 N ATOM 2774 CA MET A 175 -13.587 1.492 4.687 1.00 1.36 C ATOM 2775 C MET A 175 -15.095 1.274 4.714 1.00 1.31 C ATOM 2776 O MET A 175 -15.823 1.942 5.442 1.00 1.63 O ATOM 2777 CB MET A 175 -13.168 2.453 5.803 1.00 1.69 C ATOM 2778 CG MET A 175 -11.673 2.452 6.069 1.00 2.10 C ATOM 2779 SD MET A 175 -11.020 0.788 6.317 1.00 3.24 S ATOM 2780 CE MET A 175 -9.324 1.157 6.756 1.00 3.74 C ATOM 0 H MET A 175 -12.291 1.505 3.034 1.00 1.04 H new ATOM 0 HA MET A 175 -13.105 0.530 4.861 1.00 1.36 H new ATOM 0 HB2 MET A 175 -13.482 3.463 5.540 1.00 1.69 H new ATOM 0 HB3 MET A 175 -13.693 2.185 6.720 1.00 1.69 H new ATOM 0 HG2 MET A 175 -11.157 2.921 5.231 1.00 2.10 H new ATOM 0 HG3 MET A 175 -11.463 3.057 6.951 1.00 2.10 H new ATOM 0 HE1 MET A 175 -8.651 0.540 6.160 1.00 3.74 H new ATOM 0 HE2 MET A 175 -9.119 2.210 6.562 1.00 3.74 H new ATOM 0 HE3 MET A 175 -9.168 0.946 7.814 1.00 3.74 H new ATOM 2790 N ARG A 176 -15.544 0.347 3.882 1.00 1.20 N ATOM 2791 CA ARG A 176 -16.953 -0.027 3.817 1.00 1.41 C ATOM 2792 C ARG A 176 -17.425 -0.541 5.169 1.00 1.43 C ATOM 2793 O ARG A 176 -18.559 -0.297 5.576 1.00 2.27 O ATOM 2794 CB ARG A 176 -17.179 -1.110 2.758 1.00 1.92 C ATOM 2795 CG ARG A 176 -16.691 -0.748 1.365 1.00 2.40 C ATOM 2796 CD ARG A 176 -15.387 -1.463 1.029 1.00 3.21 C ATOM 2797 NE ARG A 176 -14.221 -0.880 1.711 1.00 3.99 N ATOM 2798 CZ ARG A 176 -13.463 -1.539 2.594 1.00 4.83 C ATOM 2799 NH1 ARG A 176 -13.800 -2.758 2.971 1.00 5.05 N ATOM 2800 NH2 ARG A 176 -12.367 -0.977 3.092 1.00 5.78 N ATOM 0 H ARG A 176 -14.947 -0.167 3.234 1.00 1.20 H new ATOM 0 HA ARG A 176 -17.524 0.860 3.545 1.00 1.41 H new ATOM 0 HB2 ARG A 176 -16.677 -2.023 3.078 1.00 1.92 H new ATOM 0 HB3 ARG A 176 -18.245 -1.333 2.708 1.00 1.92 H new ATOM 0 HG2 ARG A 176 -17.452 -1.012 0.631 1.00 2.40 H new ATOM 0 HG3 ARG A 176 -16.544 0.330 1.298 1.00 2.40 H new ATOM 0 HD2 ARG A 176 -15.474 -2.514 1.304 1.00 3.21 H new ATOM 0 HD3 ARG A 176 -15.226 -1.427 -0.049 1.00 3.21 H new ATOM 0 HE ARG A 176 -13.976 0.087 1.497 1.00 3.99 H new ATOM 0 HH11 ARG A 176 -14.638 -3.197 2.589 1.00 5.05 H new ATOM 0 HH12 ARG A 176 -13.223 -3.262 3.644 1.00 5.05 H new ATOM 0 HH21 ARG A 176 -12.099 -0.037 2.801 1.00 5.78 H new ATOM 0 HH22 ARG A 176 -11.794 -1.486 3.765 1.00 5.78 H new ATOM 2814 N GLY A 177 -16.542 -1.267 5.851 1.00 1.09 N ATOM 2815 CA GLY A 177 -16.841 -1.737 7.186 1.00 1.32 C ATOM 2816 C GLY A 177 -17.050 -0.584 8.138 1.00 1.51 C ATOM 2817 O GLY A 177 -16.531 0.508 7.916 1.00 2.26 O ATOM 0 H GLY A 177 -15.624 -1.537 5.498 1.00 1.09 H new ATOM 0 HA2 GLY A 177 -17.735 -2.360 7.163 1.00 1.32 H new ATOM 0 HA3 GLY A 177 -16.025 -2.364 7.545 1.00 1.32 H new ATOM 2821 N LYS A 178 -17.798 -0.816 9.196 1.00 1.79 N ATOM 2822 CA LYS A 178 -18.171 0.260 10.091 1.00 2.45 C ATOM 2823 C LYS A 178 -17.048 0.602 11.064 1.00 2.04 C ATOM 2824 O LYS A 178 -16.865 -0.064 12.085 1.00 2.30 O ATOM 2825 CB LYS A 178 -19.445 -0.100 10.855 1.00 3.40 C ATOM 2826 CG LYS A 178 -20.036 1.056 11.653 1.00 4.30 C ATOM 2827 CD LYS A 178 -20.370 2.262 10.778 1.00 4.79 C ATOM 2828 CE LYS A 178 -21.586 2.029 9.886 1.00 5.70 C ATOM 2829 NZ LYS A 178 -21.300 1.107 8.753 1.00 6.23 N ATOM 0 H LYS A 178 -18.158 -1.734 9.457 1.00 1.79 H new ATOM 0 HA LYS A 178 -18.359 1.144 9.481 1.00 2.45 H new ATOM 0 HB2 LYS A 178 -20.192 -0.459 10.147 1.00 3.40 H new ATOM 0 HB3 LYS A 178 -19.228 -0.924 11.535 1.00 3.40 H new ATOM 0 HG2 LYS A 178 -20.940 0.718 12.160 1.00 4.30 H new ATOM 0 HG3 LYS A 178 -19.330 1.357 12.427 1.00 4.30 H new ATOM 0 HD2 LYS A 178 -20.553 3.127 11.415 1.00 4.79 H new ATOM 0 HD3 LYS A 178 -19.509 2.502 10.154 1.00 4.79 H new ATOM 0 HE2 LYS A 178 -22.398 1.619 10.486 1.00 5.70 H new ATOM 0 HE3 LYS A 178 -21.931 2.985 9.493 1.00 5.70 H new ATOM 0 HZ1 LYS A 178 -21.732 1.480 7.884 1.00 6.23 H new ATOM 0 HZ2 LYS A 178 -20.271 1.027 8.622 1.00 6.23 H new ATOM 0 HZ3 LYS A 178 -21.696 0.168 8.961 1.00 6.23 H new ATOM 2843 N LEU A 179 -16.282 1.626 10.718 1.00 1.64 N ATOM 2844 CA LEU A 179 -15.360 2.244 11.642 1.00 1.35 C ATOM 2845 C LEU A 179 -15.965 3.577 12.048 1.00 1.40 C ATOM 2846 O LEU A 179 -16.899 4.065 11.413 1.00 1.56 O ATOM 2847 CB LEU A 179 -13.962 2.479 11.032 1.00 1.23 C ATOM 2848 CG LEU A 179 -13.144 1.248 10.618 1.00 1.17 C ATOM 2849 CD1 LEU A 179 -13.811 0.468 9.495 1.00 1.61 C ATOM 2850 CD2 LEU A 179 -11.753 1.686 10.187 1.00 1.15 C ATOM 0 H LEU A 179 -16.287 2.047 9.789 1.00 1.64 H new ATOM 0 HA LEU A 179 -15.215 1.578 12.492 1.00 1.35 H new ATOM 0 HB2 LEU A 179 -14.083 3.112 10.153 1.00 1.23 H new ATOM 0 HB3 LEU A 179 -13.373 3.045 11.754 1.00 1.23 H new ATOM 0 HG LEU A 179 -13.079 0.585 11.481 1.00 1.17 H new ATOM 0 HD11 LEU A 179 -13.196 -0.394 9.236 1.00 1.61 H new ATOM 0 HD12 LEU A 179 -14.794 0.128 9.822 1.00 1.61 H new ATOM 0 HD13 LEU A 179 -13.922 1.111 8.622 1.00 1.61 H new ATOM 0 HD21 LEU A 179 -11.171 0.812 9.893 1.00 1.15 H new ATOM 0 HD22 LEU A 179 -11.832 2.370 9.342 1.00 1.15 H new ATOM 0 HD23 LEU A 179 -11.257 2.190 11.017 1.00 1.15 H new ATOM 2862 N SER A 180 -15.439 4.148 13.094 1.00 1.31 N ATOM 2863 CA SER A 180 -15.917 5.420 13.599 1.00 1.39 C ATOM 2864 C SER A 180 -14.832 6.457 13.383 1.00 1.32 C ATOM 