USER MOD reduce.3.24.130724 H: found=0, std=0, add=1066, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1061 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 112 MET CE :methyl 165:sc= -0.658 (180deg=-1.59!) USER MOD Set 1.2: A 134 HIS : no HE2:sc= -0.355 X(o=-0.97,f=-0.77) USER MOD Set 1.3: A 138 TYR OH : rot 135:sc= 0.048 USER MOD Set 2.1: A 111 HIS : no HD1:sc= -0.344 K(o=1.2,f=1.8) USER MOD Set 2.2: A 115 ASN : amide:sc= 0.525 K(o=1.2,f=-4.3) USER MOD Set 2.3: A 118 LYS NZ :NH3+ -142:sc= 1.01 (180deg=0) USER MOD Set 3.1: A 87 HIS : no HE2:sc= 0.251 K(o=0.65,f=-2.7!) USER MOD Set 3.2: A 94 SER OG : rot 123:sc= 0.395 USER MOD Set 4.1: A 85 THR OG1 : rot -134:sc= 1.33 USER MOD Set 4.2: A 98 GLN : amide:sc= -2.2! C(o=-0.87!,f=-7.5!) USER MOD Set 5.1: A 66 SER OG : rot -19:sc= 0.948 USER MOD Set 5.2: A 69 SER OG : rot -78:sc= 1.78 USER MOD Set 6.1: A 10 GLN : amide:sc= 0.197 X(o=0.055,f=-0.33) USER MOD Set 6.2: A 30 HIS : no HE2:sc= -0.143 K(o=0.055,f=-1.3) USER MOD Single : A 12 HIS : no HE2:sc= -0.473 K(o=-0.47,f=-3.9!) USER MOD Single : A 14 GLN : amide:sc= -4.28! C(o=-4.3!,f=-4.8!) USER MOD Single : A 17 LYS NZ :NH3+ -143:sc= 1.24 (180deg=0.484) USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot -11:sc= 0.647 USER MOD Single : A 28 HIS : no HD1:sc= -0.275 X(o=-0.27,f=-0.2) USER MOD Single : A 29 LYS NZ :NH3+ -177:sc= 1.24 (180deg=1.14) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 SER OG : rot 180:sc= -0.0125 USER MOD Single : A 36 MET CE :methyl 175:sc= -0.118 (180deg=-0.199) USER MOD Single : A 43 TYR OH : rot 34:sc= 1.28 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 GLN : amide:sc= -1.2 K(o=-1.2,f=-0.53) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 LYS NZ :NH3+ 157:sc= -0.0924 (180deg=-0.469) USER MOD Single : A 55 TYR OH : rot 30:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 162:sc= -0.164 (180deg=-0.724) USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 MET CE :methyl -163:sc= -0.0269 (180deg=-0.295) USER MOD Single : A 70 LYS NZ :NH3+ -176:sc= 0.822 (180deg=0.812) USER MOD Single : A 72 ASN : amide:sc= -2.27! C(o=-2.3!,f=-7.8!) USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= -1.55! K(o=-1.5!,f=-0.00098) USER MOD Single : A 84 SER OG : rot 180:sc= -1.68 USER MOD Single : A 99 SER OG : rot 42:sc= 0.0212 USER MOD Single : A 102 GLN : amide:sc= -0.779 X(o=-0.78,f=-0.73) USER MOD Single : A 110 SER OG : rot -9:sc= 1.09 USER MOD Single : A 113 GLN : amide:sc= -1.66! X(o=-1.7!,f=-1.8) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 THR OG1 : rot 77:sc= 1.29 USER MOD Single : A 125 LYS NZ :NH3+ 169:sc= 1.62 (180deg=1.24) USER MOD Single : A 135 MET CE :methyl -113:sc= -0.353 (180deg=-2.6!) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 139 SER OG : rot 180:sc= -0.159 USER MOD ----------------------------------------------------------------- ATOM 97 N GLU A 7 36.411 -4.152 3.272 1.00 0.00 N ATOM 98 CA GLU A 7 35.151 -4.385 3.918 1.00 0.00 C ATOM 99 C GLU A 7 34.008 -3.828 3.083 1.00 0.00 C ATOM 100 O GLU A 7 34.191 -2.839 2.360 1.00 0.00 O ATOM 101 CB GLU A 7 35.146 -3.741 5.295 1.00 0.00 C ATOM 102 CG GLU A 7 36.200 -4.299 6.212 1.00 0.00 C ATOM 103 CD GLU A 7 36.105 -3.753 7.595 1.00 0.00 C ATOM 104 OE1 GLU A 7 35.206 -4.184 8.354 1.00 0.00 O ATOM 105 OE2 GLU A 7 36.944 -2.917 7.977 1.00 0.00 O ATOM 0 HA GLU A 7 35.012 -5.461 4.023 1.00 0.00 H new ATOM 0 HB2 GLU A 7 35.298 -2.667 5.188 1.00 0.00 H new ATOM 0 HB3 GLU A 7 34.166 -3.880 5.751 1.00 0.00 H new ATOM 0 HG2 GLU A 7 36.108 -5.385 6.247 1.00 0.00 H new ATOM 0 HG3 GLU A 7 37.186 -4.076 5.804 1.00 0.00 H new ATOM 112 N PRO A 8 32.818 -4.447 3.155 1.00 0.00 N ATOM 113 CA PRO A 8 31.660 -3.976 2.448 1.00 0.00 C ATOM 114 C PRO A 8 30.875 -2.958 3.272 1.00 0.00 C ATOM 115 O PRO A 8 31.304 -2.543 4.366 1.00 0.00 O ATOM 116 CB PRO A 8 30.821 -5.243 2.233 1.00 0.00 C ATOM 117 CG PRO A 8 31.396 -6.290 3.146 1.00 0.00 C ATOM 118 CD PRO A 8 32.508 -5.648 3.931 1.00 0.00 C ATOM 0 HA PRO A 8 31.925 -3.469 1.520 1.00 0.00 H new ATOM 0 HB2 PRO A 8 29.772 -5.059 2.465 1.00 0.00 H new ATOM 0 HB3 PRO A 8 30.865 -5.567 1.193 1.00 0.00 H new ATOM 0 HG2 PRO A 8 30.628 -6.677 3.816 1.00 0.00 H new ATOM 0 HG3 PRO A 8 31.772 -7.135 2.570 1.00 0.00 H new ATOM 0 HD2 PRO A 8 32.194 -5.402 4.945 1.00 0.00 H new ATOM 0 HD3 PRO A 8 33.373 -6.306 4.016 1.00 0.00 H new ATOM 126 N LEU A 9 29.723 -2.609 2.783 1.00 0.00 N ATOM 127 CA LEU A 9 28.906 -1.598 3.400 1.00 0.00 C ATOM 128 C LEU A 9 27.664 -2.263 3.946 1.00 0.00 C ATOM 129 O LEU A 9 26.906 -2.850 3.186 1.00 0.00 O ATOM 130 CB LEU A 9 28.504 -0.537 2.342 1.00 0.00 C ATOM 131 CG LEU A 9 28.290 0.920 2.826 1.00 0.00 C ATOM 132 CD1 LEU A 9 27.145 1.043 3.820 1.00 0.00 C ATOM 133 CD2 LEU A 9 29.570 1.471 3.422 1.00 0.00 C ATOM 0 H LEU A 9 29.318 -3.017 1.941 1.00 0.00 H new ATOM 0 HA LEU A 9 29.456 -1.107 4.203 1.00 0.00 H new ATOM 0 HB2 LEU A 9 29.274 -0.524 1.571 1.00 0.00 H new ATOM 0 HB3 LEU A 9 27.582 -0.871 1.866 1.00 0.00 H new ATOM 0 HG LEU A 9 28.016 1.510 1.951 1.00 0.00 H new ATOM 0 HD11 LEU A 9 27.039 2.084 4.126 1.00 0.00 H new ATOM 0 HD12 LEU A 9 26.220 0.706 3.353 1.00 0.00 H new ATOM 0 HD13 LEU A 9 27.355 0.427 4.695 1.00 0.00 H new ATOM 0 HD21 LEU A 9 29.404 2.495 3.757 1.00 0.00 H new ATOM 0 HD22 LEU A 9 29.871 0.856 4.270 1.00 0.00 H new ATOM 0 HD23 LEU A 9 30.357 1.459 2.668 1.00 0.00 H new ATOM 145 N GLN A 10 27.498 -2.230 5.242 1.00 0.00 N ATOM 146 CA GLN A 10 26.318 -2.762 5.882 1.00 0.00 C ATOM 147 C GLN A 10 25.177 -1.784 5.762 1.00 0.00 C ATOM 148 O GLN A 10 25.153 -0.750 6.442 1.00 0.00 O ATOM 149 CB GLN A 10 26.570 -3.063 7.345 1.00 0.00 C ATOM 150 CG GLN A 10 27.438 -4.246 7.609 1.00 0.00 C ATOM 151 CD GLN A 10 27.610 -4.509 9.071 1.00 0.00 C ATOM 152 OE1 GLN A 10 28.524 -3.990 9.709 1.00 0.00 O ATOM 153 NE2 GLN A 10 26.745 -5.296 9.613 1.00 0.00 N ATOM 0 H GLN A 10 28.179 -1.832 5.889 1.00 0.00 H new ATOM 0 HA GLN A 10 26.060 -3.693 5.378 1.00 0.00 H new ATOM 0 HB2 GLN A 10 27.027 -2.187 7.806 1.00 0.00 H new ATOM 0 HB3 GLN A 10 25.610 -3.219 7.838 1.00 0.00 H new ATOM 0 HG2 GLN A 10 27.005 -5.125 7.132 1.00 0.00 H new ATOM 0 HG3 GLN A 10 28.415 -4.086 7.154 1.00 0.00 H new ATOM 0 HE21 GLN A 10 26.002 -5.705 9.046 1.00 0.00 H new ATOM 0 HE22 GLN A 10 26.803 -5.510 10.609 1.00 0.00 H new ATOM 162 N VAL A 11 24.269 -2.091 4.902 1.00 0.00 N ATOM 163 CA VAL A 11 23.133 -1.244 4.648 1.00 0.00 C ATOM 164 C VAL A 11 21.904 -1.877 5.239 1.00 0.00 C ATOM 165 O VAL A 11 21.741 -3.101 5.189 1.00 0.00 O ATOM 166 CB VAL A 11 22.841 -1.098 3.134 1.00 0.00 C ATOM 167 CG1 VAL A 11 21.893 0.052 2.851 1.00 0.00 C ATOM 168 CG2 VAL A 11 24.091 -1.010 2.304 1.00 0.00 C ATOM 0 H VAL A 11 24.285 -2.945 4.344 1.00 0.00 H new ATOM 0 HA VAL A 11 23.364 -0.271 5.082 1.00 0.00 H new ATOM 0 HB VAL A 11 22.338 -2.016 2.830 1.00 0.00 H new ATOM 0 HG11 VAL A 11 21.714 0.120 1.778 1.00 0.00 H new ATOM 0 HG12 VAL A 11 20.948 -0.120 3.366 1.00 0.00 H new ATOM 0 HG13 VAL A 11 22.335 0.983 3.205 1.00 0.00 H new ATOM 0 HG21 VAL A 11 23.823 -0.909 1.252 1.00 0.00 H new ATOM 0 HG22 VAL A 11 24.674 -0.143 2.615 1.00 0.00 H new ATOM 0 HG23 VAL A 11 24.684 -1.914 2.442 1.00 0.00 H new ATOM 178 N HIS A 12 21.064 -1.071 5.801 1.00 0.00 N ATOM 179 CA HIS A 12 19.778 -1.507 6.218 1.00 0.00 C ATOM 180 C HIS A 12 18.769 -0.780 5.349 1.00 0.00 C ATOM 181 O HIS A 12 18.497 0.402 5.541 1.00 0.00 O ATOM 182 CB HIS A 12 19.523 -1.238 7.704 1.00 0.00 C ATOM 183 CG HIS A 12 18.244 -1.855 8.191 1.00 0.00 C ATOM 184 ND1 HIS A 12 17.059 -1.170 8.351 1.00 0.00 N ATOM 185 CD2 HIS A 12 17.982 -3.131 8.543 1.00 0.00 C ATOM 186 CE1 HIS A 12 16.140 -2.027 8.781 1.00 0.00 C ATOM 187 NE2 HIS A 12 16.648 -3.238 8.915 1.00 0.00 N ATOM 0 H HIS A 12 21.255 -0.086 5.984 1.00 0.00 H new ATOM 0 HA HIS A 12 19.695 -2.588 6.101 1.00 0.00 H new ATOM 0 HB2 HIS A 12 20.356 -1.629 8.288 1.00 0.00 H new ATOM 0 HB3 HIS A 12 19.491 -0.162 7.874 1.00 0.00 H new ATOM 0 HD1 HIS A 12 16.913 -0.177 8.170 1.00 0.00 H new ATOM 0 HD2 HIS A 12 18.696 -3.941 8.537 1.00 0.00 H new ATOM 0 HE1 HIS A 12 15.113 -1.768 8.993 1.00 0.00 H new ATOM 195 N VAL A 13 18.286 -1.462 4.372 1.00 0.00 N ATOM 196 CA VAL A 13 17.370 -0.918 3.420 1.00 0.00 C ATOM 197 C VAL A 13 15.952 -1.334 3.748 1.00 0.00 C ATOM 198 O VAL A 13 15.643 -2.517 3.904 1.00 0.00 O ATOM 199 CB VAL A 13 17.806 -1.251 1.950 1.00 0.00 C ATOM 200 CG1 VAL A 13 18.017 -2.727 1.716 1.00 0.00 C ATOM 201 CG2 VAL A 13 16.828 -0.717 0.942 1.00 0.00 C ATOM 0 H VAL A 13 18.520 -2.440 4.204 1.00 0.00 H new ATOM 0 HA VAL A 13 17.392 0.170 3.488 1.00 0.00 H new ATOM 0 HB VAL A 13 18.766 -0.752 1.815 1.00 0.00 H new ATOM 0 HG11 VAL A 13 18.317 -2.892 0.681 1.00 0.00 H new ATOM 0 HG12 VAL A 13 18.798 -3.093 2.383 1.00 0.00 H new ATOM 0 HG13 VAL A 13 17.089 -3.263 1.915 1.00 0.00 H new ATOM 0 HG21 VAL A 13 17.167 -0.969 -0.063 1.00 0.00 H new ATOM 0 HG22 VAL A 13 15.848 -1.160 1.116 1.00 0.00 H new ATOM 0 HG23 VAL A 13 16.759 0.366 1.041 1.00 0.00 H new ATOM 211 N GLN A 14 15.137 -0.344 3.937 1.00 0.00 N ATOM 212 CA GLN A 14 13.766 -0.506 4.285 1.00 0.00 C ATOM 213 C GLN A 14 12.970 -0.293 3.012 1.00 0.00 C ATOM 214 O GLN A 14 13.137 0.728 2.322 1.00 0.00 O ATOM 215 CB GLN A 14 13.435 0.524 5.392 1.00 0.00 C ATOM 216 CG GLN A 14 12.104 0.357 6.130 1.00 0.00 C ATOM 217 CD GLN A 14 10.896 0.775 5.335 1.00 0.00 C ATOM 218 OE1 GLN A 14 10.304 -0.013 4.640 1.00 0.00 O ATOM 219 NE2 GLN A 14 10.516 2.012 5.458 1.00 0.00 N ATOM 0 H GLN A 14 15.421 0.632 3.849 1.00 0.00 H new ATOM 0 HA GLN A 14 13.525 -1.493 4.681 1.00 0.00 H new ATOM 0 HB2 GLN A 14 14.236 0.495 6.130 1.00 0.00 H new ATOM 0 HB3 GLN A 14 13.450 1.518 4.944 1.00 0.00 H new ATOM 0 HG2 GLN A 14 11.991 -0.688 6.418 1.00 0.00 H new ATOM 0 HG3 GLN A 14 12.137 0.939 7.051 1.00 0.00 H new ATOM 0 HE21 GLN A 14 11.042 2.650 6.055 1.00 0.00 H new ATOM 0 HE22 GLN A 14 9.692 2.345 4.957 1.00 0.00 H new ATOM 228 N LEU A 15 12.199 -1.274 2.661 1.00 0.00 N ATOM 229 CA LEU A 15 11.435 -1.252 1.462 1.00 0.00 C ATOM 230 C LEU A 15 9.964 -1.054 1.724 1.00 0.00 C ATOM 231 O LEU A 15 9.340 -1.854 2.425 1.00 0.00 O ATOM 232 CB LEU A 15 11.614 -2.544 0.683 1.00 0.00 C ATOM 233 CG LEU A 15 12.985 -2.838 0.074 1.00 0.00 C ATOM 234 CD1 LEU A 15 13.670 -1.609 -0.489 1.00 0.00 C ATOM 235 CD2 LEU A 15 13.873 -3.606 0.979 1.00 0.00 C ATOM 0 H LEU A 15 12.084 -2.125 3.211 1.00 0.00 H new ATOM 0 HA LEU A 15 11.804 -0.407 0.882 1.00 0.00 H new ATOM 0 HB2 LEU A 15 11.361 -3.371 1.347 1.00 0.00 H new ATOM 0 HB3 LEU A 15 10.883 -2.549 -0.125 1.00 0.00 H new ATOM 0 HG LEU A 15 12.779 -3.486 -0.778 1.00 0.00 H new ATOM 0 HD11 LEU A 15 14.638 -1.890 -0.905 1.00 0.00 H new ATOM 0 HD12 LEU A 15 13.050 -1.174 -1.273 1.00 0.00 H new ATOM 0 HD13 LEU A 15 13.816 -0.877 0.306 1.00 0.00 H new ATOM 0 HD21 LEU A 15 14.830 -3.782 0.487 1.00 0.00 H new ATOM 0 HD22 LEU A 15 14.035 -3.040 1.896 1.00 0.00 H new ATOM 0 HD23 LEU A 15 13.408 -4.562 1.220 1.00 0.00 H new ATOM 247 N GLU A 16 9.415 -0.025 1.142 1.00 0.00 N ATOM 248 CA GLU A 16 8.001 0.241 1.228 1.00 0.00 C ATOM 249 C GLU A 16 7.368 -0.275 -0.034 1.00 0.00 C ATOM 250 O GLU A 16 7.925 -0.116 -1.124 1.00 0.00 O ATOM 251 CB GLU A 16 7.716 1.734 1.316 1.00 0.00 C ATOM 252 CG GLU A 16 8.303 2.450 2.505 1.00 0.00 C ATOM 253 CD GLU A 16 8.082 3.939 2.400 1.00 0.00 C ATOM 254 OE1 GLU A 16 8.662 4.574 1.509 1.00 0.00 O ATOM 255 OE2 GLU A 16 7.318 4.508 3.209 1.00 0.00 O ATOM 0 H GLU A 16 9.936 0.658 0.591 1.00 0.00 H new ATOM 0 HA GLU A 16 7.605 -0.240 2.122 1.00 0.00 H new ATOM 0 HB2 GLU A 16 8.091 2.209 0.409 1.00 0.00 H new ATOM 0 HB3 GLU A 16 6.636 1.877 1.328 1.00 0.00 H new ATOM 0 HG2 GLU A 16 7.848 2.075 3.422 1.00 0.00 H new ATOM 0 HG3 GLU A 16 9.371 2.240 2.570 1.00 0.00 H new ATOM 262 N LYS A 17 6.240 -0.888 0.079 1.00 0.00 N ATOM 263 CA LYS A 17 5.557 -1.400 -1.081 1.00 0.00 C ATOM 264 C LYS A 17 4.152 -0.890 -1.057 1.00 0.00 C ATOM 265 O LYS A 17 3.339 -1.372 -0.290 1.00 0.00 O ATOM 266 CB LYS A 17 5.605 -2.938 -1.108 1.00 0.00 C ATOM 267 CG LYS A 17 7.024 -3.489 -1.176 1.00 0.00 C ATOM 268 CD LYS A 17 7.083 -5.003 -1.060 1.00 0.00 C ATOM 269 CE LYS A 17 8.531 -5.467 -1.093 1.00 0.00 C ATOM 270 NZ LYS A 17 8.689 -6.919 -0.857 1.00 0.00 N ATOM 0 H LYS A 17 5.761 -1.052 0.964 1.00 0.00 H new ATOM 0 HA LYS A 17 6.049 -1.057 -1.991 1.00 0.00 H new ATOM 0 HB2 LYS A 17 5.113 -3.327 -0.217 1.00 0.00 H new ATOM 0 HB3 LYS A 17 5.040 -3.298 -1.967 1.00 0.00 H new ATOM 0 HG2 LYS A 17 7.480 -3.185 -2.118 1.00 0.00 H new ATOM 0 HG3 LYS A 17 7.618 -3.046 -0.376 1.00 0.00 H new ATOM 0 HD2 LYS A 17 6.610 -5.324 -0.132 1.00 0.00 H new ATOM 0 HD3 LYS A 17 6.526 -5.461 -1.877 1.00 0.00 H new ATOM 0 HE2 LYS A 17 8.963 -5.215 -2.061 1.00 0.00 H new ATOM 0 HE3 LYS A 17 9.097 -4.920 -0.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 9.547 -7.088 -0.294 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 7.861 -7.279 -0.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 8.770 -7.412 -1.769 1.00 0.00 H new ATOM 284 N VAL A 18 3.877 0.124 -1.851 1.00 0.00 N ATOM 285 CA VAL A 18 2.575 0.754 -1.816 1.00 0.00 C ATOM 286 C VAL A 18 1.652 0.036 -2.780 1.00 0.00 C ATOM 287 O VAL A 18 1.715 0.246 -3.991 1.00 0.00 O ATOM 288 CB VAL A 18 2.632 2.277 -2.177 1.00 0.00 C ATOM 289 CG1 VAL A 18 1.337 2.984 -1.823 1.00 0.00 C ATOM 290 CG2 VAL A 18 3.846 2.972 -1.552 1.00 0.00 C ATOM 0 H VAL A 18 4.531 0.526 -2.522 1.00 0.00 H new ATOM 0 HA VAL A 18 2.200 0.682 -0.795 1.00 0.00 H new ATOM 0 HB VAL A 18 2.753 2.343 -3.258 1.00 0.00 H new ATOM 0 HG11 VAL A 18 1.414 4.039 -2.088 1.00 0.00 H new ATOM 0 HG12 VAL A 18 0.513 2.531 -2.374 1.00 0.00 H new ATOM 0 HG13 VAL A 18 1.153 2.891 -0.753 1.00 0.00 H new ATOM 0 HG21 VAL A 18 3.844 4.026 -1.829 1.00 0.00 H new ATOM 0 HG22 VAL A 18 3.798 2.882 -0.467 1.00 0.00 H new ATOM 0 HG23 VAL A 18 4.761 2.503 -1.915 1.00 0.00 H new ATOM 300 N TYR A 19 0.854 -0.847 -2.264 1.00 0.00 N ATOM 301 CA TYR A 19 -0.079 -1.591 -3.079 1.00 0.00 C ATOM 302 C TYR A 19 -1.297 -0.752 -3.386 1.00 0.00 C ATOM 303 O TYR A 19 -1.480 0.326 -2.804 1.00 0.00 O ATOM 304 CB TYR A 19 -0.508 -2.862 -2.364 1.00 0.00 C ATOM 305 CG TYR A 19 0.570 -3.905 -2.231 1.00 0.00 C ATOM 306 CD1 TYR A 19 1.513 -3.853 -1.217 1.00 0.00 C ATOM 307 CD2 TYR A 19 0.617 -4.963 -3.106 1.00 0.00 C ATOM 308 CE1 TYR A 19 2.471 -4.832 -1.096 1.00 0.00 C ATOM 309 CE2 TYR A 19 1.557 -5.948 -2.990 1.00 0.00 C ATOM 310 CZ TYR A 19 2.486 -5.881 -1.984 1.00 0.00 C ATOM 311 OH TYR A 19 3.428 -6.872 -1.858 1.00 0.00 O ATOM 0 H TYR A 19 0.824 -1.078 -1.271 1.00 0.00 H new ATOM 0 HA TYR A 19 0.418 -1.854 -4.013 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -0.865 -2.599 -1.368 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -1.351 -3.297 -2.900 1.00 0.00 H new ATOM 0 HD1 TYR A 19 1.495 -3.034 -0.513 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -0.107 -5.018 -3.906 1.00 0.00 H new ATOM 0 HE1 TYR A 19 3.207 -4.777 -0.308 1.00 0.00 H new ATOM 0 HE2 TYR A 19 1.568 -6.774 -3.686 1.00 0.00 H new ATOM 0 HH TYR A 19 3.298 -7.538 -2.565 1.00 0.00 H new ATOM 321 N LEU A 20 -2.139 -1.238 -4.288 1.00 0.00 N ATOM 322 CA LEU A 20 -3.381 -0.545 -4.625 1.00 0.00 C ATOM 323 C LEU A 20 -4.282 -0.602 -3.423 1.00 0.00 C ATOM 324 O LEU A 20 -4.960 0.345 -3.100 1.00 0.00 O ATOM 325 CB LEU A 20 -4.100 -1.244 -5.778 1.00 0.00 C ATOM 326 CG LEU A 20 -3.354 -1.398 -7.093 1.00 0.00 C ATOM 327 CD1 LEU A 20 -4.176 -2.261 -8.029 1.00 0.00 C ATOM 328 CD2 LEU A 20 -3.078 -0.041 -7.723 1.00 0.00 C ATOM 0 H LEU A 20 -1.988 -2.107 -4.800 1.00 0.00 H new ATOM 0 HA LEU A 20 -3.148 0.479 -4.916 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -4.388 -2.239 -5.438 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -5.021 -0.697 -5.978 1.00 0.00 H new ATOM 0 HG LEU A 20 -2.393 -1.876 -6.905 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -3.648 -2.377 -8.975 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -4.331 -3.241 -7.578 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -5.141 -1.787 -8.208 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -2.543 -0.178 -8.663 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -4.022 0.470 -7.914 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -2.471 0.558 -7.044 1.00 0.00 H new ATOM 340 N ASP A 21 -4.221 -1.754 -2.779 1.00 0.00 N ATOM 341 CA ASP A 21 -5.001 -2.122 -1.593 1.00 0.00 C ATOM 342 C ASP A 21 -4.917 -1.096 -0.477 1.00 0.00 C ATOM 343 O ASP A 21 -5.910 -0.773 0.150 1.00 0.00 O ATOM 344 CB ASP A 21 -4.488 -3.464 -1.087 1.00 0.00 C ATOM 345 CG ASP A 21 -5.009 -3.838 0.278 1.00 0.00 C ATOM 346 OD1 ASP A 21 -6.077 -4.463 0.364 1.00 0.00 O ATOM 347 OD2 ASP A 21 -4.304 -3.558 1.258 1.00 0.00 O ATOM 0 H ASP A 21 -3.596 -2.502 -3.079 1.00 0.00 H new ATOM 0 HA ASP A 21 -6.050 -2.174 -1.886 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -4.768 -4.241 -1.798 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -3.399 -3.438 -1.056 1.00 0.00 H new ATOM 352 N GLY A 22 -3.742 -0.589 -0.245 1.00 0.00 N ATOM 353 CA GLY A 22 -3.565 0.330 0.827 1.00 0.00 C ATOM 354 C GLY A 22 -2.514 -0.153 1.769 1.00 0.00 C ATOM 355 O GLY A 22 -1.856 0.644 2.432 1.00 0.00 O ATOM 0 H GLY A 22 -2.901 -0.798 -0.783 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -3.285 1.307 0.432 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -4.507 0.459 1.361 1.00 0.00 H new ATOM 359 N ASP A 23 -2.383 -1.469 1.864 1.00 0.00 N ATOM 360 CA