2865 O SER A 180 -13.686 6.076 13.153 1.00 1.19 O ATOM 2866 CB SER A 180 -16.271 5.296 15.084 1.00 1.41 C ATOM 2867 OG SER A 180 -17.242 4.283 15.286 1.00 2.04 O ATOM 0 H SER A 180 -14.665 3.751 13.627 1.00 1.31 H new ATOM 0 HA SER A 180 -16.819 5.724 13.068 1.00 1.39 H new ATOM 0 HB2 SER A 180 -15.374 5.066 15.659 1.00 1.41 H new ATOM 0 HB3 SER A 180 -16.650 6.249 15.453 1.00 1.41 H new ATOM 0 HG SER A 180 -17.453 4.218 16.241 1.00 2.04 H new ATOM 2873 N PRO A 181 -15.148 7.763 13.432 1.00 1.45 N ATOM 2874 CA PRO A 181 -14.144 8.814 13.264 1.00 1.44 C ATOM 2875 C PRO A 181 -12.865 8.508 14.038 1.00 1.30 C ATOM 2876 O PRO A 181 -11.772 8.533 13.480 1.00 1.20 O ATOM 2877 CB PRO A 181 -14.841 10.048 13.830 1.00 1.65 C ATOM 2878 CG PRO A 181 -16.287 9.814 13.563 1.00 1.74 C ATOM 2879 CD PRO A 181 -16.499 8.322 13.646 1.00 1.64 C ATOM 0 HA PRO A 181 -13.826 8.929 12.228 1.00 1.44 H new ATOM 0 HB2 PRO A 181 -14.647 10.159 14.897 1.00 1.65 H new ATOM 0 HB3 PRO A 181 -14.490 10.959 13.346 1.00 1.65 H new ATOM 0 HG2 PRO A 181 -16.906 10.336 14.293 1.00 1.74 H new ATOM 0 HG3 PRO A 181 -16.567 10.192 12.580 1.00 1.74 H new ATOM 0 HD2 PRO A 181 -16.905 8.029 14.614 1.00 1.64 H new ATOM 0 HD3 PRO A 181 -17.201 7.975 12.888 1.00 1.64 H new ATOM 2887 N SER A 182 -13.030 8.142 15.306 1.00 1.34 N ATOM 2888 CA SER A 182 -11.910 7.846 16.192 1.00 1.28 C ATOM 2889 C SER A 182 -11.151 6.574 15.777 1.00 1.11 C ATOM 2890 O SER A 182 -10.051 6.314 16.260 1.00 1.09 O ATOM 2891 CB SER A 182 -12.440 7.693 17.617 1.00 1.40 C ATOM 2892 OG SER A 182 -13.378 8.717 17.914 1.00 2.14 O ATOM 0 H SER A 182 -13.944 8.042 15.748 1.00 1.34 H new ATOM 0 HA SER A 182 -11.201 8.672 16.129 1.00 1.28 H new ATOM 0 HB2 SER A 182 -12.910 6.717 17.733 1.00 1.40 H new ATOM 0 HB3 SER A 182 -11.612 7.734 18.325 1.00 1.40 H new ATOM 0 HG SER A 182 -13.708 8.603 18.830 1.00 2.14 H new ATOM 2898 N ILE A 183 -11.729 5.786 14.874 1.00 1.04 N ATOM 2899 CA ILE A 183 -11.104 4.543 14.438 1.00 0.90 C ATOM 2900 C ILE A 183 -10.255 4.826 13.234 1.00 0.79 C ATOM 2901 O ILE A 183 -9.148 4.341 13.092 1.00 0.69 O ATOM 2902 CB ILE A 183 -12.139 3.482 14.035 1.00 0.96 C ATOM 2903 CG1 ILE A 183 -13.184 3.307 15.126 1.00 1.09 C ATOM 2904 CG2 ILE A 183 -11.454 2.156 13.738 1.00 0.92 C ATOM 2905 CD1 ILE A 183 -12.610 2.845 16.449 1.00 1.12 C ATOM 0 H ILE A 183 -12.626 5.986 14.432 1.00 1.04 H new ATOM 0 HA ILE A 183 -10.518 4.161 15.274 1.00 0.90 H new ATOM 0 HB ILE A 183 -12.643 3.823 13.130 1.00 0.96 H new ATOM 0 HG12 ILE A 183 -13.702 4.254 15.276 1.00 1.09 H new ATOM 0 HG13 ILE A 183 -13.929 2.585 14.791 1.00 1.09 H new ATOM 0 HG21 ILE A 183 -12.202 1.416 13.454 1.00 0.92 H new ATOM 0 HG22 ILE A 183 -10.745 2.288 12.920 1.00 0.92 H new ATOM 0 HG23 ILE A 183 -10.923 1.814 14.626 1.00 0.92 H new ATOM 0 HD11 ILE A 183 -13.414 2.742 17.178 1.00 1.12 H new ATOM 0 HD12 ILE A 183 -12.116 1.883 16.315 1.00 1.12 H new ATOM 0 HD13 ILE A 183 -11.886 3.577 16.807 1.00 1.12 H new ATOM 2917 N ILE A 184 -10.830 5.619 12.373 1.00 0.87 N ATOM 2918 CA ILE A 184 -10.214 6.067 11.161 1.00 0.83 C ATOM 2919 C ILE A 184 -9.032 6.978 11.470 1.00 0.81 C ATOM 2920 O ILE A 184 -8.025 6.982 10.757 1.00 0.75 O ATOM 2921 CB ILE A 184 -11.261 6.785 10.299 1.00 0.96 C ATOM 2922 CG1 ILE A 184 -12.142 5.764 9.587 1.00 0.98 C ATOM 2923 CG2 ILE A 184 -10.613 7.738 9.295 1.00 1.00 C ATOM 2924 CD1 ILE A 184 -13.455 5.518 10.283 1.00 1.13 C ATOM 0 H ILE A 184 -11.774 5.982 12.503 1.00 0.87 H new ATOM 0 HA ILE A 184 -9.831 5.211 10.606 1.00 0.83 H new ATOM 0 HB ILE A 184 -11.882 7.389 10.960 1.00 0.96 H new ATOM 0 HG12 ILE A 184 -12.337 6.109 8.571 1.00 0.98 H new ATOM 0 HG13 ILE A 184 -11.600 4.822 9.506 1.00 0.98 H new ATOM 0 HG21 ILE A 184 -11.388 8.226 8.704 1.00 1.00 H new ATOM 0 HG22 ILE A 184 -10.035 8.492 9.830 1.00 1.00 H new ATOM 0 HG23 ILE A 184 -9.953 7.176 8.634 1.00 1.00 H new ATOM 0 HD11 ILE A 184 -14.031 4.782 9.723 1.00 1.13 H new ATOM 0 HD12 ILE A 184 -13.269 5.144 11.290 1.00 1.13 H new ATOM 0 HD13 ILE A 184 -14.016 6.450 10.341 1.00 1.13 H new ATOM 2936 N GLU A 185 -9.153 7.701 12.574 1.00 0.91 N ATOM 2937 CA GLU A 185 -8.072 8.550 13.063 1.00 0.99 C ATOM 2938 C GLU A 185 -6.908 7.670 13.469 1.00 0.91 C ATOM 2939 O GLU A 185 -5.748 8.071 13.426 1.00 0.99 O ATOM 2940 CB GLU A 185 -8.532 9.378 14.268 1.00 1.17 C ATOM 2941 CG GLU A 185 -9.569 10.438 13.939 1.00 1.58 C ATOM 2942 CD GLU A 185 -8.962 11.706 13.377 1.00 2.26 C ATOM 2943 OE1 GLU A 185 -8.700 11.763 12.161 1.00 2.89 O ATOM 2944 OE2 GLU A 185 -8.765 12.666 14.152 1.00 2.46 O ATOM 0 H GLU A 185 -9.993 7.718 13.152 1.00 0.91 H new ATOM 0 HA GLU A 185 -7.772 9.236 12.271 1.00 0.99 H new ATOM 0 HB2 GLU A 185 -8.943 8.705 15.021 1.00 1.17 H new ATOM 0 HB3 GLU A 185 -7.663 9.862 14.714 1.00 1.17 H new ATOM 0 HG2 GLU A 185 -10.280 10.032 13.219 1.00 1.58 H new ATOM 0 HG3 GLU A 185 -10.132 10.680 14.841 1.00 1.58 H new ATOM 2951 N LYS A 186 -7.246 6.462 13.878 1.00 0.82 N ATOM 2952 CA LYS A 186 -6.257 5.490 14.274 1.00 0.79 C ATOM 2953 C LYS A 186 -5.868 4.597 13.094 1.00 0.70 C ATOM 2954 O LYS A 186 -4.766 4.063 13.062 1.00 0.86 O ATOM 2955 CB LYS A 186 -6.777 4.670 15.463 1.00 0.80 C ATOM 2956 CG LYS A 186 -7.129 3.233 15.154 1.00 1.27 C ATOM 2957 CD LYS A 186 -7.594 2.504 16.406 1.00 1.28 C ATOM 2958 CE LYS A 186 -8.895 3.073 16.949 1.00 0.96 C ATOM 2959 NZ LYS A 186 -9.357 2.331 18.157 1.00 1.09 N ATOM 0 H LYS A 186 -8.209 6.133 13.943 1.00 0.82 H new ATOM 0 HA LYS A 186 -5.354 6.010 14.592 1.00 0.79 H new ATOM 0 HB2 LYS A 186 -6.021 4.681 16.248 1.00 0.80 H new ATOM 0 HB3 LYS A 186 -7.661 5.165 15.865 1.00 0.80 H new ATOM 0 HG2 LYS A 186 -7.914 3.202 14.398 1.00 1.27 H new ATOM 0 HG3 LYS A 186 -6.261 2.725 14.734 1.00 1.27 H new ATOM 0 HD2 LYS A 186 -7.728 1.446 16.180 1.00 1.28 H new ATOM 0 HD3 LYS A 186 -6.822 2.571 17.172 1.00 1.28 H new ATOM 0 HE2 LYS A 186 -8.757 4.125 17.198 1.00 0.96 H new ATOM 0 HE3 LYS A 186 -9.663 3.027 16.177 1.00 0.96 H new ATOM 0 HZ1 LYS A 186 -9.986 2.939 18.719 1.00 1.09 H new ATOM 0 HZ2 LYS A 186 -9.873 1.477 17.864 1.00 1.09 H new ATOM 0 HZ3 LYS A 186 -8.535 2.058 18.733 1.00 1.09 H new ATOM 2973 N THR A 187 -6.766 4.428 12.121 1.00 0.59 N ATOM 2974 CA THR A 187 -6.478 3.525 11.011 1.00 0.54 C ATOM 2975 C THR A 187 -5.541 4.161 9.983 1.00 0.50 C ATOM 2976 O THR A 187 -4.585 3.524 9.545 1.00 0.53 O ATOM 2977 CB THR A 187 -7.764 3.002 10.316 1.00 0.58 C ATOM 2978 OG1 THR A 187 -7.453 1.869 9.494 1.00 0.62 O ATOM 2979 CG2 THR A 187 -8.414 4.059 9.444 1.00 0.60 C ATOM 0 H THR A 187 -7.674 4.891 12.080 1.00 0.59 H new ATOM 0 HA THR A 187 -5.970 2.667 11.453 1.00 0.54 H new ATOM 0 HB THR A 187 -8.461 2.727 11.108 1.00 0.58 H new ATOM 0 HG1 THR A 187 -7.382 2.153 8.559 1.00 0.62 H new ATOM 0 HG21 THR A 187 -9.309 3.647 8.979 1.00 0.60 H new ATOM 0 HG22 THR A 187 -8.686 4.919 10.056 1.00 0.60 H new ATOM 0 HG23 THR A 187 -7.714 4.372 8.669 1.00 0.60 H new ATOM 2987 N MET A 188 -5.778 5.419 9.616 1.00 0.52 N ATOM 2988 CA MET A 188 -5.002 6.024 8.544 1.00 0.53 C ATOM 2989 C MET A 188 -3.643 6.493 9.058 1.00 0.54 C ATOM 2990 O MET A 188 -2.625 5.888 8.722 1.00 0.54 O ATOM 2991 CB MET A 188 -5.746 7.186 7.866 1.00 0.62 C ATOM 2992 CG MET A 188 -7.186 6.887 7.453 1.00 0.80 C ATOM 2993 SD MET A 188 -7.343 6.115 5.823 1.00 1.06 S ATOM 2994 CE MET A 188 -6.658 4.487 6.125 1.00 0.83 C ATOM 0 H MET A 188 -6.484 6.024 10.035 1.00 0.52 H new ATOM 0 HA MET A 188 -4.850 5.252 7.790 1.00 0.53 H new ATOM 0 HB2 MET A 188 -5.750 8.039 8.545 1.00 0.62 H new ATOM 0 HB3 MET A 188 -5.186 7.486 6.980 1.00 0.62 H new ATOM 0 HG2 MET A 188 -7.638 6.232 8.198 1.00 0.80 H new ATOM 0 HG3 MET A 188 -7.755 7.817 7.459 1.00 0.80 H new ATOM 0 HE1 MET A 188 -5.700 4.394 5.613 1.00 0.83 H new ATOM 0 HE2 MET A 188 -6.512 4.347 7.196 1.00 0.83 H new ATOM 0 HE3 MET A 188 -7.345 3.728 5.750 1.00 0.83 H new ATOM 3004 N PRO A 189 -3.595 7.542 9.920 1.00 0.60 N ATOM 3005 CA PRO A 189 -2.331 8.180 10.326 1.00 0.71 C ATOM 3006 C PRO A 189 -1.377 7.225 11.033 1.00 0.74 C ATOM 3007 O PRO A 189 -0.190 7.517 11.179 1.00 0.91 O ATOM 3008 CB PRO A 189 -2.767 9.300 11.279 1.00 0.84 C ATOM 3009 CG PRO A 189 -4.209 9.521 10.976 1.00 0.83 C ATOM 3010 CD PRO A 189 -4.746 8.182 10.581 1.00 0.63 C ATOM 0 HA PRO A 189 -1.777 8.534 9.457 1.00 0.71 H new ATOM 0 HB2 PRO A 189 -2.622 9.012 12.320 1.00 0.84 H new ATOM 0 HB3 PRO A 189 -2.185 10.207 11.115 1.00 0.84 H new ATOM 0 HG2 PRO A 189 -4.736 9.914 11.845 1.00 0.83 H new ATOM 0 HG3 PRO A 189 -4.334 10.246 10.172 1.00 0.83 H new ATOM 0 HD2 PRO A 189 -5.082 7.611 11.447 1.00 0.63 H new ATOM 0 HD3 PRO A 189 -5.599 8.272 9.908 1.00 0.63 H new ATOM 3018 N SER A 190 -1.891 6.092 11.471 1.00 0.66 N ATOM 3019 CA SER A 190 -1.053 5.078 12.072 1.00 0.76 C ATOM 3020 C SER A 190 -0.470 4.185 10.988 1.00 0.72 C ATOM 3021 O SER A 190 0.729 3.926 10.960 1.00 0.90 O ATOM 3022 CB SER A 190 -1.851 4.236 13.075 1.00 0.84 C ATOM 3023 OG SER A 190 -1.027 3.289 13.736 1.00 1.50 O ATOM 0 H SER A 190 -2.881 5.853 11.421 1.00 0.66 H new ATOM 0 HA SER A 190 -0.242 5.570 12.609 1.00 0.76 H new ATOM 0 HB2 SER A 190 -2.316 4.891 13.812 1.00 0.84 H new ATOM 0 HB3 SER A 190 -2.657 3.718 12.555 1.00 0.84 H new ATOM 0 HG SER A 190 -1.567 2.771 14.369 1.00 1.50 H new ATOM 3029 N ASN A 191 -1.311 3.775 10.053 1.00 0.57 N ATOM 3030 CA ASN A 191 -0.937 2.712 9.137 1.00 0.61 C ATOM 3031 C ASN A 191 -0.158 3.234 7.938 1.00 0.51 C ATOM 3032 O ASN A 191 0.564 2.476 7.302 1.00 0.52 O ATOM 3033 CB ASN A 191 -2.162 1.921 8.683 1.00 0.70 C ATOM 3034 CG ASN A 191 -1.904 0.424 8.667 1.00 1.08 C ATOM 3035 OD1 ASN A 191 -1.089 -0.089 9.441 1.00 1.88 O ATOM 3036 ND2 ASN A 191 -2.606 -0.291 7.800 1.00 1.46 N ATOM 0 H ASN A 191 -2.246 4.157 9.909 1.00 0.57 H new ATOM 0 HA ASN A 191 -0.276 2.040 9.685 1.00 0.61 H new ATOM 0 HB2 ASN A 191 -2.999 2.137 9.348 1.00 0.70 H new ATOM 0 HB3 ASN A 191 -2.455 2.248 7.685 1.00 0.70 H new ATOM 0 HD21 ASN A 191 -2.483 -1.303 7.755 1.00 1.46 H new ATOM 0 HD22 ASN A 191 -3.269 0.170 7.177 1.00 1.46 H new ATOM 3043 N LEU A 192 -0.289 4.520 7.629 1.00 0.45 N ATOM 3044 CA LEU A 192 0.523 5.124 6.580 1.00 0.42 C ATOM 3045 C LEU A 192 1.995 5.004 6.934 1.00 0.36 C ATOM 3046 O LEU A 192 2.813 4.511 6.156 1.00 0.35 O ATOM 3047 CB LEU A 192 0.172 6.599 6.435 1.00 0.48 C ATOM 3048 CG LEU A 192 -1.258 6.884 5.998 1.00 0.62 C ATOM 3049 CD1 