ASP A 23 -1.329 -2.079 2.662 1.00 0.00 C ATOM 361 C ASP A 23 0.007 -1.714 2.089 1.00 0.00 C ATOM 362 O ASP A 23 0.273 -1.956 0.898 1.00 0.00 O ATOM 363 CB ASP A 23 -1.466 -3.614 2.683 1.00 0.00 C ATOM 364 CG ASP A 23 -0.377 -4.327 3.485 1.00 0.00 C ATOM 365 OD1 ASP A 23 0.716 -4.615 2.934 1.00 0.00 O ATOM 366 OD2 ASP A 23 -0.613 -4.664 4.675 1.00 0.00 O ATOM 0 H ASP A 23 -2.996 -2.137 1.396 1.00 0.00 H new ATOM 0 HA ASP A 23 -1.416 -1.708 3.683 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -2.439 -3.876 3.099 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -1.448 -3.984 1.658 1.00 0.00 H new ATOM 371 N VAL A 24 0.809 -1.062 2.866 1.00 0.00 N ATOM 372 CA VAL A 24 2.142 -0.819 2.450 1.00 0.00 C ATOM 373 C VAL A 24 2.995 -1.771 3.210 1.00 0.00 C ATOM 374 O VAL A 24 3.079 -1.702 4.441 1.00 0.00 O ATOM 375 CB VAL A 24 2.622 0.632 2.720 1.00 0.00 C ATOM 376 CG1 VAL A 24 4.002 0.866 2.116 1.00 0.00 C ATOM 377 CG2 VAL A 24 1.620 1.652 2.205 1.00 0.00 C ATOM 0 H VAL A 24 0.563 -0.693 3.784 1.00 0.00 H new ATOM 0 HA VAL A 24 2.206 -0.955 1.370 1.00 0.00 H new ATOM 0 HB VAL A 24 2.697 0.763 3.799 1.00 0.00 H new ATOM 0 HG11 VAL A 24 4.319 1.889 2.317 1.00 0.00 H new ATOM 0 HG12 VAL A 24 4.716 0.172 2.559 1.00 0.00 H new ATOM 0 HG13 VAL A 24 3.960 0.705 1.039 1.00 0.00 H new ATOM 0 HG21 VAL A 24 1.987 2.658 2.410 1.00 0.00 H new ATOM 0 HG22 VAL A 24 1.491 1.525 1.130 1.00 0.00 H new ATOM 0 HG23 VAL A 24 0.663 1.506 2.705 1.00 0.00 H new ATOM 387 N SER A 25 3.596 -2.665 2.515 1.00 0.00 N ATOM 388 CA SER A 25 4.428 -3.629 3.135 1.00 0.00 C ATOM 389 C SER A 25 5.783 -3.028 3.412 1.00 0.00 C ATOM 390 O SER A 25 6.411 -2.472 2.518 1.00 0.00 O ATOM 391 CB SER A 25 4.542 -4.839 2.252 1.00 0.00 C ATOM 392 OG SER A 25 3.253 -5.363 1.929 1.00 0.00 O ATOM 0 H SER A 25 3.526 -2.750 1.501 1.00 0.00 H new ATOM 0 HA SER A 25 3.991 -3.938 4.085 1.00 0.00 H new ATOM 0 HB2 SER A 25 5.071 -4.576 1.336 1.00 0.00 H new ATOM 0 HB3 SER A 25 5.134 -5.605 2.754 1.00 0.00 H new ATOM 0 HG SER A 25 2.576 -4.938 2.495 1.00 0.00 H new ATOM 398 N ILE A 26 6.191 -3.103 4.648 1.00 0.00 N ATOM 399 CA ILE A 26 7.453 -2.573 5.083 1.00 0.00 C ATOM 400 C ILE A 26 8.413 -3.729 5.270 1.00 0.00 C ATOM 401 O ILE A 26 8.229 -4.566 6.159 1.00 0.00 O ATOM 402 CB ILE A 26 7.275 -1.777 6.411 1.00 0.00 C ATOM 403 CG1 ILE A 26 6.287 -0.614 6.218 1.00 0.00 C ATOM 404 CG2 ILE A 26 8.598 -1.270 6.954 1.00 0.00 C ATOM 405 CD1 ILE A 26 6.659 0.351 5.111 1.00 0.00 C ATOM 0 H ILE A 26 5.648 -3.541 5.393 1.00 0.00 H new ATOM 0 HA ILE A 26 7.851 -1.884 4.338 1.00 0.00 H new ATOM 0 HB ILE A 26 6.866 -2.467 7.149 1.00 0.00 H new ATOM 0 HG12 ILE A 26 5.299 -1.024 6.008 1.00 0.00 H new ATOM 0 HG13 ILE A 26 6.210 -0.061 7.154 1.00 0.00 H new ATOM 0 HG21 ILE A 26 8.425 -0.721 7.880 1.00 0.00 H new ATOM 0 HG22 ILE A 26 9.258 -2.115 7.151 1.00 0.00 H new ATOM 0 HG23 ILE A 26 9.062 -0.609 6.222 1.00 0.00 H new ATOM 0 HD11 ILE A 26 5.907 1.138 5.046 1.00 0.00 H new ATOM 0 HD12 ILE A 26 7.631 0.795 5.326 1.00 0.00 H new ATOM 0 HD13 ILE A 26 6.706 -0.184 4.163 1.00 0.00 H new ATOM 417 N GLU A 27 9.398 -3.791 4.431 1.00 0.00 N ATOM 418 CA GLU A 27 10.338 -4.870 4.432 1.00 0.00 C ATOM 419 C GLU A 27 11.720 -4.391 4.847 1.00 0.00 C ATOM 420 O GLU A 27 12.164 -3.351 4.443 1.00 0.00 O ATOM 421 CB GLU A 27 10.323 -5.551 3.048 1.00 0.00 C ATOM 422 CG GLU A 27 11.553 -6.361 2.718 1.00 0.00 C ATOM 423 CD GLU A 27 11.340 -7.347 1.595 1.00 0.00 C ATOM 424 OE1 GLU A 27 11.038 -6.936 0.450 1.00 0.00 O ATOM 425 OE2 GLU A 27 11.517 -8.557 1.830 1.00 0.00 O ATOM 0 H GLU A 27 9.576 -3.085 3.716 1.00 0.00 H new ATOM 0 HA GLU A 27 10.050 -5.615 5.174 1.00 0.00 H new ATOM 0 HB2 GLU A 27 9.452 -6.203 2.991 1.00 0.00 H new ATOM 0 HB3 GLU A 27 10.197 -4.784 2.284 1.00 0.00 H new ATOM 0 HG2 GLU A 27 12.363 -5.684 2.448 1.00 0.00 H new ATOM 0 HG3 GLU A 27 11.873 -6.901 3.609 1.00 0.00 H new ATOM 432 N HIS A 28 12.362 -5.140 5.696 1.00 0.00 N ATOM 433 CA HIS A 28 13.671 -4.774 6.200 1.00 0.00 C ATOM 434 C HIS A 28 14.710 -5.703 5.621 1.00 0.00 C ATOM 435 O HIS A 28 14.622 -6.923 5.780 1.00 0.00 O ATOM 436 CB HIS A 28 13.715 -4.834 7.742 1.00 0.00 C ATOM 437 CG HIS A 28 12.835 -3.829 8.464 1.00 0.00 C ATOM 438 ND1 HIS A 28 13.140 -3.282 9.694 1.00 0.00 N ATOM 439 CD2 HIS A 28 11.632 -3.297 8.118 1.00 0.00 C ATOM 440 CE1 HIS A 28 12.152 -2.464 10.047 1.00 0.00 C ATOM 441 NE2 HIS A 28 11.203 -2.434 9.123 1.00 0.00 N ATOM 0 H HIS A 28 12.002 -6.021 6.063 1.00 0.00 H new ATOM 0 HA HIS A 28 13.881 -3.748 5.897 1.00 0.00 H new ATOM 0 HB2 HIS A 28 13.425 -5.836 8.057 1.00 0.00 H new ATOM 0 HB3 HIS A 28 14.746 -4.685 8.064 1.00 0.00 H new ATOM 0 HD2 HIS A 28 11.094 -3.511 7.206 1.00 0.00 H new ATOM 0 HE1 HIS A 28 12.127 -1.898 10.967 1.00 0.00 H new ATOM 0 HE2 HIS A 28 10.339 -1.892 9.144 1.00 0.00 H new ATOM 449 N LYS A 29 15.646 -5.154 4.922 1.00 0.00 N ATOM 450 CA LYS A 29 16.717 -5.922 4.343 1.00 0.00 C ATOM 451 C LYS A 29 18.026 -5.376 4.854 1.00 0.00 C ATOM 452 O LYS A 29 18.195 -4.167 4.961 1.00 0.00 O ATOM 453 CB LYS A 29 16.735 -5.785 2.822 1.00 0.00 C ATOM 454 CG LYS A 29 15.511 -6.198 2.076 1.00 0.00 C ATOM 455 CD LYS A 29 15.148 -7.636 2.239 1.00 0.00 C ATOM 456 CE LYS A 29 14.659 -8.146 0.915 1.00 0.00 C ATOM 457 NZ LYS A 29 13.961 -9.437 0.995 1.00 0.00 N ATOM 0 H LYS A 29 15.697 -4.154 4.730 1.00 0.00 H new ATOM 0 HA LYS A 29 16.573 -6.968 4.613 1.00 0.00 H new ATOM 0 HB2 LYS A 29 16.939 -4.742 2.581 1.00 0.00 H new ATOM 0 HB3 LYS A 29 17.573 -6.369 2.442 1.00 0.00 H new ATOM 0 HG2 LYS A 29 14.673 -5.584 2.407 1.00 0.00 H new ATOM 0 HG3 LYS A 29 15.658 -5.991 1.016 1.00 0.00 H new ATOM 0 HD2 LYS A 29 16.012 -8.211 2.573 1.00 0.00 H new ATOM 0 HD3 LYS A 29 14.376 -7.750 3.000 1.00 0.00 H new ATOM 0 HE2 LYS A 29 13.987 -7.407 0.478 1.00 0.00 H new ATOM 0 HE3 LYS A 29 15.508 -8.244 0.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 13.698 -9.749 0.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 14.588 -10.144 1.430 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 13.103 -9.332 1.573 1.00 0.00 H new ATOM 471 N HIS A 30 18.920 -6.231 5.184 1.00 0.00 N ATOM 472 CA HIS A 30 20.239 -5.821 5.560 1.00 0.00 C ATOM 473 C HIS A 30 21.171 -6.487 4.614 1.00 0.00 C ATOM 474 O HIS A 30 21.107 -7.713 4.437 1.00 0.00 O ATOM 475 CB HIS A 30 20.574 -6.235 6.983 1.00 0.00 C ATOM 476 CG HIS A 30 21.865 -5.663 7.528 1.00 0.00 C ATOM 477 ND1 HIS A 30 21.925 -4.659 8.465 1.00 0.00 N ATOM 478 CD2 HIS A 30 23.156 -5.989 7.255 1.00 0.00 C ATOM 479 CE1 HIS A 30 23.204 -4.401 8.719 1.00 0.00 C ATOM 480 NE2 HIS A 30 23.999 -5.188 8.011 1.00 0.00 N ATOM 0 H HIS A 30 18.767 -7.239 5.204 1.00 0.00 H new ATOM 0 HA HIS A 30 20.318 -4.735 5.520 1.00 0.00 H new ATOM 0 HB2 HIS A 30 19.756 -5.932 7.636 1.00 0.00 H new ATOM 0 HB3 HIS A 30 20.629 -7.323 7.026 1.00 0.00 H new ATOM 0 HD1 HIS A 30 21.125 -4.192 8.892 1.00 0.00 H new ATOM 0 HD2 HIS A 30 23.475 -6.751 6.559 1.00 0.00 H new ATOM 0 HE1 HIS A 30 23.549 -3.648 9.412 1.00 0.00 H new ATOM 488 N GLU A 31 21.997 -5.734 4.007 1.00 0.00 N ATOM 489 CA GLU A 31 22.918 -6.278 3.077 1.00 0.00 C ATOM 490 C GLU A 31 24.229 -5.568 3.115 1.00 0.00 C ATOM 491 O GLU A 31 24.291 -4.362 3.315 1.00 0.00 O ATOM 492 CB GLU A 31 22.335 -6.297 1.665 1.00 0.00 C ATOM 493 CG GLU A 31 21.941 -4.961 1.073 1.00 0.00 C ATOM 494 CD GLU A 31 21.228 -5.165 -0.239 1.00 0.00 C ATOM 495 OE1 GLU A 31 21.905 -5.483 -1.253 1.00 0.00 O ATOM 496 OE2 GLU A 31 19.979 -5.103 -0.266 1.00 0.00 O ATOM 0 H GLU A 31 22.060 -4.724 4.135 1.00 0.00 H new ATOM 0 HA GLU A 31 23.104 -7.311 3.373 1.00 0.00 H new ATOM 0 HB2 GLU A 31 23.065 -6.761 1.002 1.00 0.00 H new ATOM 0 HB3 GLU A 31 21.455 -6.940 1.669 1.00 0.00 H new ATOM 0 HG2 GLU A 31 21.295 -4.423 1.767 1.00 0.00 H new ATOM 0 HG3 GLU A 31 22.828 -4.346 0.922 1.00 0.00 H new ATOM 503 N LYS A 32 25.270 -6.328 2.996 1.00 0.00 N ATOM 504 CA LYS A 32 26.567 -5.799 2.886 1.00 0.00 C ATOM 505 C LYS A 32 26.920 -5.740 1.454 1.00 0.00 C ATOM 506 O LYS A 32 26.963 -6.762 0.765 1.00 0.00 O ATOM 507 CB LYS A 32 27.593 -6.610 3.627 1.00 0.00 C ATOM 508 CG LYS A 32 27.510 -6.519 5.130 1.00 0.00 C ATOM 509 CD LYS A 32 28.707 -7.187 5.800 1.00 0.00 C ATOM 510 CE LYS A 32 29.013 -8.539 5.185 1.00 0.00 C ATOM 511 NZ LYS A 32 30.088 -9.259 5.901 1.00 0.00 N ATOM 0 H LYS A 32 25.229 -7.347 2.973 1.00 0.00 H new ATOM 0 HA LYS A 32 26.569 -4.807 3.338 1.00 0.00 H new ATOM 0 HB2 LYS A 32 27.489 -7.655 3.335 1.00 0.00 H new ATOM 0 HB3 LYS A 32 28.586 -6.288 3.312 1.00 0.00 H new ATOM 0 HG2 LYS A 32 27.462 -5.472 5.430 1.00 0.00 H new ATOM 0 HG3 LYS A 32 26.590 -6.991 5.473 1.00 0.00 H new ATOM 0 HD2 LYS A 32 29.581 -6.541 5.712 1.00 0.00 H new ATOM 0 HD3 LYS A 32 28.507 -7.309 6.865 1.00 0.00 H new ATOM 0 HE2 LYS A 32 28.109 -9.148 5.187 1.00 0.00 H new ATOM 0 HE3 LYS A 32 29.303 -8.403 4.