LEU A 192 -1.828 8.012 6.819 1.00 1.04 C ATOM 3050 CD2 LEU A 192 -1.304 7.232 4.523 1.00 1.09 C ATOM 0 H LEU A 192 -0.942 5.158 8.084 1.00 0.45 H new ATOM 0 HA LEU A 192 0.324 4.605 5.642 1.00 0.42 H new ATOM 0 HB2 LEU A 192 0.349 7.094 7.390 1.00 0.48 H new ATOM 0 HB3 LEU A 192 0.853 7.049 5.712 1.00 0.48 H new ATOM 0 HG LEU A 192 -1.859 5.989 6.158 1.00 0.62 H new ATOM 0 HD11 LEU A 192 -2.852 8.212 6.502 1.00 1.04 H new ATOM 0 HD12 LEU A 192 -1.822 7.734 7.873 1.00 1.04 H new ATOM 0 HD13 LEU A 192 -1.223 8.907 6.677 1.00 1.04 H new ATOM 0 HD21 LEU A 192 -2.334 7.433 4.228 1.00 1.09 H new ATOM 0 HD22 LEU A 192 -0.695 8.117 4.339 1.00 1.09 H new ATOM 0 HD23 LEU A 192 -0.916 6.397 3.940 1.00 1.09 H new ATOM 3062 N VAL A 193 2.308 5.445 8.137 1.00 0.36 N ATOM 3063 CA VAL A 193 3.677 5.446 8.625 1.00 0.36 C ATOM 3064 C VAL A 193 4.118 4.022 8.923 1.00 0.39 C ATOM 3065 O VAL A 193 5.283 3.661 8.768 1.00 0.42 O ATOM 3066 CB VAL A 193 3.824 6.324 9.894 1.00 0.44 C ATOM 3067 CG1 VAL A 193 2.799 7.445 9.887 1.00 0.68 C ATOM 3068 CG2 VAL A 193 3.716 5.523 11.186 1.00 0.59 C ATOM 0 H VAL A 193 1.626 5.811 8.802 1.00 0.36 H new ATOM 0 HA VAL A 193 4.314 5.870 7.849 1.00 0.36 H new ATOM 0 HB VAL A 193 4.828 6.747 9.865 1.00 0.44 H new ATOM 0 HG11 VAL A 193 2.917 8.051 10.785 1.00 0.68 H new ATOM 0 HG12 VAL A 193 2.948 8.069 9.006 1.00 0.68 H new ATOM 0 HG13 VAL A 193 1.795 7.020 9.865 1.00 0.68 H new ATOM 0 HG21 VAL A 193 3.827 6.192 12.039 1.00 0.59 H new ATOM 0 HG22 VAL A 193 2.742 5.035 11.231 1.00 0.59 H new ATOM 0 HG23 VAL A 193 4.502 4.768 11.213 1.00 0.59 H new ATOM 3078 N ASN A 194 3.157 3.226 9.341 1.00 0.43 N ATOM 3079 CA ASN A 194 3.386 1.836 9.689 1.00 0.48 C ATOM 3080 C ASN A 194 3.638 0.981 8.456 1.00 0.45 C ATOM 3081 O ASN A 194 4.367 -0.005 8.527 1.00 0.49 O ATOM 3082 CB ASN A 194 2.199 1.301 10.485 1.00 0.58 C ATOM 3083 CG ASN A 194 2.317 1.538 11.986 1.00 1.28 C ATOM 3084 OD1 ASN A 194 1.798 0.762 12.786 1.00 1.80 O ATOM 3085 ND2 ASN A 194 2.992 2.604 12.380 1.00 2.07 N ATOM 0 H ASN A 194 2.188 3.525 9.450 1.00 0.43 H new ATOM 0 HA ASN A 194 4.284 1.783 10.305 1.00 0.48 H new ATOM 0 HB2 ASN A 194 1.286 1.772 10.121 1.00 0.58 H new ATOM 0 HB3 ASN A 194 2.101 0.231 10.301 1.00 0.58 H new ATOM 0 HD21 ASN A 194 3.095 2.803 13.375 1.00 2.07 H new ATOM 0 HD22 ASN A 194 3.410 3.227 11.689 1.00 2.07 H new ATOM 3092 N PHE A 195 3.046 1.350 7.327 1.00 0.44 N ATOM 3093 CA PHE A 195 3.354 0.673 6.075 1.00 0.44 C ATOM 3094 C PHE A 195 4.761 1.030 5.626 1.00 0.36 C ATOM 3095 O PHE A 195 5.438 0.236 4.972 1.00 0.36 O ATOM 3096 CB PHE A 195 2.341 1.012 4.982 1.00 0.47 C ATOM 3097 CG PHE A 195 1.302 -0.053 4.789 1.00 0.73 C ATOM 3098 CD1 PHE A 195 1.616 -1.227 4.121 1.00 1.51 C ATOM 3099 CD2 PHE A 195 0.014 0.117 5.269 1.00 1.06 C ATOM 3100 CE1 PHE A 195 0.664 -2.212 3.940 1.00 2.00 C ATOM 3101 CE2 PHE A 195 -0.941 -0.866 5.089 1.00 1.43 C ATOM 3102 CZ PHE A 195 -0.616 -2.031 4.425 1.00 1.76 C ATOM 0 H PHE A 195 2.361 2.102 7.252 1.00 0.44 H new ATOM 0 HA PHE A 195 3.294 -0.401 6.251 1.00 0.44 H new ATOM 0 HB2 PHE A 195 1.847 1.951 5.232 1.00 0.47 H new ATOM 0 HB3 PHE A 195 2.870 1.170 4.042 1.00 0.47 H new ATOM 0 HD1 PHE A 195 2.615 -1.373 3.738 1.00 1.51 H new ATOM 0 HD2 PHE A 195 -0.247 1.027 5.789 1.00 1.06 H new ATOM 0 HE1 PHE A 195 0.921 -3.123 3.420 1.00 2.00 H new ATOM 0 HE2 PHE A 195 -1.942 -0.722 5.468 1.00 1.43 H new ATOM 0 HZ PHE A 195 -1.361 -2.800 4.285 1.00 1.76 H new ATOM 3112 N ILE A 196 5.207 2.221 5.997 1.00 0.31 N ATOM 3113 CA ILE A 196 6.574 2.620 5.748 1.00 0.27 C ATOM 3114 C ILE A 196 7.515 1.940 6.739 1.00 0.28 C ATOM 3115 O ILE A 196 8.687 1.715 6.454 1.00 0.28 O ATOM 3116 CB ILE A 196 6.715 4.147 5.824 1.00 0.25 C ATOM 3117 CG1 ILE A 196 6.053 4.783 4.600 1.00 0.25 C ATOM 3118 CG2 ILE A 196 8.175 4.546 5.940 1.00 0.29 C ATOM 3119 CD1 ILE A 196 6.156 6.289 4.563 1.00 0.26 C ATOM 0 H ILE A 196 4.639 2.923 6.471 1.00 0.31 H new ATOM 0 HA ILE A 196 6.848 2.304 4.741 1.00 0.27 H new ATOM 0 HB ILE A 196 6.209 4.512 6.718 1.00 0.25 H new ATOM 0 HG12 ILE A 196 6.510 4.375 3.699 1.00 0.25 H new ATOM 0 HG13 ILE A 196 5.001 4.500 4.580 1.00 0.25 H new ATOM 0 HG21 ILE A 196 8.252 5.632 5.992 1.00 0.29 H new ATOM 0 HG22 ILE A 196 8.601 4.108 6.842 1.00 0.29 H new ATOM 0 HG23 ILE A 196 8.721 4.185 5.068 1.00 0.29 H new ATOM 0 HD11 ILE A 196 5.664 6.665 3.666 1.00 0.26 H new ATOM 0 HD12 ILE A 196 5.673 6.709 5.445 1.00 0.26 H new ATOM 0 HD13 ILE A 196 7.206 6.582 4.550 1.00 0.26 H new ATOM 3131 N LEU A 197 6.990 1.601 7.898 1.00 0.33 N ATOM 3132 CA LEU A 197 7.735 0.832 8.878 1.00 0.37 C ATOM 3133 C LEU A 197 7.921 -0.574 8.391 1.00 0.36 C ATOM 3134 O LEU A 197 8.993 -1.158 8.532 1.00 0.38 O ATOM 3135 CB LEU A 197 7.009 0.808 10.211 1.00 0.50 C ATOM 3136 CG LEU A 197 7.089 2.097 10.993 1.00 0.52 C ATOM 3137 CD1 LEU A 197 6.241 1.981 12.249 1.00 1.00 C ATOM 3138 CD2 LEU A 197 8.546 2.382 11.319 1.00 1.03 C ATOM 0 H LEU A 197 6.043 1.847 8.188 1.00 0.33 H new ATOM 0 HA LEU A 197 8.707 1.307 9.015 1.00 0.37 H new ATOM 0 HB2 LEU A 197 5.960 0.570 10.034 1.00 0.50 H new ATOM 0 HB3 LEU A 197 7.421 0.003 10.820 1.00 0.50 H new ATOM 0 HG LEU A 197 6.699 2.929 