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 30.258 -10.176 5.441 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 30.960 -8.693 5.878 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 29.803 -9.415 6.889 1.00 0.00 H new ATOM 525 N VAL A 33 27.135 -4.586 1.000 1.00 0.00 N ATOM 526 CA VAL A 33 27.454 -4.373 -0.362 1.00 0.00 C ATOM 527 C VAL A 33 28.788 -3.687 -0.503 1.00 0.00 C ATOM 528 O VAL A 33 29.050 -2.725 0.175 1.00 0.00 O ATOM 529 CB VAL A 33 26.307 -3.625 -1.080 1.00 0.00 C ATOM 530 CG1 VAL A 33 25.723 -2.533 -0.226 1.00 0.00 C ATOM 531 CG2 VAL A 33 26.750 -3.082 -2.389 1.00 0.00 C ATOM 0 H VAL A 33 27.097 -3.736 1.563 1.00 0.00 H new ATOM 0 HA VAL A 33 27.554 -5.339 -0.857 1.00 0.00 H new ATOM 0 HB VAL A 33 25.521 -4.358 -1.261 1.00 0.00 H new ATOM 0 HG11 VAL A 33 24.921 -2.035 -0.771 1.00 0.00 H new ATOM 0 HG12 VAL A 33 25.325 -2.963 0.693 1.00 0.00 H new ATOM 0 HG13 VAL A 33 26.499 -1.808 0.019 1.00 0.00 H new ATOM 0 HG21 VAL A 33 25.920 -2.562 -2.867 1.00 0.00 H new ATOM 0 HG22 VAL A 33 27.573 -2.385 -2.234 1.00 0.00 H new ATOM 0 HG23 VAL A 33 27.083 -3.900 -3.028 1.00 0.00 H new ATOM 541 N PHE A 34 29.646 -4.226 -1.336 1.00 0.00 N ATOM 542 CA PHE A 34 30.957 -3.656 -1.544 1.00 0.00 C ATOM 543 C PHE A 34 30.895 -2.339 -2.296 1.00 0.00 C ATOM 544 O PHE A 34 31.630 -1.427 -1.997 1.00 0.00 O ATOM 545 CB PHE A 34 31.883 -4.621 -2.277 1.00 0.00 C ATOM 546 CG PHE A 34 32.327 -5.809 -1.486 1.00 0.00 C ATOM 547 CD1 PHE A 34 33.155 -5.645 -0.392 1.00 0.00 C ATOM 548 CD2 PHE A 34 31.962 -7.089 -1.860 1.00 0.00 C ATOM 549 CE1 PHE A 34 33.608 -6.735 0.321 1.00 0.00 C ATOM 550 CE2 PHE A 34 32.405 -8.185 -1.148 1.00 0.00 C ATOM 551 CZ PHE A 34 33.230 -8.007 -0.056 1.00 0.00 C ATOM 0 H PHE A 34 29.458 -5.065 -1.885 1.00 0.00 H new ATOM 0 HA PHE A 34 31.364 -3.466 -0.551 1.00 0.00 H new ATOM 0 HB2 PHE A 34 31.376 -4.973 -3.175 1.00 0.00 H new ATOM 0 HB3 PHE A 34 32.766 -4.073 -2.604 1.00 0.00 H new ATOM 0 HD1 PHE A 34 33.451 -4.651 -0.092 1.00 0.00 H new ATOM 0 HD2 PHE A 34 31.323 -7.233 -2.719 1.00 0.00 H new ATOM 0 HE1 PHE A 34 34.257 -6.593 1.172 1.00 0.00 H new ATOM 0 HE2 PHE A 34 32.107 -9.180 -1.445 1.00 0.00 H new ATOM 0 HZ PHE A 34 33.579 -8.863 0.503 1.00 0.00 H new ATOM 561 N SER A 35 30.007 -2.242 -3.241 1.00 0.00 N ATOM 562 CA SER A 35 29.924 -1.064 -4.050 1.00 0.00 C ATOM 563 C SER A 35 28.567 -0.456 -3.913 1.00 0.00 C ATOM 564 O SER A 35 27.579 -1.052 -4.337 1.00 0.00 O ATOM 565 CB SER A 35 30.200 -1.413 -5.522 1.00 0.00 C ATOM 566 OG SER A 35 30.053 -0.281 -6.378 1.00 0.00 O ATOM 0 H SER A 35 29.328 -2.968 -3.470 1.00 0.00 H new ATOM 0 HA SER A 35 30.673 -0.347 -3.715 1.00 0.00 H new ATOM 0 HB2 SER A 35 31.211 -1.810 -5.617 1.00 0.00 H new ATOM 0 HB3 SER A 35 29.517 -2.200 -5.842 1.00 0.00 H new ATOM 0 HG SER A 35 30.238 -0.545 -7.304 1.00 0.00 H new ATOM 572 N MET A 36 28.499 0.742 -3.352 1.00 0.00 N ATOM 573 CA MET A 36 27.218 1.447 -3.200 1.00 0.00 C ATOM 574 C MET A 36 26.501 1.577 -4.524 1.00 0.00 C ATOM 575 O MET A 36 25.288 1.507 -4.587 1.00 0.00 O ATOM 576 CB MET A 36 27.409 2.814 -2.551 1.00 0.00 C ATOM 577 CG MET A 36 27.611 2.744 -1.055 1.00 0.00 C ATOM 578 SD MET A 36 26.195 3.383 -0.122 1.00 0.00 S ATOM 579 CE MET A 36 24.857 2.352 -0.733 1.00 0.00 C ATOM 0 H MET A 36 29.307 1.251 -2.993 1.00 0.00 H new ATOM 0 HA MET A 36 26.594 0.846 -2.538 1.00 0.00 H new ATOM 0 HB2 MET A 36 28.270 3.306 -3.004 1.00 0.00 H new ATOM 0 HB3 MET A 36 26.538 3.434 -2.764 1.00 0.00 H new ATOM 0 HG2 MET A 36 27.793 1.709 -0.766 1.00 0.00 H new ATOM 0 HG3 MET A 36 28.502 3.311 -0.787 1.00 0.00 H new ATOM 0 HE1 MET A 36 23.944 2.575 -0.181 1.00 0.00 H new ATOM 0 HE2 MET A 36 24.698 2.552 -1.793 1.00 0.00 H new ATOM 0 HE3 MET A 36 25.116 1.302 -0.597 1.00 0.00 H new ATOM 589 N ASP A 37 27.276 1.643 -5.578 1.00 0.00 N ATOM 590 CA ASP A 37 26.761 1.777 -6.936 1.00 0.00 C ATOM 591 C ASP A 37 25.993 0.531 -7.347 1.00 0.00 C ATOM 592 O ASP A 37 24.961 0.623 -8.002 1.00 0.00 O ATOM 593 CB ASP A 37 27.894 2.055 -7.914 1.00 0.00 C ATOM 594 CG ASP A 37 27.445 2.060 -9.357 1.00 0.00 C ATOM 595 OD1 ASP A 37 26.721 2.997 -9.775 1.00 0.00 O ATOM 596 OD2 ASP A 37 27.834 1.133 -10.098 1.00 0.00 O ATOM 0 H ASP A 37 28.294 1.606 -5.527 1.00 0.00 H new ATOM 0 HA ASP A 37 26.074 2.623 -6.957 1.00 0.00 H new ATOM 0 HB2 ASP A 37 28.343 3.020 -7.676 1.00 0.00 H new ATOM 0 HB3 ASP A 37 28.671 1.301 -7.784 1.00 0.00 H new ATOM 601 N ASP A 38 26.467 -0.625 -6.893 1.00 0.00 N ATOM 602 CA ASP A 38 25.812 -1.907 -7.185 1.00 0.00 C ATOM 603 C ASP A 38 24.472 -1.925 -6.517 1.00 0.00 C ATOM 604 O ASP A 38 23.477 -2.365 -7.092 1.00 0.00 O ATOM 605 CB ASP A 38 26.639 -3.070 -6.649 1.00 0.00 C ATOM 606 CG ASP A 38 26.004 -4.425 -6.903 1.00 0.00 C ATOM 607 OD1 ASP A 38 26.155 -4.961 -8.028 1.00 0.00 O ATOM 608 OD2 ASP A 38 25.387 -5.001 -5.980 1.00 0.00 O ATOM 0 H ASP A 38 27.306 -0.706 -6.318 1.00 0.00 H new ATOM 0 HA ASP A 38 25.711 -2.013 -8.265 1.00 0.00 H new ATOM 0 HB2 ASP A 38 27.627 -3.047 -7.110 1.00 0.00 H new ATOM 0 HB3 ASP A 38 26.784 -2.940 -5.577 1.00 0.00 H new ATOM 613 N PHE A 39 24.460 -1.400 -5.304 1.00 0.00 N ATOM 614 CA PHE A 39 23.277 -1.297 -4.508 1.00 0.00 C ATOM 615 C PHE A 39 22.266 -0.351 -5.179 1.00 0.00 C ATOM 616 O PHE A 39 21.078 -0.669 -5.286 1.00 0.00 O ATOM 617 CB PHE A 39 23.668 -0.791 -3.116 1.00 0.00 C ATOM 618 CG PHE A 39 22.525 -0.627 -2.170 1.00 0.00 C ATOM 619 CD1 PHE A 39 21.809 0.539 -2.155 1.00 0.00 C ATOM 620 CD2 PHE A 39 22.173 -1.642 -1.298 1.00 0.00 C ATOM 621 CE1 PHE A 39 20.759 0.708 -1.300 1.00 0.00 C ATOM 622 CE2 PHE A 39 21.115 -1.480 -0.429 1.00 0.00 C ATOM 623 CZ PHE A 39 20.407 -0.296 -0.436 1.00 0.00 C ATOM 0 H PHE A 39 25.294 -1.030 -4.848 1.00 0.00 H new ATOM 0 HA PHE A 39 22.801 -2.273 -4.414 1.00 0.00 H new ATOM 0 HB2 PHE A 39 24.386 -1.485 -2.680 1.00 0.00 H new ATOM 0 HB3 PHE A 39 24.175 0.168 -3.222 1.00 0.00 H new ATOM 0 HD1 PHE A 39 22.079 1.338 -2.830 1.00 0.00 H new ATOM 0 HD2 PHE A 39 22.731 -2.567 -1.298 1.00 0.00 H new ATOM 0 HE1 PHE A 39 20.204 1.635 -1.304 1.00 0.00 H new ATOM 0 HE2 PHE A 39 20.843 -2.273 0.251 1.00 0.00 H new ATOM 0 HZ PHE A 39 19.575 -0.160 0.239 1.00 0.00 H new ATOM 633 N TRP A 40 22.746 0.803 -5.648 1.00 0.00 N ATOM 634 CA TRP A 40 21.875 1.770 -6.311 1.00 0.00 C ATOM 635 C TRP A 40 21.318 1.190 -7.584 1.00 0.00 C ATOM 636 O TRP A 40 20.165 1.356 -7.883 1.00 0.00 O ATOM 637 CB TRP A 40 22.580 3.104 -6.600 1.00 0.00 C ATOM 638 CG TRP A 40 23.144 3.776 -5.385 1.00 0.00 C ATOM 639 CD1 TRP A 40 24.402 4.262 -5.238 1.00 0.00 C ATOM 640 CD2 TRP A 40 22.481 4.010 -4.136 1.00 0.00 C ATOM 641 NE1 TRP A 40 24.570 4.762 -3.976 1.00 0.00 N ATOM 642 CE2 TRP A 40 23.408 4.626 -3.285 1.00 0.00 C ATOM 643 CE3 TRP A 40 21.200 3.758 -3.655 1.00 0.00 C ATOM 644 CZ2 TRP A 40 23.094 4.982 -1.987 1.00 0.00 C ATOM 645 CZ3 TRP A 40 20.893 4.117 -2.372 1.00 0.00 C ATOM 646 CH2 TRP A 40 21.831 4.716 -1.553 1.00 0.00 C ATOM 0 H TRP A 40 23.723 1.087 -5.581 1.00 0.00 H new ATOM 0 HA TRP A 40 21.059 1.983 -5.621 1.00 0.00 H new ATOM 0 HB2 TRP A 40 23.386 2.929 -7.312 1.00 0.00 H new ATOM 0 HB3 TRP A 40 21.872 3.780 -7.080 1.00 0.00 H new ATOM 0 HD1 TRP A 40 25.161 4.255 -6.006 1.00 0.00 H new ATOM 0 HE1 TRP A 40 25.430 5.172 -3.612 1.00 0.00 H new ATOM 0 HE3 TRP A 40 20.460 3.286 -4.285 1.00 0.00 H new ATOM 0 HZ2 TRP A 40 23.822 5.453 -1.342 1.00 0.00 H new ATOM 0 HZ3 TRP A 40 19.900 3.929 -1.992 1.00 0.00 H new ATOM 0 HH2 TRP A 40 21.555 4.980 -0.543 1.00 0.00 H new ATOM 657 N ALA A 41 22.140 0.461 -8.293 1.00 0.00 N ATOM 658 CA ALA A 41 21.723 -0.174 -9.528 1.00 0.00 C ATOM 659 C ALA A 41 20.750 -1.314 -9.245 1.00 0.00 C ATOM 660 O ALA A 41 19.884 -1.623 -10.064 1.00 0.00 O ATOM 661 CB ALA A 41 22.925 -0.663 -10.314 1.00 0.00 C ATOM 0 H ALA A 41 23.112 0.288 -8.038 1.00 0.00 H new ATOM 0 HA ALA A 41 21.205 0.567 -10.137 1.00 0.00 H new ATOM 0 HB1 ALA A 41 22.589 -1.136 -11.237 1.00 0.00 H new ATOM 0 HB2 ALA A 41 23.571 0.182 -10.554 1.00 0.00 H new ATOM 0 HB3 ALA A 41 23.480 -1.386 -9.717 1.00 0.00 H new ATOM 667 N ALA A 42 20.889 -1.931 -8.090 1.00 0.00 N ATOM 668 CA ALA A 42 19.999 -3.006 -7.678 1.00 0.00 C ATOM 669 C ALA A 42 18.604 -2.467 -7.339 1.00 0.00 C ATOM 670 O ALA A 42 17.595 -3.064 -7.697 1.00 0.00 O ATOM 671 CB ALA A 42 20.588 -3.762 -6.491 1.00 0.00 C ATOM 0 H ALA A 42 21.616 -1.706 -7.411 1.00 0.00 H new ATOM 0 HA ALA A 42 19.896 -3.699 -8.513 1.00 0.00 H new ATOM 0 HB1 ALA A 42 19.909 -4.562 -6.196 1.00 0.00 H new ATOM 0 HB2 ALA A 42 21.551 -4.188 -6.773 1.00 0.00 H new ATOM 0 HB3 ALA A 42 20.725 -3.076 -5.655 1.00 0.00 H new ATOM 677 N TYR A 43 18.548 -1.322 -6.685 1.00 0.00 N ATOM 678 CA TYR A 43 17.279 -0.753 -6.271 1.00 0.00 C ATOM 679 C TYR A 43 16.907 0.454 -7.107 1.00 0.00 C ATOM 680 O TYR A 43 16.038 1.227 -6.729 1.00 0.00 O ATOM 681 CB TYR A 43 17.323 -0.391 -4.786 1.00 0.00 C ATOM 682 CG TYR A 43 17.426 -1.595 -3.880 1.00 0.00 C ATOM 683 CD1 TYR A 43 18.651 -2.176 -3.582 1.00 0.00 C ATOM 684 CD2 TYR A 43 16.289 -2.166 -3.348 1.00 0.00 C ATOM 685 CE1 TYR A 43 18.732 -3.290 -2.777 1.00 0.00 C ATOM 686 CE2 TYR A 43 16.357 -3.284 -2.546 1.00 0.00 C ATOM 687 CZ TYR A 43 17.580 -3.842 -2.262 1.00 0.00 C ATOM 688 OH TYR A 43 17.651 -4.972 -1.480 1.00 0.00 O ATOM 0 H TYR A 43 19.365 -0.768 -6.429 1.00 0.00 H new ATOM 0 HA TYR A 43 16.507 -1.506 -6.428 1.00 0.00 H new ATOM 0 HB2 TYR A 43 18.174 0.265 -4.604 1.00 0.00 H new ATOM 0 HB3 TYR A 43 16.426 0.172 -4.530 1.00 0.00 H new ATOM 0 HD1 TYR A 43 19.555 -1.747 -3.988 1.00 0.00 H new ATOM 0 HD2 TYR A 43 15.326 -1.728 -3.564 1.00 0.00 H new ATOM 0 HE1 TYR A 43 19.693 -3.728 -2.551 1.00 0.00 H new ATOM 0 HE2 TYR A 43 15.454 -3.719 -2.143 1.00 0.00 H new ATOM 0 HH TYR A 43 18.475 -4.952 -0.950 1.00 0.00 H new ATOM 698 N ALA A 44 17.548 0.595 -8.258 1.00 0.00 N ATOM 699 CA ALA A 44 17.285 1.697 -9.193 1.00 0.00 C ATOM 700 C ALA A 44 15.808 1.789 -9.627 1.00 0.00 C ATOM 701 O ALA A 44 15.347 2.839 -10.082 1.00 0.00 O ATOM 702 CB ALA A 44 18.179 1.580 -10.418 1.00 0.00 C ATOM 0 H ALA A 44 18.270 -0.051 -8.578 1.00 0.00 H new ATOM 0 HA ALA A 44 17.514 2.616 -8.654 1.00 0.00 H new ATOM 0 HB1 ALA A 44 17.971 2.404 -11.100 1.00 0.00 H new ATOM 0 HB2 ALA A 44 19.224 1.618 -10.111 1.00 0.00 H new ATOM 0 HB3 ALA A 44 17.983 0.634 -10.922 1.00 0.00 H new ATOM 708 N GLY A 45 15.082 0.697 -9.511 1.00 0.00 N ATOM 709 CA GLY A 45 13.691 0.697 -9.894 1.00 0.00 C ATOM 710 C GLY A 45 12.779 1.144 -8.769 1.00 0.00 C ATOM 711 O GLY A 45 11.589 1.364 -8.980 1.00 0.00 O ATOM 0 H GLY A 45 15.431 -0.194 -9.157 1.00 0.00 H new ATOM 0 HA2 GLY A 45 13.554 1.355 -10.752 1.00 0.00 H new ATOM 0 HA3 GLY A 45 13.405 -0.305 -10.212 1.00 0.00 H new ATOM 715 N TRP A 46 13.304 1.172 -7.571 1.00 0.00 N ATOM 716 CA TRP A 46 12.593 1.663 -6.423 1.00 0.00 C ATOM 717 C TRP A 46 12.807 3.176 -6.341 1.00 0.00 C ATOM 718 O TRP A 46 13.769 3.701 -6.910 1.00 0.00 O ATOM 719 CB TRP A 46 13.169 1.042 -5.148 1.00 0.00 C ATOM 720 CG TRP A 46 13.175 -0.447 -5.057 1.00 0.00 C ATOM 721 CD1 TRP A 46 13.930 -1.318 -5.775 1.00 0.00 C ATOM 722 CD2 TRP A 46 12.419 -1.230 -4.156 1.00 0.00 C ATOM 723 NE1 TRP A 46 13.663 -2.598 -5.391 1.00 0.00 N ATOM 724 CE2 TRP A 46 12.738 -2.575 -4.393 1.00 0.00 C ATOM 725 CE3 TRP A 46 11.492 -0.924 -3.179 1.00 0.00 C ATOM 726 CZ2 TRP A 46 12.156 -3.610 -3.677 1.00 0.00 C ATOM 727 CZ3 TRP A 46 10.908 -1.946 -2.485 1.00 0.00 C ATOM 728 CH2 TRP A 46 11.246 -3.275 -2.737 1.00 0.00 C ATOM 0 H TRP A 46 14.250 0.850 -7.365 1.00 0.00 H new ATOM 0 HA TRP A 46 11.537 1.411 -6.515 1.00 0.00 H new ATOM 0 HB2 TRP A 46 14.195 1.391 -5.036 1.00 0.00 H new ATOM 0 HB3 TRP A 46 12.606 1.430 -4.299 1.00 0.00 H new ATOM 0 HD1 TRP A 46 14.639 -1.037 -6.540 1.00 0.00 H new ATOM 0 HE1 TRP A 46 14.087 -3.437 -5.787 1.00 0.00 H new ATOM 0 HE3 TRP A 46 11.234 0.103 -2.968 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 12.419 -4.641 -3.863 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 10.172 -1.720 -1.728 1.00 0.00 H new ATOM 0 HH2 TRP A 46 10.768 -4.057 -2.166 1.00 0.00 H new ATOM 739 N THR A 47 11.940 3.856 -5.650 1.00 0.00 N ATOM 740 CA THR A 47 12.060 5.251 -5.428 1.00 0.00 C ATOM 741 C THR A 47 12.831 5.475 -4.120 1.00 0.00 C ATOM 742 O THR A 47 12.434 4.959 -3.066 1.00 0.00 O ATOM 743 CB THR A 47 10.652 5.864 -5.340 1.00 0.00 C ATOM 744 OG1 THR A 47 9.936 5.607 -6.566 1.00 0.00 O ATOM 745 CG2 THR A 47 10.703 7.352 -5.075 1.00 0.00 C ATOM 0 H THR A 47 11.115 3.439 -5.219 1.00 0.00 H new ATOM 0 HA THR A 47 12.600 5.728 -6.245 1.00 0.00 H new ATOM 0 HB THR A 47 10.134 5.398 -4.502 1.00 0.00 H new ATOM 0 HG1 THR A 47 9.039 5.996 -6.508 1.00 0.00 H new ATOM 0 HG21 THR A 47 9.688 7.747 -5.020 1.00 0.00 H new ATOM 0 HG22 THR A 47 11.216 7.536 -4.131 1.00 0.00 H new ATOM 0 HG23 THR A 47 11.242 7.847 -5.883 1.00 0.00 H new ATOM 753 N LEU A 48 13.946 6.181 -4.204 1.00 0.00 N ATOM 754 CA LEU A 48 14.762 6.478 -3.043 1.00 0.00 C ATOM 755 C LEU A 48 14.066 7.573 -2.266 1.00 0.00 C ATOM 756 O LEU A 48 13.965 8.702 -2.734 1.00 0.00 O ATOM 757 CB LEU A 48 16.198 6.896 -3.516 1.00 0.00 C ATOM 758 CG LEU A 48 17.343 7.083 -2.462 1.00 0.00 C ATOM 759 CD1 LEU A 48 17.269 8.388 -1.697 1.00 0.00 C ATOM 760 CD2 LEU A 48 17.375 5.939 -1.486 1.00 0.00 C ATOM 0 H LEU A 48 14.309 6.563 -5.078 1.00 0.00 H new ATOM 0 HA LEU A 48 14.881 5.611 -2.393 1.00 0.00 H new ATOM 0 HB2 LEU A 48 16.535 6.147 -4.232 1.00 0.00 H new ATOM 0 HB3 LEU A 48 16.100 7.836 -4.060 1.00 0.00 H new ATOM 0 HG LEU A 48 18.263 7.105 -3.046 1.00 0.00 H new ATOM 0 HD11 LEU A 48 18.095 8.441 -0.988 1.00 0.00 H new ATOM 0 HD12 LEU A 48 17.335 9.223 -2.395 1.00 0.00 H new ATOM 0 HD13 LEU A 48 16.324 8.440 -1.157 1.00 0.00 H new ATOM 0 HD21 LEU A 48 18.179 6.096 -0.767 1.00 0.00 H new ATOM 0 HD22 LEU A 48 16.423 5.884 -0.959 1.00 0.00 H new ATOM 0 HD23 LEU A 48 17.546 5.007 -2.024 1.00 0.00 H new ATOM 772 N VAL A 49 13.535 7.230 -1.122 1.00 0.00 N ATOM 773 CA VAL A 49 12.812 8.197 -0.338 1.00 0.00 C ATOM 774 C VAL A 49 13.784 8.964 0.516 1.00 0.00 C ATOM 775 O VAL A 49 13.755 10.197 0.555 1.00 0.00 O ATOM 776 CB VAL A 49 11.679 7.554 0.516 1.00 0.00 C ATOM 777 CG1 VAL A 49 10.913 8.608 1.297 1.00 0.00 C ATOM 778 CG2 VAL A 49 10.742 6.799 -0.389 1.00 0.00 C ATOM 0 H VAL A 49 13.588 6.296 -0.715 1.00 0.00 H new ATOM 0 HA VAL A 49 12.309 8.883 -1.020 1.00 0.00 H new ATOM 0 HB VAL A 49 12.130 6.870 1.234 1.00 0.00 H new ATOM 0 HG11 VAL A 49 10.129 8.128 1.883 1.00 0.00 H new ATOM 0 HG12 VAL A 49 11.596 9.133 1.965 1.00 0.00 H new ATOM 0 HG13 VAL A 49 10.464 9.320 0.604 1.00 0.00 H new ATOM 0 HG21 VAL A 49 9.947 6.347 0.205 1.00 0.00 H new ATOM 0 HG22 VAL A 49 10.307 7.485 -1.116 1.00 0.00 H new ATOM 0 HG23 VAL A 49 11.293 6.017 -0.912 1.00 0.00 H new ATOM 788 N GLU A 50 14.676 8.243 1.157 1.00 0.00 N ATOM 789 CA GLU A 50 15.703 8.867 1.954 1.00 0.00 C ATOM 790 C GLU A 50 16.805 7.887 2.185 1.00 0.00 C ATOM 791 O GLU A 50 16.612 6.684 2.046 1.00 0.00 O ATOM 792 CB GLU A 50 15.174 9.354 3.322 1.00 0.00 C ATOM 793 CG GLU A 50 14.672 8.253 4.222 1.00 0.00 C ATOM 794 CD GLU A 50 14.273 8.743 5.583 1.00 0.00 C ATOM 795 OE1 GLU A 50 13.193 9.348 5.724 1.00 0.00 O ATOM 796 OE2 GLU A 50 15.022 8.523 6.551 1.00 0.00 O ATOM 0 H GLU A 50 14.710 7.224 1.141 1.00 0.00 H new ATOM 0 HA GLU A 50 16.059 9.739 1.405 1.00 0.00 H new ATOM 0 HB2 GLU A 50 15.971 9.892 3.836 1.00 0.00 H new ATOM 0 HB3 GLU A 50 14.366 10.066 3.153 1.00 0.00 H new ATOM 0 HG2 GLU A 50 13.817 7.768 3.751 1.00 0.00 H new ATOM 0 HG3 GLU A 50 15.449 7.496 4.328 1.00 0.00 H new ATOM 803 N GLN A 51 17.946 8.386 2.460 1.00 0.00 N ATOM 804 CA GLN A 51 19.029 7.589 2.886 1.00 0.00 C ATOM 805 C GLN A 51 19.786 8.312 3.957 1.00 0.00 C ATOM 806 O GLN A 51 19.950 9.538 3.910 1.00 0.00 O ATOM 807 CB GLN A 51 19.930 7.187 1.738 1.00 0.00 C ATOM 808 CG GLN A 51 20.531 8.326 0.948 1.00 0.00 C ATOM 809 CD GLN A 51 21.459 7.802 -0.094 1.00 0.00 C ATOM 810 OE1 GLN A 51 22.641 7.651 0.137 1.00 0.00 O ATOM 811 NE2 GLN A 51 20.925 7.486 -1.237 1.00 0.00 N ATOM 0 H GLN A 51 18.160 9.381 2.394 1.00 0.00 H new ATOM 0 HA GLN A 51 18.634 6.660 3.296 1.00 0.00 H new ATOM 0 HB2 GLN A 51 20.741 6.576 2.134 1.00 0.00 H new ATOM 0 HB3 GLN A 51 19.359 6.557 1.056 1.00 0.00 H new ATOM 0 HG2 GLN A 51 19.739 8.909 0.479 1.00 0.00 H new ATOM 0 HG3 GLN A 51 21.068 8.998 1.618 1.00 0.00 H new ATOM 0 HE21 GLN A 51 19.927 7.629 -1.390 1.00 0.00 H new ATOM 0 HE22 GLN A 51 21.504 7.095 -1.980 1.00 0.00 H new ATOM 820 N LYS A 52 20.181 7.587 4.921 1.00 0.00 N ATOM 821 CA LYS A 52 20.926 8.082 6.016 1.00 0.00 C ATOM 822 C LYS A 52 22.048 7.117 6.274 1.00 0.00 C ATOM 823 O LYS A 52 21.911 6.140 7.001 1.00 0.00 O ATOM 824 CB LYS A 52 19.991 8.284 7.218 1.00 0.00 C ATOM 825 CG LYS A 52 19.051 7.111 7.440 1.00 0.00 C ATOM 826 CD LYS A 52 17.827 7.442 8.285 1.00 0.00 C ATOM 827 CE LYS A 52 18.161 7.851 9.695 1.00 0.00 C ATOM 828 NZ LYS A 52 16.944 8.209 10.459 1.00 0.00 N ATOM 0 H LYS A 52 19.989 6.587 4.978 1.00 0.00 H new ATOM 0 HA LYS A 52 21.367 9.058 5.812 1.00 0.00 H new ATOM 0 HB2 LYS A 52 20.590 8.438 8.116 1.00 0.00 H new ATOM 0 HB3 LYS A 52 19.404 9.190 7.067 1.00 0.00 H new ATOM 0 HG2 LYS A 52 18.719 6.737 6.471 1.00 0.00 H new ATOM 0 HG3 LYS A 52 19.603 6.304 7.921 1.00 0.00 H new ATOM 0 HD2 LYS A 52 17.271 8.247 7.804 1.00 0.00 H new ATOM 0 HD3 LYS A 52 17.170 6.573 8.314 1.00 0.00 H new ATOM 0 HE2 LYS A 52 18.681 7.036 10.198 1.00 0.00 H new ATOM 0 HE3 LYS A 52 18.843 8.701 9.