10.407 1.00 0.52 H new ATOM 0 HD11 LEU A 197 6.298 2.911 12.814 1.00 1.00 H new ATOM 0 HD12 LEU A 197 5.205 1.788 11.972 1.00 1.00 H new ATOM 0 HD13 LEU A 197 6.611 1.160 12.863 1.00 1.00 H new ATOM 0 HD21 LEU A 197 8.617 3.311 11.884 1.00 1.03 H new ATOM 0 HD22 LEU A 197 8.953 1.564 11.913 1.00 1.03 H new ATOM 0 HD23 LEU A 197 9.114 2.476 10.394 1.00 1.03 H new ATOM 3150 N ASN A 198 6.856 -1.116 7.835 1.00 0.38 N ATOM 3151 CA ASN A 198 6.938 -2.362 7.104 1.00 0.43 C ATOM 3152 C ASN A 198 8.056 -2.288 6.086 1.00 0.31 C ATOM 3153 O ASN A 198 8.723 -3.274 5.806 1.00 0.32 O ATOM 3154 CB ASN A 198 5.631 -2.654 6.382 1.00 0.65 C ATOM 3155 CG ASN A 198 4.530 -3.099 7.313 1.00 1.05 C ATOM 3156 OD1 ASN A 198 4.791 -3.681 8.362 1.00 1.90 O ATOM 3157 ND2 ASN A 198 3.289 -2.830 6.937 1.00 1.61 N ATOM 0 H ASN A 198 5.921 -0.710 7.876 1.00 0.38 H new ATOM 0 HA ASN A 198 7.135 -3.161 7.818 1.00 0.43 H new ATOM 0 HB2 ASN A 198 5.309 -1.759 5.849 1.00 0.65 H new ATOM 0 HB3 ASN A 198 5.801 -3.428 5.633 1.00 0.65 H new ATOM 0 HD21 ASN A 198 2.505 -3.109 7.528 1.00 1.61 H new ATOM 0 HD22 ASN A 198 3.117 -2.344 6.057 1.00 1.61 H new ATOM 3164 N ALA A 199 8.275 -1.104 5.545 1.00 0.29 N ATOM 3165 CA ALA A 199 9.292 -0.913 4.560 1.00 0.25 C ATOM 3166 C ALA A 199 10.658 -0.776 5.205 1.00 0.23 C ATOM 3167 O ALA A 199 11.636 -1.322 4.709 1.00 0.26 O ATOM 3168 CB ALA A 199 8.939 0.298 3.749 1.00 0.26 C ATOM 0 H ALA A 199 7.751 -0.262 5.782 1.00 0.29 H new ATOM 0 HA ALA A 199 9.345 -1.784 3.906 1.00 0.25 H new ATOM 0 HB1 ALA A 199 9.703 0.463 2.990 1.00 0.26 H new ATOM 0 HB2 ALA A 199 7.974 0.144 3.265 1.00 0.26 H new ATOM 0 HB3 ALA A 199 8.882 1.169 4.402 1.00 0.26 H new ATOM 3174 N LYS A 200 10.720 -0.057 6.319 1.00 0.26 N ATOM 3175 CA LYS A 200 11.964 0.073 7.068 1.00 0.29 C ATOM 3176 C LYS A 200 12.446 -1.296 7.522 1.00 0.31 C ATOM 3177 O LYS A 200 13.630 -1.621 7.442 1.00 0.36 O ATOM 3178 CB LYS A 200 11.751 0.938 8.300 1.00 0.34 C ATOM 3179 CG LYS A 200 11.406 2.394 8.012 1.00 0.57 C ATOM 3180 CD LYS A 200 12.440 3.059 7.111 1.00 0.54 C ATOM 3181 CE LYS A 200 12.611 4.535 7.447 1.00 0.64 C ATOM 3182 NZ LYS A 200 11.310 5.248 7.574 1.00 0.97 N ATOM 0 H LYS A 200 9.928 0.443 6.722 1.00 0.26 H new ATOM 0 HA LYS A 200 12.706 0.534 6.416 1.00 0.29 H new ATOM 0 HB2 LYS A 200 10.951 0.502 8.898 1.00 0.34 H new ATOM 0 HB3 LYS A 200 12.655 0.908 8.908 1.00 0.34 H new ATOM 0 HG2 LYS A 200 10.425 2.447 7.539 1.00 0.57 H new ATOM 0 HG3 LYS A 200 11.337 2.943 8.951 1.00 0.57 H new ATOM 0 HD2 LYS A 200 13.397 2.548 7.216 1.00 0.54 H new ATOM 0 HD3 LYS A 200 12.136 2.955 6.069 1.00 0.54 H new ATOM 0 HE2 LYS A 200 13.165 4.629 8.381 1.00 0.64 H new ATOM 0 HE3 LYS A 200 13.209 5.013 6.671 1.00 0.64 H new ATOM 0 HZ1 LYS A 200 11.471 6.275 7.532 1.00 0.97 H new ATOM 0 HZ2 LYS A 200 10.681 4.964 6.796 1.00 0.97 H new ATOM 0 HZ3 LYS A 200 10.868 5.004 8.483 1.00 0.97 H new ATOM 3196 N ASP A 201 11.501 -2.096 7.979 1.00 0.30 N ATOM 3197 CA ASP A 201 11.811 -3.409 8.531 1.00 0.33 C ATOM 3198 C ASP A 201 11.920 -4.440 7.429 1.00 0.31 C ATOM 3199 O ASP A 201 12.840 -5.247 7.425 1.00 0.36 O ATOM 3200 CB ASP A 201 10.760 -3.853 9.555 1.00 0.40 C ATOM 3201 CG ASP A 201 11.103 -3.434 10.971 1.00 1.10 C ATOM 3202 OD1 ASP A 201 11.893 -4.143 11.635 1.00 1.18 O ATOM 3203 OD2 ASP A 201 10.574 -2.405 11.442 1.00 1.94 O ATOM 0 H ASP A 201 10.508 -1.862 7.980 1.00 0.30 H new ATOM 0 HA ASP A 201 12.771 -3.327 9.041 1.00 0.33 H new ATOM 0 HB2 ASP A 201 9.793 -3.432 9.281 1.00 0.40 H new ATOM 0 HB3 ASP A 201 10.658 -4.938 9.517 1.00 0.40 H new ATOM 3208 N GLY A 202 10.993 -4.395 6.485 1.00 0.31 N ATOM 3209 CA GLY A 202 11.007 -5.347 5.386 1.00 0.37 C ATOM 3210 C GLY A 202 12.226 -5.176 4.510 1.00 0.37 C ATOM 3211 O GLY A 202 12.720 -6.140 3.931 1.00 0.47 O ATOM 0 H GLY A 202 10.230 -3.718 6.457 1.00 0.31 H new ATOM 0 HA2 GLY A 202 10.985 -6.362 5.784 1.00 0.37 H new ATOM 0 HA3 GLY A 202 10.107 -5.221 4.785 1.00 0.37 H new ATOM 3215 N ILE A 203 12.716 -3.944 4.413 1.00 0.30 N ATOM 3216 CA ILE A 203 13.874 -3.648 3.594 1.00 0.37 C ATOM 3217 C ILE A 203 15.134 -4.230 4.212 1.00 0.47 C ATOM 3218 O ILE A 203 15.980 -4.750 3.502 1.00 0.61 O ATOM 3219 CB ILE A 203 14.060 -2.123 3.359 1.00 0.32 C ATOM 3220 CG1 ILE A 203 14.633 -1.863 1.987 1.00 0.41 C ATOM 3221 CG2 ILE A 203 14.990 -1.499 4.365 1.00 0.38 C ATOM 3222 CD1 ILE A 203 13.661 -2.117 0.891 1.00 0.52 C ATOM 0 H ILE A 203 12.324 -3.136 4.895 1.00 0.30 H new ATOM 0 HA ILE A 203 13.697 -4.113 2.624 1.00 0.37 H new ATOM 0 HB ILE A 203 13.070 -1.678 3.460 1.00 0.32 H new ATOM 0 HG12 ILE A 203 14.972 -0.828 1.931 1.00 0.41 H new ATOM 0 HG13 ILE A 203 15.510 -2.494 1.840 1.00 0.41 H new ATOM 0 HG21 ILE A 203 15.087 -0.433 4.158 1.00 0.38 H new ATOM 0 HG22 ILE A 203 14.588 -1.639 5.368 1.00 0.38 H new ATOM 0 HG23 ILE A 203 15.969 -1.972 4.298 1.00 0.38 H new ATOM 0 HD11 ILE A 203 14.134 -1.912 -0.069 1.00 0.52 H new ATOM 0 HD12 ILE A 203 13.341 -3.158 0.923 1.00 0.52 H new ATOM 0 HD13 ILE A 203 12.795 -1.467 1.015 1.00 0.52 H new ATOM 3234 N LYS A 204 15.243 -4.162 5.537 1.00 0.47 N ATOM 3235 CA LYS A 204 16.420 -4.662 6.220 1.00 0.63 C ATOM 3236 C LYS A 204 16.281 -6.150 