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 17.210 8.486 11.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 16.462 9.003 9.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 16.304 7.390 10.497 1.00 0.00 H new ATOM 842 N LYS A 53 23.137 7.428 5.625 1.00 0.00 N ATOM 843 CA LYS A 53 24.363 6.685 5.528 1.00 0.00 C ATOM 844 C LYS A 53 24.252 5.161 5.398 1.00 0.00 C ATOM 845 O LYS A 53 24.443 4.608 4.317 1.00 0.00 O ATOM 846 CB LYS A 53 25.396 7.126 6.530 1.00 0.00 C ATOM 847 CG LYS A 53 26.786 6.772 6.091 1.00 0.00 C ATOM 848 CD LYS A 53 27.186 7.548 4.826 1.00 0.00 C ATOM 849 CE LYS A 53 28.387 6.940 4.143 1.00 0.00 C ATOM 850 NZ LYS A 53 28.096 5.576 3.630 1.00 0.00 N ATOM 0 H LYS A 53 23.192 8.299 5.097 1.00 0.00 H new ATOM 0 HA LYS A 53 24.728 6.965 4.540 1.00 0.00 H new ATOM 0 HB2 LYS A 53 25.324 8.204 6.675 1.00 0.00 H new ATOM 0 HB3 LYS A 53 25.190 6.660 7.494 1.00 0.00 H new ATOM 0 HG2 LYS A 53 27.490 6.992 6.893 1.00 0.00 H new ATOM 0 HG3 LYS A 53 26.847 5.701 5.898 1.00 0.00 H new ATOM 0 HD2 LYS A 53 26.346 7.567 4.132 1.00 0.00 H new ATOM 0 HD3 LYS A 53 27.405 8.583 5.090 1.00 0.00 H new ATOM 0 HE2 LYS A 53 28.699 7.580 3.318 1.00 0.00 H new ATOM 0 HE3 LYS A 53 29.220 6.895 4.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 28.757 5.346 2.861 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 28.206 4.885 4.399 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 27.121 5.541 3.270 1.00 0.00 H new ATOM 864 N GLY A 54 23.975 4.530 6.479 1.00 0.00 N ATOM 865 CA GLY A 54 23.915 3.092 6.535 1.00 0.00 C ATOM 866 C GLY A 54 22.509 2.554 6.373 1.00 0.00 C ATOM 867 O GLY A 54 22.326 1.382 6.091 1.00 0.00 O ATOM 0 H GLY A 54 23.779 4.990 7.368 1.00 0.00 H new ATOM 0 HA2 GLY A 54 24.550 2.676 5.753 1.00 0.00 H new ATOM 0 HA3 GLY A 54 24.321 2.753 7.488 1.00 0.00 H new ATOM 871 N TYR A 55 21.514 3.377 6.570 1.00 0.00 N ATOM 872 CA TYR A 55 20.172 2.957 6.401 1.00 0.00 C ATOM 873 C TYR A 55 19.614 3.656 5.182 1.00 0.00 C ATOM 874 O TYR A 55 19.803 4.853 5.005 1.00 0.00 O ATOM 875 CB TYR A 55 19.387 3.271 7.687 1.00 0.00 C ATOM 876 CG TYR A 55 17.883 3.233 7.575 1.00 0.00 C ATOM 877 CD1 TYR A 55 17.218 4.334 7.122 1.00 0.00 C ATOM 878 CD2 TYR A 55 17.150 2.133 7.944 1.00 0.00 C ATOM 879 CE1 TYR A 55 15.857 4.378 7.019 1.00 0.00 C ATOM 880 CE2 TYR A 55 15.767 2.143 7.855 1.00 0.00 C ATOM 881 CZ TYR A 55 15.124 3.276 7.391 1.00 0.00 C ATOM 882 OH TYR A 55 13.751 3.301 7.301 1.00 0.00 O ATOM 0 H TYR A 55 21.623 4.352 6.851 1.00 0.00 H new ATOM 0 HA TYR A 55 20.096 1.882 6.235 1.00 0.00 H new ATOM 0 HB2 TYR A 55 19.691 2.561 8.456 1.00 0.00 H new ATOM 0 HB3 TYR A 55 19.680 4.262 8.034 1.00 0.00 H new ATOM 0 HD1 TYR A 55 17.789 5.204 6.834 1.00 0.00 H new ATOM 0 HD2 TYR A 55 17.656 1.251 8.307 1.00 0.00 H new ATOM 0 HE1 TYR A 55 15.364 5.265 6.651 1.00 0.00 H new ATOM 0 HE2 TYR A 55 15.196 1.273 8.146 1.00 0.00 H new ATOM 0 HH TYR A 55 13.482 3.894 6.569 1.00 0.00 H new ATOM 892 N VAL A 56 18.953 2.924 4.347 1.00 0.00 N ATOM 893 CA VAL A 56 18.405 3.466 3.139 1.00 0.00 C ATOM 894 C VAL A 56 16.933 3.102 3.051 1.00 0.00 C ATOM 895 O VAL A 56 16.544 1.999 3.404 1.00 0.00 O ATOM 896 CB VAL A 56 19.176 2.943 1.882 1.00 0.00 C ATOM 897 CG1 VAL A 56 18.537 3.442 0.616 1.00 0.00 C ATOM 898 CG2 VAL A 56 20.636 3.383 1.907 1.00 0.00 C ATOM 0 H VAL A 56 18.775 1.929 4.480 1.00 0.00 H new ATOM 0 HA VAL A 56 18.512 4.551 3.160 1.00 0.00 H new ATOM 0 HB VAL A 56 19.131 1.854 1.907 1.00 0.00 H new ATOM 0 HG11 VAL A 56 19.091 3.065 -0.244 1.00 0.00 H new ATOM 0 HG12 VAL A 56 17.506 3.091 0.566 1.00 0.00 H new ATOM 0 HG13 VAL A 56 18.550 4.532 0.607 1.00 0.00 H new ATOM 0 HG21 VAL A 56 21.145 3.004 1.021 1.00 0.00 H new ATOM 0 HG22 VAL A 56 20.688 4.472 1.918 1.00 0.00 H new ATOM 0 HG23 VAL A 56 21.120 2.988 2.800 1.00 0.00 H new ATOM 908 N LEU A 57 16.128 4.030 2.630 1.00 0.00 N ATOM 909 CA LEU A 57 14.725 3.815 2.475 1.00 0.00 C ATOM 910 C LEU A 57 14.310 3.937 1.008 1.00 0.00 C ATOM 911 O LEU A 57 14.439 5.021 0.381 1.00 0.00 O ATOM 912 CB LEU A 57 13.939 4.788 3.371 1.00 0.00 C ATOM 913 CG LEU A 57 12.469 5.010 3.004 1.00 0.00 C ATOM 914 CD1 LEU A 57 11.674 3.763 2.981 1.00 0.00 C ATOM 915 CD2 LEU A 57 11.804 6.059 3.864 1.00 0.00 C ATOM 0 H LEU A 57 16.434 4.971 2.381 1.00 0.00 H new ATOM 0 HA LEU A 57 14.489 2.799 2.791 1.00 0.00 H new ATOM 0 HB2 LEU A 57 13.984 4.421 4.397 1.00 0.00 H new ATOM 0 HB3 LEU A 57 14.445 5.753 3.355 1.00 0.00 H new ATOM 0 HG LEU A 57 12.492 5.388 1.982 1.00 0.00 H new ATOM 0 HD11 LEU A 57 10.643 3.994 2.714 1.00 0.00 H new ATOM 0 HD12 LEU A 57 12.094 3.077 2.246 1.00 0.00 H new ATOM 0 HD13 LEU A 57 11.698 3.298 3.966 1.00 0.00 H new ATOM 0 HD21 LEU A 57 10.764 6.174 3.559 1.00 0.00 H new ATOM 0 HD22 LEU A 57 11.844 5.751 4.909 1.00 0.00 H new ATOM 0 HD23 LEU A 57 12.324 7.010 3.746 1.00 0.00 H new ATOM 927 N PHE A 58 13.833 2.829 0.476 1.00 0.00 N ATOM 928 CA PHE A 58 13.314 2.735 -0.889 1.00 0.00 C ATOM 929 C PHE A 58 11.857 2.298 -0.896 1.00 0.00 C ATOM 930 O PHE A 58 11.427 1.519 -0.061 1.00 0.00 O ATOM 931 CB PHE A 58 14.104 1.724 -1.726 1.00 0.00 C ATOM 932 CG PHE A 58 15.323 2.236 -2.419 1.00 0.00 C ATOM 933 CD1 PHE A 58 15.198 2.939 -3.594 1.00 0.00 C ATOM 934 CD2 PHE A 58 16.578 1.985 -1.933 1.00 0.00 C ATOM 935 CE1 PHE A 58 16.298 3.395 -4.271 1.00 0.00 C ATOM 936 CE2 PHE A 58 17.689 2.437 -2.611 1.00 0.00 C ATOM 937 CZ PHE A 58 17.547 3.146 -3.781 1.00 0.00 C ATOM 0 H PHE A 58 13.791 1.946 0.985 1.00 0.00 H new ATOM 0 HA PHE A 58 13.413 3.731 -1.320 1.00 0.00 H new ATOM 0 HB2 PHE A 58 14.402 0.902 -1.075 1.00 0.00 H new ATOM 0 HB3 PHE A 58 13.434 1.308 -2.478 1.00 0.00 H new ATOM 0 HD1 PHE A 58 14.213 3.136 -3.991 1.00 0.00 H new ATOM 0 HD2 PHE A 58 16.698 1.430 -1.014 1.00 0.00 H new ATOM 0 HE1 PHE A 58 16.177 3.950 -5.190 1.00 0.00 H new ATOM 0 HE2 PHE A 58 18.676 2.234 -2.222 1.00 0.00 H new ATOM 0 HZ PHE A 58 18.419 3.504 -4.309 1.00 0.00 H new ATOM 947 N ARG A 59 11.110 2.793 -1.847 1.00 0.00 N ATOM 948 CA ARG A 59 9.749 2.359 -2.015 1.00 0.00 C ATOM 949 C ARG A 59 9.514 1.895 -3.428 1.00 0.00 C ATOM 950 O ARG A 59 10.081 2.424 -4.373 1.00 0.00 O ATOM 951 CB ARG A 59 8.729 3.433 -1.643 1.00 0.00 C ATOM 952 CG ARG A 59 8.765 4.680 -2.486 1.00 0.00 C ATOM 953 CD ARG A 59 7.658 5.624 -2.096 1.00 0.00 C ATOM 954 NE ARG A 59 7.610 5.844 -0.641 1.00 0.00 N ATOM 955 CZ ARG A 59 6.809 6.706 -0.011 1.00 0.00 C ATOM 956 NH1 ARG A 59 6.062 7.561 -0.699 1.00 0.00 N ATOM 957 NH2 ARG A 59 6.781 6.717 1.316 1.00 0.00 N ATOM 0 H ARG A 59 11.421 3.497 -2.517 1.00 0.00 H new ATOM 0 HA ARG A 59 9.603 1.528 -1.325 1.00 0.00 H new ATOM 0 HB2 ARG A 59 7.731 3.000 -1.708 1.00 0.00 H new ATOM 0 HB3 ARG A 59 8.887 3.714 -0.602 1.00 0.00 H new ATOM 0 HG2 ARG A 59 9.729 5.175 -2.369 1.00 0.00 H new ATOM 0 HG3 ARG A 59 8.668 4.415 -3.539 1.00 0.00 H new ATOM 0 HD2 ARG A 59 7.800 6.579 -2.603 1.00 0.00 H new ATOM 0 HD3 ARG A 59 6.703 5.222 -2.434 1.00 0.00 H new ATOM 0 HE ARG A 59 8.243 5.290 -0.065 1.00 0.00 H new ATOM 0 HH11 ARG A 59 6.097 7.563 -1.718 1.00 0.00 H new ATOM 0 HH12 ARG A 59 5.453 8.216 -0.208 1.00 0.00 H new ATOM 0 HH21 ARG A 59 7.368 6.071 1.844 1.00 0.00 H new ATOM 0 HH22 ARG A 59 6.173 7.372 1.808 1.00 0.00 H new ATOM 971 N LYS A 60 8.724 0.898 -3.556 1.00 0.00 N ATOM 972 CA LYS A 60 8.337 0.343 -4.822 1.00 0.00 C ATOM 973 C LYS A 60 6.863 0.120 -4.761 1.00 0.00 C ATOM 974 O LYS A 60 6.372 -0.620 -3.906 1.00 0.00 O ATOM 975 CB LYS A 60 9.030 -0.993 -5.028 1.00 0.00 C ATOM 976 CG LYS A 60 8.639 -1.769 -6.262 1.00 0.00 C ATOM 977 CD LYS A 60 9.398 -1.339 -7.504 1.00 0.00 C ATOM 978 CE LYS A 60 10.880 -1.693 -7.416 1.00 0.00 C ATOM 979 NZ LYS A 60 11.499 -1.707 -8.762 1.00 0.00 N ATOM 0 H LYS A 60 8.306 0.418 -2.759 1.00 0.00 H new ATOM 0 HA LYS A 60 8.609 1.010 -5.640 1.00 0.00 H new ATOM 0 HB2 LYS A 60 10.105 -0.818 -5.061 1.00 0.00 H new ATOM 0 HB3 LYS A 60 8.835 -1.617 -4.156 1.00 0.00 H new ATOM 0 HG2 LYS A 60 8.814 -2.830 -6.086 1.00 0.00 H new ATOM 0 HG3 LYS A 60 7.570 -1.647 -6.437 1.00 0.00 H new ATOM 0 HD2 LYS A 60 8.962 -1.818 -8.380 1.00 0.00 H new ATOM 0 HD3 LYS A 60 9.289 -0.263 -7.642 1.00 0.00 H new ATOM 0 HE2 LYS A 60 11.394 -0.970 -6.782 1.00 0.00 H new ATOM 0 HE3 LYS A 60 10.998 -2.670 -6.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 12.533 -1.645 -8.