6.442 1.00 0.64 C ATOM 3237 O LYS A 204 17.261 -6.875 6.492 1.00 0.78 O ATOM 3238 CB LYS A 204 16.654 -3.936 7.532 1.00 0.74 C ATOM 3239 CG LYS A 204 15.563 -4.130 8.551 1.00 1.21 C ATOM 3240 CD LYS A 204 16.109 -3.856 9.923 1.00 1.55 C ATOM 3241 CE LYS A 204 15.141 -4.300 11.004 1.00 2.41 C ATOM 3242 NZ LYS A 204 15.690 -4.084 12.366 1.00 3.37 N ATOM 0 H LYS A 204 14.531 -3.766 6.151 1.00 0.47 H new ATOM 0 HA LYS A 204 17.291 -4.474 5.592 1.00 0.63 H new ATOM 0 HB2 LYS A 204 17.598 -4.276 7.958 1.00 0.74 H new ATOM 0 HB3 LYS A 204 16.761 -2.870 7.330 1.00 0.74 H new ATOM 0 HG2 LYS A 204 14.729 -3.461 8.339 1.00 1.21 H new ATOM 0 HG3 LYS A 204 15.177 -5.148 8.498 1.00 1.21 H new ATOM 0 HD2 LYS A 204 17.059 -4.375 10.048 1.00 1.55 H new ATOM 0 HD3 LYS A 204 16.311 -2.790 10.029 1.00 1.55 H new ATOM 0 HE2 LYS A 204 14.205 -3.752 10.900 1.00 2.41 H new ATOM 0 HE3 LYS A 204 14.908 -5.356 10.870 1.00 2.41 H new ATOM 0 HZ1 LYS A 204 14.997 -4.401 13.074 1.00 3.37 H new ATOM 0 HZ2 LYS A 204 16.570 -4.627 12.476 1.00 3.37 H new ATOM 0 HZ3 LYS A 204 15.888 -3.072 12.504 1.00 3.37 H new ATOM 3256 N ALA A 205 15.044 -6.591 6.556 1.00 0.57 N ATOM 3257 CA ALA A 205 14.722 -8.005 6.565 1.00 0.69 C ATOM 3258 C ALA A 205 15.095 -8.614 5.227 1.00 0.87 C ATOM 3259 O ALA A 205 15.478 -9.779 5.135 1.00 1.02 O ATOM 3260 CB ALA A 205 13.239 -8.192 6.828 1.00 0.68 C ATOM 0 H ALA A 205 14.233 -5.979 6.645 1.00 0.57 H new ATOM 0 HA ALA A 205 15.285 -8.502 7.355 1.00 0.69 H new ATOM 0 HB1 ALA A 205 13.002 -9.256 6.834 1.00 0.68 H new ATOM 0 HB2 ALA A 205 12.983 -7.758 7.795 1.00 0.68 H new ATOM 0 HB3 ALA A 205 12.665 -7.697 6.045 1.00 0.68 H new ATOM 3266 N HIS A 206 14.949 -7.813 4.180 1.00 0.89 N ATOM 3267 CA HIS A 206 15.351 -8.231 2.844 1.00 1.11 C ATOM 3268 C HIS A 206 16.775 -7.790 2.510 1.00 1.21 C ATOM 3269 O HIS A 206 17.279 -8.092 1.426 1.00 1.52 O ATOM 3270 CB HIS A 206 14.370 -7.686 1.808 1.00 1.29 C ATOM 3271 CG HIS A 206 13.136 -8.536 1.677 1.00 2.13 C ATOM 3272 ND1 HIS A 206 12.635 -8.959 0.465 1.00 2.83 N ATOM 3273 CD2 HIS A 206 12.325 -9.070 2.621 1.00 2.92 C ATOM 3274 CE1 HIS A 206 11.574 -9.719 0.669 1.00 3.56 C ATOM 3275 NE2 HIS A 206 11.362 -9.805 1.973 1.00 3.63 N ATOM 0 H HIS A 206 14.556 -6.873 4.230 1.00 0.89 H new ATOM 0 HA HIS A 206 15.335 -9.321 2.820 1.00 1.11 H new ATOM 0 HB2 HIS A 206 14.081 -6.672 2.085 1.00 1.29 H new ATOM 0 HB3 HIS A 206 14.867 -7.622 0.840 1.00 1.29 H new ATOM 0 HD1 HIS A 206 13.023 -8.722 -0.448 1.00 2.83 H new ATOM 0 HD2 HIS A 206 12.418 -8.941 3.689 1.00 2.92 H new ATOM 0 HE1 HIS A 206 10.979 -10.191 -0.099 1.00 3.56 H new ATOM 3284 N ARG A 207 17.412 -7.076 3.428 1.00 1.11 N ATOM 3285 CA ARG A 207 18.776 -6.606 3.223 1.00 1.23 C ATOM 3286 C ARG A 207 19.747 -7.475 4.016 1.00 1.36 C ATOM 3287 O ARG A 207 20.702 -8.020 3.462 1.00 1.67 O ATOM 3288 CB ARG A 207 18.888 -5.136 3.648 1.00 1.20 C ATOM 3289 CG ARG A 207 20.027 -4.366 2.998 1.00 1.41 C ATOM 3290 CD ARG A 207 21.373 -4.705 3.610 1.00 1.49 C ATOM 3291 NE ARG A 207 22.421 -3.807 3.130 1.00 1.73 N ATOM 3292 CZ ARG A 207 23.644 -4.202 2.778 1.00 2.04 C ATOM 3293 NH1 ARG A 207 23.963 -5.493 2.797 1.00 2.47 N ATOM 3294 NH2 ARG A 207 24.549 -3.303 2.403 1.00 2.59 N ATOM 0 H ARG A 207 17.005 -6.809 4.324 1.00 1.11 H new ATOM 0 HA ARG A 207 19.031 -6.680 2.166 1.00 1.23 H new ATOM 0 HB2 ARG A 207 17.949 -4.633 3.415 1.00 1.20 H new ATOM 0 HB3 ARG A 207 19.012 -5.094 4.730 1.00 1.20 H new ATOM 0 HG2 ARG A 207 20.050 -4.587 1.931 1.00 1.41 H new ATOM 0 HG3 ARG A 207 19.844 -3.296 3.099 1.00 1.41 H new ATOM 0 HD2 ARG A 207 21.307 -4.641 4.696 1.00 1.49 H new ATOM 0 HD3 ARG A 207 21.635 -5.735 3.367 1.00 1.49 H new ATOM 0 HE ARG A 207 22.202 -2.813 3.060 1.00 1.73 H new ATOM 0 HH11 ARG A 207 23.270 -6.185 3.082 1.00 2.47 H new ATOM 0 HH12 ARG A 207 24.900 -5.791 2.527 1.00 2.47 H new ATOM 0 HH21 ARG A 207 24.307 -2.312 2.385 1.00 2.59 H new ATOM 0 HH22 ARG A 207 25.486 -3.604 2.133 1.00 2.59 H new ATOM 3308 N THR A 208 19.499 -7.594 5.313 1.00 1.20 N ATOM 3309 CA THR A 208 20.307 -8.446 6.169 1.00 1.41 C ATOM 3310 C THR A 208 19.548 -9.752 6.416 1.00 1.48 C ATOM 3311 O THR A 208 18.316 -9.761 6.408 1.00 1.35 O ATOM 3312 CB THR A 208 20.653 -7.746 7.518 1.00 1.37 C ATOM 3313 OG1 THR A 208 21.696 -8.452 8.204 1.00 1.84 O ATOM 3314 CG2 THR A 208 19.440 -7.646 8.430 1.00 1.53 C ATOM 0 H THR A 208 18.742 -7.109 5.795 1.00 1.20 H new ATOM 0 HA THR A 208 21.253 -8.654 5.670 1.00 1.41 H new ATOM 0 HB THR A 208 20.989 -6.738 7.273 1.00 1.37 H new ATOM 0 HG1 THR A 208 21.900 -7.996 9.047 1.00 1.84 H new ATOM 0 HG21 THR A 208 19.723 -7.152 9.359 1.00 1.53 H new ATOM 0 HG22 THR A 208 18.659 -7.068 7.935 1.00 1.53 H new ATOM 0 HG23 THR A 208 19.067 -8.646 8.650 1.00 1.53 H new ATOM 3322 N PRO A 209 20.257 -10.879 6.598 1.00 1.78 N ATOM 3323 CA PRO A 209 19.624 -12.177 6.865 1.00 1.95 C ATOM 3324 C PRO A 209 18.972 -12.255 8.251 1.00 1.87 C ATOM 3325 O PRO A 209 19.138 -13.238 8.971 1.00 2.12 O ATOM 3326 CB PRO A 209 20.788 -13.168 6.765 1.00 2.33 C ATOM 3327 CG PRO A 209 22.003 -12.359 7.061 1.00 2.35 C ATOM 3328 CD PRO A 209 21.725 -10.984 6.528 1.00 2.03 C ATOM 0 HA PRO A 209 18.810 -12.375 6.167 1.00 1.95 H new ATOM 0 HB2 PRO A 209 20.674 -13.985 7.477 1.00 2.33 H new ATOM 0 HB3 PRO A 209 20.843 -13.615 5.772 1.00 2.33 H new ATOM 0 HG2 PRO A 209 22.200 -12.329 8.133 1.00 2.35 H new ATOM 0 HG3 PRO A 209 22.884 -12.791 6.586 1.00 2.35 H new ATOM 0 HD2 PRO A 209 22.212 -10.215 7.128 1.00 2.03 H new ATOM 0 HD3 PRO A 209 22.088 -10.868 5.507 1.00 2.03 H new ATOM 3336 N SER A 210 18.212 -11.226 8.606 1.00 1.76 N ATOM 3337 CA SER A 210 17.528 -11.180 9.889 1.00 1.78 C ATOM 3338 C SER A 210 16.271 -12.041 9.832 1.00 1.74 C ATOM 3339 O SER A 210 15.708 -12.423 10.860 1.00 2.01 O ATOM 3340 CB SER A 210 17.176 -9.733 10.242 1.00 1.85 C ATOM 3341 OG SER A 210 16.286 -9.176 9.290 1.00 2.31 O ATOM 0 H SER A 210 18.054 -10.408 8.018 1.00 1.76 H new ATOM 0 HA SER A 210 18.186 -11.573 10.664 1.00 1.78 H new ATOM 0 HB2 SER A 210 16.722 -9.697 11.232 1.00 1.85 H new ATOM 0 HB3 SER A 210 18.086 -9.135 10.287 1.00 1.85 H new ATOM 0 HG SER A 210 16.076 -8.252 9.540 1.00 2.31 H new ATOM 3347 N ARG A 211 15.844 -12.347 8.612 1.00 1.75 N ATOM 3348 CA ARG A 211 14.711 -13.231 8.383 1.00 1.94 C ATOM 3349 C ARG A 211 15.070 -14.675 8.711 1.00 2.32 C ATOM 3350 O ARG A 211 14.187 -15.521 8.849 1.00 2.55 O ATOM 3351 CB ARG A 211 14.233 -13.116 6.933 1.00 2.31 C ATOM 3352 CG ARG A 211 13.196 -12.026 6.722 1.00 2.60 C ATOM 3353 CD ARG A 211 11.815 -12.481 7.174 1.00 3.06 C ATOM 3354 NE ARG A 211 11.182 -13.358 6.190 1.00 3.80 N ATOM 3355 CZ ARG A 211 11.135 -14.691 6.271 1.00 4.56 C ATOM 3356 NH1 ARG A 211 11.668 -15.329 7.309 1.00 4.78 N ATOM 3357 NH2 ARG A 211 10.547 -15.381 5.306 1.00 5.45 N ATOM 0 H ARG A 211 16.273 -11.990 7.758 1.00 1.75 H new ATOM 0 HA ARG A 211 13.901 -12.925 9.046 1.00 1.94 H new ATOM 0 HB2 ARG A 211 15.091 -12.920 6.290 1.00 2.31 H new ATOM 0 HB3 ARG A 211 13.813 -14.072 6.620 1.00 2.31 H new ATOM 0 HG2 ARG A 211 13.486 -11.133 7.276 1.00 2.60 H new ATOM 0 HG3 ARG A 211 13.164 -11.751 5.668 1.00 2.60 H new ATOM 0 HD2 ARG A 211 11.899 -13.004 8.126 1.00 3.06 H new ATOM 0 HD3 ARG A 211 11.183 -11.609 7.344 1.00 3.06 H new ATOM 0 HE ARG A 211 10.743 -12.919 5.381 1.00 3.80 H new ATOM 0 HH11 ARG A 211 12.119 -14.800 8.055 1.00 4.78 H new ATOM 0 HH12 ARG A 211 11.625 -16.347 7.359 1.00 4.78 H new ATOM 0 HH21 ARG A 211 10.135 -14.895 4.510 1.00 5.45 H new ATOM 0 HH22 ARG A 211 10.506 -16.399 5.359 1.00 5.45 H new ATOM 3371 N ARG A 212 16.363 -14.947 8.845 1.00 2.62 N ATOM 3372 CA ARG A 212 16.827 -16.267 9.253 1.00 3.26 C ATOM 3373 C ARG A 212 16.322 -16.575 10.660 1.00 3.32 C ATOM 3374 O ARG A 212 15.815 -17.663 10.930 1.00 3.71 O ATOM 3375 CB ARG A 212 18.355 -16.329 9.206 1.00 3.80 C ATOM 3376 CG ARG A 212 18.931 -17.681 9.592 1.00 4.37 C ATOM 3377 CD ARG A 212 20.450 -17.662 9.566 1.00 4.99 C ATOM 3378 NE ARG A 212 21.022 -18.942 9.975 1.00 5.44 N ATOM 3379 CZ ARG A 212 22.230 -19.079 10.517 1.00 6.24 C ATOM 3380 NH1 ARG A 212 23.005 -18.017 10.710 1.00 6.66 N ATOM 3381 NH2 ARG A 212 22.670 -20.280 10.868 1.00 6.86 N ATOM 0 H ARG A 212 17.108 -14.271 8.677 1.00 2.62 H new ATOM 0 HA ARG A 212 16.433 -17.014 8.564 1.00 3.26 H new ATOM 0 HB2 ARG A 212 18.688 -16.078 8.199 1.00 3.80 H new ATOM 0 HB3 ARG A 212 18.760 -15.569 9.874 1.00 3.80 H new ATOM 0 HG2 ARG A 212 18.586 -17.954 10.589 1.00 4.37 H new ATOM 0 HG3 ARG A 212 18.563 -18.445 8.907 1.00 4.37 H new ATOM 0 HD2 ARG A 212 20.792 -17.417 8.560 1.00 4.99 H new ATOM 0 HD3 ARG A 212 20.814 -16.875 10.227 1.00 4.99 H new ATOM 0 HE ARG A 212 20.461 -19.783 9.837 1.00 5.44 H new ATOM 0 HH11 ARG A 212 22.675 -17.090 10.442 1.00 6.66 H new ATOM 0 HH12 ARG A 212 23.930 -18.129 11.126 1.00 6.66 H new ATOM 0 HH21 ARG A 212 22.082 -21.101 10.723 1.00 6.86 H new ATOM 0 HH22 ARG A 212 23.596 -20.383 11.283 1.00 6.86 H new ATOM 3395 N GLY A 213 16.446 -15.595 11.543 1.00 3.12 N ATOM 3396 CA GLY A 213 15.935 -15.736 12.891 1.00 3.37 C ATOM 3397 C GLY A 213 14.643 -14.969 13.075 1.00 2.92 C ATOM 3398 O GLY A 213 14.382 -14.417 14.142 1.00 3.19 O ATOM 0 H GLY A 213 16.894 -14.700 11.348 1.00 3.12 H new ATOM 0 HA2 GLY A 213 15.768 -16.791 13.110 1.00 3.37 H new ATOM 0 HA3 GLY A 213 16.678 -15.376 13.603 1.00 3.37 H new ATOM 3402 N PHE A 214 13.839 -14.930 12.022 1.00 2.56 N ATOM 3403 CA PHE A 214 12.575 -14.208 12.043 1.00 2.44 C ATOM 3404 C PHE A 214 11.447 -15.132 12.491 1.00 2.70 C ATOM 3405 O PHE A 214 11.428 -16.310 12.124 1.00 3.00 O ATOM 3406 CB PHE A 214 12.274 -13.655 10.647 1.00 2.65 C ATOM 3407 CG PHE A 214 11.020 -12.827 10.560 1.00 3.21 C ATOM 3408 CD1 PHE A 214 11.035 -11.487 10.911 1.00 3.82 C ATOM 3409 CD2 PHE A 214 9.828 -13.388 10.123 1.00 3.73 C ATOM 3410 CE1 PHE A 214 9.889 -10.722 10.832 1.00 4.85 C ATOM 3411 CE2 PHE A 214 8.679 -12.626 10.041 1.00 4.67 C ATOM 3412 CZ PHE A 214 8.709 -11.292 10.396 1.00 5.21 C ATOM 0 H PHE A 214 14.042 -15.394 11.136 1.00 2.56 H new ATOM 0 HA PHE A 214 12.651 -13.381 12.749 1.00 2.44 H new ATOM 0 HB2 PHE A 214 13.118 -13.048 10.321 1.00 2.65 H new ATOM 0 HB3 PHE A 214 12.193 -14.489 9.950 1.00 2.65 H new ATOM 0 HD1 PHE A 214 11.955 -11.035 11.251 1.00 3.82 H new ATOM 0 HD2 PHE A 214 9.799 -14.431 9.844 1.00 3.73 H new ATOM 0 HE1 PHE A 214 9.915 -9.679 