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 11.248 -2.590 -9.250 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 11.151 -0.896 -9.312 1.00 0.00 H new ATOM 993 N GLN A 61 6.149 0.746 -5.602 1.00 0.00 N ATOM 994 CA GLN A 61 4.756 0.580 -5.574 1.00 0.00 C ATOM 995 C GLN A 61 4.259 -0.102 -6.812 1.00 0.00 C ATOM 996 O GLN A 61 4.081 0.497 -7.873 1.00 0.00 O ATOM 997 CB GLN A 61 4.057 1.865 -5.199 1.00 0.00 C ATOM 998 CG GLN A 61 4.406 3.051 -6.020 1.00 0.00 C ATOM 999 CD GLN A 61 3.987 4.317 -5.350 1.00 0.00 C ATOM 1000 OE1 GLN A 61 2.869 4.790 -5.526 1.00 0.00 O ATOM 1001 NE2 GLN A 61 4.897 4.899 -4.623 1.00 0.00 N ATOM 0 H GLN A 61 6.503 1.379 -6.319 1.00 0.00 H new ATOM 0 HA GLN A 61 4.490 -0.109 -4.772 1.00 0.00 H new ATOM 0 HB2 GLN A 61 2.981 1.704 -5.265 1.00 0.00 H new ATOM 0 HB3 GLN A 61 4.282 2.089 -4.156 1.00 0.00 H new ATOM 0 HG2 GLN A 61 5.481 3.070 -6.197 1.00 0.00 H new ATOM 0 HG3 GLN A 61 3.924 2.976 -6.995 1.00 0.00 H new ATOM 0 HE21 GLN A 61 5.812 4.464 -4.507 1.00 0.00 H new ATOM 0 HE22 GLN A 61 4.694 5.790 -4.169 1.00 0.00 H new ATOM 1010 N MET A 62 4.115 -1.383 -6.662 1.00 0.00 N ATOM 1011 CA MET A 62 3.688 -2.277 -7.701 1.00 0.00 C ATOM 1012 C MET A 62 2.187 -2.259 -7.756 1.00 0.00 C ATOM 1013 O MET A 62 1.524 -2.321 -6.711 1.00 0.00 O ATOM 1014 CB MET A 62 4.205 -3.688 -7.380 1.00 0.00 C ATOM 1015 CG MET A 62 5.727 -3.795 -7.419 1.00 0.00 C ATOM 1016 SD MET A 62 6.385 -5.288 -6.627 1.00 0.00 S ATOM 1017 CE MET A 62 6.030 -4.962 -4.889 1.00 0.00 C ATOM 0 H MET A 62 4.299 -1.856 -5.777 1.00 0.00 H new ATOM 0 HA MET A 62 4.083 -1.970 -8.670 1.00 0.00 H new ATOM 0 HB2 MET A 62 3.852 -3.981 -6.391 1.00 0.00 H new ATOM 0 HB3 MET A 62 3.779 -4.395 -8.093 1.00 0.00 H new ATOM 0 HG2 MET A 62 6.056 -3.773 -8.458 1.00 0.00 H new ATOM 0 HG3 MET A 62 6.155 -2.919 -6.931 1.00 0.00 H new ATOM 0 HE1 MET A 62 6.629 -5.625 -4.265 1.00 0.00 H new ATOM 0 HE2 MET A 62 6.274 -3.925 -4.656 1.00 0.00 H new ATOM 0 HE3 MET A 62 4.972 -5.139 -4.694 1.00 0.00 H new ATOM 1027 N ASP A 63 1.648 -2.143 -8.940 1.00 0.00 N ATOM 1028 CA ASP A 63 0.220 -2.078 -9.100 1.00 0.00 C ATOM 1029 C ASP A 63 -0.410 -3.453 -9.021 1.00 0.00 C ATOM 1030 O ASP A 63 -0.446 -4.214 -9.981 1.00 0.00 O ATOM 1031 CB ASP A 63 -0.218 -1.306 -10.370 1.00 0.00 C ATOM 1032 CG ASP A 63 0.240 -1.926 -11.672 1.00 0.00 C ATOM 1033 OD1 ASP A 63 1.450 -1.808 -12.010 1.00 0.00 O ATOM 1034 OD2 ASP A 63 -0.597 -2.542 -12.396 1.00 0.00 O ATOM 0 H ASP A 63 2.178 -2.091 -9.810 1.00 0.00 H new ATOM 0 HA ASP A 63 -0.157 -1.495 -8.259 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -1.306 -1.235 -10.379 1.00 0.00 H new ATOM 0 HB3 ASP A 63 0.168 -0.288 -10.312 1.00 0.00 H new ATOM 1039 N ASP A 64 -0.803 -3.785 -7.841 1.00 0.00 N ATOM 1040 CA ASP A 64 -1.553 -4.974 -7.536 1.00 0.00 C ATOM 1041 C ASP A 64 -1.999 -4.766 -6.126 1.00 0.00 C ATOM 1042 O ASP A 64 -1.722 -3.698 -5.542 1.00 0.00 O ATOM 1043 CB ASP A 64 -0.704 -6.266 -7.636 1.00 0.00 C ATOM 1044 CG ASP A 64 -1.550 -7.526 -7.866 1.00 0.00 C ATOM 1045 OD1 ASP A 64 -2.247 -8.007 -6.937 1.00 0.00 O ATOM 1046 OD2 ASP A 64 -1.558 -8.032 -8.990 1.00 0.00 O ATOM 0 H ASP A 64 -0.606 -3.215 -7.018 1.00 0.00 H new ATOM 0 HA ASP A 64 -2.370 -5.114 -8.244 1.00 0.00 H new ATOM 0 HB2 ASP A 64 0.011 -6.162 -8.452 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -0.126 -6.386 -6.720 1.00 0.00 H new ATOM 1051 N ILE A 65 -2.640 -5.701 -5.566 1.00 0.00 N ATOM 1052 CA ILE A 65 -3.092 -5.575 -4.228 1.00 0.00 C ATOM 1053 C ILE A 65 -2.245 -6.489 -3.357 1.00 0.00 C ATOM 1054 O ILE A 65 -1.457 -7.294 -3.887 1.00 0.00 O ATOM 1055 CB ILE A 65 -4.607 -5.844 -4.107 1.00 0.00 C ATOM 1056 CG1 ILE A 65 -4.943 -7.206 -4.682 1.00 0.00 C ATOM 1057 CG2 ILE A 65 -5.404 -4.732 -4.791 1.00 0.00 C ATOM 1058 CD1 ILE A 65 -6.417 -7.532 -4.750 1.00 0.00 C ATOM 0 H ILE A 65 -2.874 -6.587 -6.014 1.00 0.00 H new ATOM 0 HA ILE A 65 -2.967 -4.549 -3.881 1.00 0.00 H new ATOM 0 HB ILE A 65 -4.885 -5.847 -3.053 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -4.527 -7.271 -5.687 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -4.446 -7.968 -4.082 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -6.470 -4.937 -4.696 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -5.175 -3.777 -4.318 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -5.135 -4.688 -5.846 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -6.550 -8.527 -5.176 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -6.842 -7.507 -3.747 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -6.923 -6.798 -5.377 1.00 0.00 H new ATOM 1070 N SER A 66 -2.371 -6.380 -2.071 1.00 0.00 N ATOM 1071 CA SER A 66 -1.485 -7.083 -1.177 1.00 0.00 C ATOM 1072 C SER A 66 -1.831 -8.565 -1.149 1.00 0.00 C ATOM 1073 O SER A 66 -2.936 -8.946 -1.535 1.00 0.00 O ATOM 1074 CB SER A 66 -1.527 -6.447 0.238 1.00 0.00 C ATOM 1075 OG SER A 66 -2.822 -6.487 0.800 1.00 0.00 O ATOM 0 H SER A 66 -3.080 -5.810 -1.609 1.00 0.00 H new ATOM 0 HA SER A 66 -0.462 -6.993 -1.542 1.00 0.00 H new ATOM 0 HB2 SER A 66 -0.832 -6.973 0.892 1.00 0.00 H new ATOM 0 HB3 SER A 66 -1.189 -5.412 0.180 1.00 0.00 H new ATOM 0 HG SER A 66 -3.482 -6.629 0.090 1.00 0.00 H new ATOM 1081 N PRO A 67 -0.889 -9.442 -0.739 1.00 0.00 N ATOM 1082 CA PRO A 67 -1.150 -10.884 -0.601 1.00 0.00 C ATOM 1083 C PRO A 67 -2.375 -11.147 0.276 1.00 0.00 C ATOM 1084 O PRO A 67 -3.115 -12.114 0.079 1.00 0.00 O ATOM 1085 CB PRO A 67 0.113 -11.422 0.097 1.00 0.00 C ATOM 1086 CG PRO A 67 0.881 -10.212 0.526 1.00 0.00 C ATOM 1087 CD PRO A 67 0.509 -9.121 -0.422 1.00 0.00 C ATOM 0 HA PRO A 67 -1.352 -11.356 -1.562 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -0.147 -12.045 0.953 1.00 0.00 H new ATOM 0 HB3 PRO A 67 0.702 -12.041 -0.580 1.00 0.00 H new ATOM 0 HG2 PRO A 67 0.633 -9.937 1.551 1.00 0.00 H new ATOM 0 HG3 PRO A 67 1.954 -10.402 0.498 1.00 0.00 H new ATOM 0 HD2 PRO A 67 0.606 -8.136 0.034 1.00 0.00 H new ATOM 0 HD3 PRO A 67 1.138 -9.124 -1.312 1.00 0.00 H new ATOM 1095 N LEU A 68 -2.606 -10.239 1.192 1.00 0.00 N ATOM 1096 CA LEU A 68 -3.673 -10.331 2.125 1.00 0.00 C ATOM 1097 C LEU A 68 -5.001 -10.018 1.409 1.00 0.00 C ATOM 1098 O LEU A 68 -5.995 -10.602 1.716 1.00 0.00 O ATOM 1099 CB LEU A 68 -3.402 -9.374 3.310 1.00 0.00 C ATOM 1100 CG LEU A 68 -3.944 -9.777 4.711 1.00 0.00 C ATOM 1101 CD1 LEU A 68 -5.452 -9.842 4.750 1.00 0.00 C ATOM 1102 CD2 LEU A 68 -3.360 -11.117 5.145 1.00 0.00 C ATOM 0 H LEU A 68 -2.037 -9.400 1.302 1.00 0.00 H new ATOM 0 HA LEU A 68 -3.746 -11.340 2.530 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -2.323 -9.243 3.394 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -3.822 -8.401 3.056 1.00 0.00 H new ATOM 0 HG LEU A 68 -3.630 -8.998 5.405 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -5.778 -10.128 5.750 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -5.865 -8.865 4.499 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -5.803 -10.580 4.029 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -3.750 -11.383 6.127 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -3.638 -11.886 4.424 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -2.274 -11.042 5.194 1.00 0.00 H new ATOM 1114 N SER A 69 -4.985 -9.159 0.403 1.00 0.00 N ATOM 1115 CA SER A 69 -6.201 -8.825 -0.347 1.00 0.00 C ATOM 1116 C SER A 69 -6.730 -10.059 -1.124 1.00 0.00 C ATOM 1117 O SER A 69 -7.902 -10.153 -1.451 1.00 0.00 O ATOM 1118 CB SER A 69 -5.918 -7.704 -1.318 1.00 0.00 C ATOM 1119 OG SER A 69 -5.125 -6.705 -0.733 1.00 0.00 O ATOM 0 H SER A 69 -4.146 -8.676 0.081 1.00 0.00 H new ATOM 0 HA SER A 69 -6.962 -8.509 0.366 1.00 0.00 H new ATOM 0 HB2 SER A 69 -5.413 -8.102 -2.198 1.00 0.00 H new ATOM 0 HB3 SER A 69 -6.858 -7.271 -1.659 1.00 0.00 H new ATOM 0 HG SER A 69 -5.683 -6.139 -0.159 1.00 0.00 H new ATOM 1125 N LYS A 70 -5.857 -11.011 -1.401 1.00 0.00 N ATOM 1126 CA LYS A 70 -6.272 -12.214 -2.115 1.00 0.00 C ATOM 1127 C LYS A 70 -6.930 -13.196 -1.153 1.00 0.00 C ATOM 1128 O LYS A 70 -7.611 -14.140 -1.572 1.00 0.00 O ATOM 1129 CB LYS A 70 -5.126 -12.915 -2.915 1.00 0.00 C ATOM 1130 CG LYS A 70 -4.542 -12.112 -4.096 1.00 0.00 C ATOM 1131 CD LYS A 70 -3.574 -11.051 -3.629 1.00 0.00 C ATOM 1132 CE LYS A 70 -3.196 -10.055 -4.721 1.00 0.00 C ATOM 1133 NZ LYS A 70 -2.433 -10.621 -5.856 1.00 0.00 N ATOM 0 H LYS A 70 -4.869 -10.980 -1.149 1.00 0.00 H new ATOM 0 HA LYS A 70 -6.992 -11.884 -2.864 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -4.316 -13.149 -2.224 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -5.503 -13.864 -3.297 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -4.034 -12.791 -4.781 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -5.353 -11.644 -4.654 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -4.015 -10.511 -2.791 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -2.670 -11.533 -3.257 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -4.108 -9.602 -5.108 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -2.608 -9.255 -4.