11.111 1.00 4.85 H new ATOM 0 HE2 PHE A 214 7.757 -13.073 9.699 1.00 4.67 H new ATOM 0 HZ PHE A 214 7.811 -10.695 10.333 1.00 5.21 H new ATOM 3422 N HIS A 215 10.517 -14.599 13.288 1.00 2.97 N ATOM 3423 CA HIS A 215 9.322 -15.348 13.684 1.00 3.39 C ATOM 3424 C HIS A 215 8.445 -15.596 12.467 1.00 3.17 C ATOM 3425 O HIS A 215 7.557 -14.804 12.155 1.00 3.66 O ATOM 3426 CB HIS A 215 8.505 -14.595 14.743 1.00 4.23 C ATOM 3427 CG HIS A 215 9.153 -14.501 16.088 1.00 4.93 C ATOM 3428 ND1 HIS A 215 9.103 -13.364 16.865 1.00 5.70 N ATOM 3429 CD2 HIS A 215 9.839 -15.417 16.812 1.00 5.40 C ATOM 3430 CE1 HIS A 215 9.730 -13.584 18.005 1.00 6.46 C ATOM 3431 NE2 HIS A 215 10.185 -14.821 17.998 1.00 6.32 N ATOM 0 H HIS A 215 10.568 -13.655 13.671 1.00 2.97 H new ATOM 0 HA HIS A 215 9.653 -16.294 14.113 1.00 3.39 H new ATOM 0 HB2 HIS A 215 8.308 -13.587 14.379 1.00 4.23 H new ATOM 0 HB3 HIS A 215 7.539 -15.088 14.855 1.00 4.23 H new ATOM 0 HD2 HIS A 215 10.071 -16.428 16.512 1.00 5.40 H new ATOM 0 HE1 HIS A 215 9.850 -12.871 18.808 1.00 6.46 H new ATOM 0 HE2 HIS A 215 10.710 -15.264 18.753 1.00 6.32 H new ATOM 3440 N HIS A 216 8.704 -16.690 11.778 1.00 2.99 N ATOM 3441 CA HIS A 216 7.994 -16.998 10.550 1.00 3.27 C ATOM 3442 C HIS A 216 6.726 -17.788 10.840 1.00 3.26 C ATOM 3443 O HIS A 216 6.773 -18.968 11.191 1.00 3.78 O ATOM 3444 CB HIS A 216 8.908 -17.739 9.558 1.00 3.92 C ATOM 3445 CG HIS A 216 9.639 -18.918 10.133 1.00 4.66 C ATOM 3446 ND1 HIS A 216 10.793 -18.798 10.880 1.00 5.31 N ATOM 3447 CD2 HIS A 216 9.381 -20.245 10.059 1.00 5.27 C ATOM 3448 CE1 HIS A 216 11.210 -19.997 11.237 1.00 6.09 C ATOM 3449 NE2 HIS A 216 10.370 -20.893 10.755 1.00 6.09 N ATOM 0 H HIS A 216 9.402 -17.383 12.048 1.00 2.99 H new ATOM 0 HA HIS A 216 7.696 -16.059 10.083 1.00 3.27 H new ATOM 0 HB2 HIS A 216 8.306 -18.079 8.715 1.00 3.92 H new ATOM 0 HB3 HIS A 216 9.639 -17.034 9.163 1.00 3.92 H new ATOM 0 HD1 HIS A 216 11.252 -17.919 11.119 1.00 5.31 H new ATOM 0 HD2 HIS A 216 8.550 -20.708 9.547 1.00 5.27 H new ATOM 0 HE1 HIS A 216 12.091 -20.210 11.825 1.00 6.09 H new ATOM 3458 N ASN A 217 5.595 -17.113 10.715 1.00 3.18 N ATOM 3459 CA ASN A 217 4.297 -17.722 10.968 1.00 3.63 C ATOM 3460 C ASN A 217 3.874 -18.591 9.790 1.00 4.03 C ATOM 3461 O ASN A 217 3.743 -18.107 8.664 1.00 4.27 O ATOM 3462 CB ASN A 217 3.252 -16.635 11.225 1.00 3.95 C ATOM 3463 CG ASN A 217 1.875 -17.203 11.516 1.00 4.57 C ATOM 3464 OD1 ASN A 217 1.744 -18.308 12.043 1.00 5.00 O ATOM 3465 ND2 ASN A 217 0.842 -16.448 11.182 1.00 5.12 N ATOM 0 H ASN A 217 5.549 -16.133 10.437 1.00 3.18 H new ATOM 0 HA ASN A 217 4.376 -18.356 11.851 1.00 3.63 H new ATOM 0 HB2 ASN A 217 3.572 -16.021 12.066 1.00 3.95 H new ATOM 0 HB3 ASN A 217 3.194 -15.980 10.356 1.00 3.95 H new ATOM 0 HD21 ASN A 217 -0.108 -16.775 11.359 1.00 5.12 H new ATOM 0 HD22 ASN A 217 0.995 -15.538 10.747 1.00 5.12 H new ATOM 3472 N SER A 218 3.682 -19.873 10.057 1.00 4.58 N ATOM 3473 CA SER A 218 3.295 -20.824 9.030 1.00 5.38 C ATOM 3474 C SER A 218 1.780 -20.869 8.853 1.00 5.75 C ATOM 3475 O SER A 218 1.271 -20.786 7.734 1.00 6.25 O ATOM 3476 CB SER A 218 3.837 -22.213 9.382 1.00 6.28 C ATOM 3477 OG SER A 218 3.599 -22.524 10.750 1.00 6.76 O ATOM 0 H SER A 218 3.789 -20.281 10.986 1.00 4.58 H new ATOM 0 HA SER A 218 3.725 -20.499 8.082 1.00 5.38 H new ATOM 0 HB2 SER A 218 3.364 -22.963 8.748 1.00 6.28 H new ATOM 0 HB3 SER A 218 4.907 -22.252 9.178 1.00 6.28 H new ATOM 0 HG SER A 218 3.953 -23.416 10.949 1.00 6.76 H new ATOM 3483 N HIS A 219 1.060 -20.990 9.959 1.00 5.79 N ATOM 3484 CA HIS A 219 -0.388 -21.106 9.912 1.00 6.41 C ATOM 3485 C HIS A 219 -1.002 -20.450 11.141 1.00 6.51 C ATOM 3486 O HIS A 219 -0.523 -20.664 12.253 1.00 6.61 O ATOM 3487 CB HIS A 219 -0.786 -22.585 9.855 1.00 7.04 C ATOM 3488 CG HIS A 219 -2.206 -22.832 9.445 1.00 7.61 C ATOM 3489 ND1 HIS A 219 -3.275 -22.748 10.311 1.00 8.17 N ATOM 3490 CD2 HIS A 219 -2.724 -23.187 8.247 1.00 8.02 C ATOM 3491 CE1 HIS A 219 -4.385 -23.047 9.664 1.00 8.82 C ATOM 3492 NE2 HIS A 219 -4.080 -23.317 8.408 1.00 8.76 N ATOM 0 H HIS A 219 1.456 -21.010 10.899 1.00 5.79 H new ATOM 0 HA HIS A 219 -0.759 -20.601 9.020 1.00 6.41 H new ATOM 0 HB2 HIS A 219 -0.125 -23.099 9.157 1.00 7.04 H new ATOM 0 HB3 HIS A 219 -0.622 -23.030 10.836 1.00 7.04 H new ATOM 0 HD2 HIS A 219 -2.171 -23.340 7.332 1.00 8.02 H new ATOM 0 HE1 HIS A 219 -5.377 -23.068 10.090 1.00 8.82 H new ATOM 0 HE2 HIS A 219 -4.743 -23.579 7.678 1.00 8.76 H new ATOM 3501 N SER A 220 -2.056 -19.664 10.931 1.00 6.83 N ATOM 3502 CA SER A 220 -2.762 -18.984 12.015 1.00 7.31 C ATOM 3503 C SER A 220 -1.853 -17.980 12.734 1.00 7.98 C ATOM 3504 O SER A 220 -1.347 -18.294 13.835 1.00 8.48 O ATOM 3505 CB SER A 220 -3.323 -20.009 13.005 1.00 7.71 C ATOM 3506 OG SER A 220 -4.111 -20.980 12.331 1.00 7.85 O ATOM 3507 OXT SER A 220 -1.653 -16.870 12.191 1.00 8.25 O ATOM 0 H SER A 220 -2.444 -19.481 10.006 1.00 6.83 H new ATOM 0 HA SER A 220 -3.590 -18.424 11.579 1.00 7.31 H new ATOM 0 HB2 SER A 220 -2.504 -20.500 13.531 1.00 7.71 H new ATOM 0 HB3 SER A 220 -3.927 -19.502 13.758 1.00 7.71 H new ATOM 0 HG SER A 220 -3.531 -21.547 11.780 1.00 7.85 H new TER 3513 SER A 220