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -2.165 -9.858 -6.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -1.575 -11.088 -5.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -3.022 -11.316 -6.358 1.00 0.00 H new ATOM 1147 N VAL A 71 -6.728 -12.965 0.134 1.00 0.00 N ATOM 1148 CA VAL A 71 -7.309 -13.807 1.171 1.00 0.00 C ATOM 1149 C VAL A 71 -8.500 -13.055 1.797 1.00 0.00 C ATOM 1150 O VAL A 71 -9.525 -13.636 2.173 1.00 0.00 O ATOM 1151 CB VAL A 71 -6.235 -14.180 2.291 1.00 0.00 C ATOM 1152 CG1 VAL A 71 -4.877 -14.441 1.696 1.00 0.00 C ATOM 1153 CG2 VAL A 71 -6.118 -13.157 3.404 1.00 0.00 C ATOM 0 H VAL A 71 -6.161 -12.195 0.489 1.00 0.00 H new ATOM 0 HA VAL A 71 -7.646 -14.743 0.726 1.00 0.00 H new ATOM 0 HB VAL A 71 -6.616 -15.096 2.743 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -4.174 -14.692 2.490 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -4.941 -15.271 0.993 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -4.531 -13.549 1.173 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -5.368 -13.486 4.123 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -5.822 -12.195 2.985 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -7.080 -13.053 3.906 1.00 0.00 H new ATOM 1163 N ASN A 72 -8.357 -11.750 1.840 1.00 0.00 N ATOM 1164 CA ASN A 72 -9.265 -10.850 2.482 1.00 0.00 C ATOM 1165 C ASN A 72 -9.274 -9.519 1.722 1.00 0.00 C ATOM 1166 O ASN A 72 -8.649 -8.544 2.136 1.00 0.00 O ATOM 1167 CB ASN A 72 -8.779 -10.624 3.936 1.00 0.00 C ATOM 1168 CG ASN A 72 -9.637 -9.704 4.790 1.00 0.00 C ATOM 1169 OD1 ASN A 72 -10.521 -10.152 5.501 1.00 0.00 O ATOM 1170 ND2 ASN A 72 -9.368 -8.422 4.738 1.00 0.00 N ATOM 0 H ASN A 72 -7.566 -11.274 1.406 1.00 0.00 H new ATOM 0 HA ASN A 72 -10.274 -11.262 2.489 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -8.716 -11.593 4.432 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -7.768 -10.217 3.901 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -9.905 -7.765 5.304 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -8.621 -8.082 4.132 1.00 0.00 H new ATOM 1177 N GLY A 73 -9.841 -9.526 0.550 1.00 0.00 N ATOM 1178 CA GLY A 73 -10.050 -8.281 -0.181 1.00 0.00 C ATOM 1179 C GLY A 73 -11.258 -7.539 0.346 1.00 0.00 C ATOM 1180 O GLY A 73 -12.209 -7.281 -0.393 1.00 0.00 O ATOM 0 H GLY A 73 -10.169 -10.365 0.072 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -9.165 -7.651 -0.093 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -10.185 -8.496 -1.241 1.00 0.00 H new ATOM 1184 N TYR A 74 -11.183 -7.157 1.605 1.00 0.00 N ATOM 1185 CA TYR A 74 -12.258 -6.557 2.313 1.00 0.00 C ATOM 1186 C TYR A 74 -12.114 -5.099 2.298 1.00 0.00 C ATOM 1187 O TYR A 74 -11.263 -4.503 2.972 1.00 0.00 O ATOM 1188 CB TYR A 74 -12.353 -7.043 3.765 1.00 0.00 C ATOM 1189 CG TYR A 74 -13.122 -8.328 3.991 1.00 0.00 C ATOM 1190 CD1 TYR A 74 -12.706 -9.535 3.456 1.00 0.00 C ATOM 1191 CD2 TYR A 74 -14.258 -8.326 4.788 1.00 0.00 C ATOM 1192 CE1 TYR A 74 -13.397 -10.700 3.710 1.00 0.00 C ATOM 1193 CE2 TYR A 74 -14.960 -9.474 5.040 1.00 0.00 C ATOM 1194 CZ TYR A 74 -14.525 -10.664 4.501 1.00 0.00 C ATOM 1195 OH TYR A 74 -15.212 -11.827 4.762 1.00 0.00 O ATOM 0 H TYR A 74 -10.339 -7.266 2.167 1.00 0.00 H new ATOM 0 HA TYR A 74 -13.176 -6.853 1.806 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -11.341 -7.177 4.148 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -12.818 -6.257 4.360 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -11.826 -9.564 2.830 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -14.597 -7.396 5.220 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -13.057 -11.636 3.292 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -15.847 -9.446 5.656 1.00 0.00 H new ATOM 0 HH TYR A 74 -15.982 -11.630 5.335 1.00 0.00 H new ATOM 1205 N ILE A 75 -12.924 -4.544 1.536 1.00 0.00 N ATOM 1206 CA ILE A 75 -13.052 -3.165 1.422 1.00 0.00 C ATOM 1207 C ILE A 75 -14.157 -2.786 2.347 1.00 0.00 C ATOM 1208 O ILE A 75 -15.285 -3.292 2.216 1.00 0.00 O ATOM 1209 CB ILE A 75 -13.373 -2.849 -0.021 1.00 0.00 C ATOM 1210 CG1 ILE A 75 -12.133 -3.094 -0.862 1.00 0.00 C ATOM 1211 CG2 ILE A 75 -13.905 -1.422 -0.211 1.00 0.00 C ATOM 1212 CD1 ILE A 75 -12.383 -3.073 -2.354 1.00 0.00 C ATOM 0 H ILE A 75 -13.561 -5.062 0.932 1.00 0.00 H new ATOM 0 HA ILE A 75 -12.151 -2.612 1.685 1.00 0.00 H new ATOM 0 HB ILE A 75 -14.177 -3.508 -0.347 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -11.387 -2.337 -0.619 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -11.708 -4.060 -0.590 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -14.119 -1.251 -1.266 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -14.819 -1.294 0.370 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -13.156 -0.706 0.128 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -11.447 -3.256 -2.882 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -13.104 -3.849 -2.613 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -12.778 -2.099 -2.643 1.00 0.00 H new ATOM 1224 N GLY A 76 -13.830 -1.997 3.306 1.00 0.00 N ATOM 1225 CA GLY A 76 -14.770 -1.655 4.303 1.00 0.00 C ATOM 1226 C GLY A 76 -14.963 -0.185 4.447 1.00 0.00 C ATOM 1227 O GLY A 76 -14.007 0.606 4.530 1.00 0.00 O ATOM 0 H GLY A 76 -12.909 -1.574 3.419 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -15.727 -2.119 4.065 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -14.444 -2.068 5.258 1.00 0.00 H new ATOM 1231 N VAL A 77 -16.165 0.217 4.495 1.00 0.00 N ATOM 1232 CA VAL A 77 -16.381 1.573 4.721 1.00 0.00 C ATOM 1233 C VAL A 77 -16.859 1.780 6.084 1.00 0.00 C ATOM 1234 O VAL A 77 -17.551 0.936 6.666 1.00 0.00 O ATOM 1235 CB VAL A 77 -17.310 2.295 3.721 1.00 0.00 C ATOM 1236 CG1 VAL A 77 -16.807 2.178 2.308 1.00 0.00 C ATOM 1237 CG2 VAL A 77 -18.739 1.863 3.867 1.00 0.00 C ATOM 0 H VAL A 77 -16.997 -0.362 4.383 1.00 0.00 H new ATOM 0 HA VAL A 77 -15.405 2.033 4.565 1.00 0.00 H new ATOM 0 HB VAL A 77 -17.289 3.356 3.968 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -17.488 2.699 1.635 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -15.815 2.624 2.237 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -16.753 1.126 2.027 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -19.356 2.396 3.144 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -18.815 0.791 3.688 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -19.086 2.088 4.876 1.00 0.00 H new ATOM 1247 N SER A 78 -16.452 2.845 6.623 1.00 0.00 N ATOM 1248 CA SER A 78 -16.944 3.236 7.868 1.00 0.00 C ATOM 1249 C SER A 78 -18.203 4.031 7.572 1.00 0.00 C ATOM 1250 O SER A 78 -18.419 4.404 6.407 1.00 0.00 O ATOM 1251 CB SER A 78 -15.894 4.040 8.597 1.00 0.00 C ATOM 1252 OG SER A 78 -14.679 3.309 8.672 1.00 0.00 O ATOM 0 H SER A 78 -15.764 3.476 6.213 1.00 0.00 H new ATOM 0 HA SER A 78 -17.181 2.397 8.522 1.00 0.00 H new ATOM 0 HB2 SER A 78 -15.727 4.985 8.081 1.00 0.00 H new ATOM 0 HB3 SER A 78 -16.243 4.282 9.601 1.00 0.00 H new ATOM 0 HG SER A 78 -14.006 3.841 9.145 1.00 0.00 H new ATOM 1258 N ASP A 79 -18.988 4.303 8.580 1.00 0.00 N ATOM 1259 CA ASP A 79 -20.321 4.925 8.452 1.00 0.00 C ATOM 1260 C ASP A 79 -20.312 6.198 7.602 1.00 0.00 C ATOM 1261 O ASP A 79 -21.257 6.474 6.883 1.00 0.00 O ATOM 1262 CB ASP A 79 -20.874 5.238 9.838 1.00 0.00 C ATOM 1263 CG ASP A 79 -22.329 5.645 9.831 1.00 0.00 C ATOM 1264 OD1 ASP A 79 -22.642 6.850 9.728 1.00 0.00 O ATOM 1265 OD2 ASP A 79 -23.188 4.767 9.980 1.00 0.00 O ATOM 0 H ASP A 79 -18.731 4.101 9.546 1.00 0.00 H new ATOM 0 HA ASP A 79 -20.959 4.206 7.938 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -20.754 4.361 10.474 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -20.284 6.039 10.283 1.00 0.00 H new ATOM 1270 N ASN A 80 -19.212 6.921 7.627 1.00 0.00 N ATOM 1271 CA ASN A 80 -19.113 8.185 6.894 1.00 0.00 C ATOM 1272 C ASN A 80 -18.826 7.959 5.412 1.00 0.00 C ATOM 1273 O ASN A 80 -18.724 8.902 4.676 1.00 0.00 O ATOM 1274 CB ASN A 80 -18.022 9.124 7.475 1.00 0.00 C ATOM 1275 CG ASN A 80 -18.305 9.716 8.841 1.00 0.00 C ATOM 1276 OD1 ASN A 80 -17.944 10.860 9.120 1.00 0.00 O ATOM 1277 ND2 ASN A 80 -18.812 8.930 9.721 1.00 0.00 N ATOM 0 H ASN A 80 -18.371 6.664 8.143 1.00 0.00 H new ATOM 0 HA ASN A 80 -20.085 8.665 7.008 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -17.086 8.568 7.530 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -17.866 9.943 6.773 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -18.926 9.248 10.684 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -19.101 7.988 9.457 1.00 0.00 H new ATOM 1284 N GLY A 81 -18.729 6.698 5.003 1.00 0.00 N ATOM 1285 CA GLY A 81 -18.372 6.334 3.659 1.00 0.00 C ATOM 1286 C GLY A 81 -16.885 6.297 3.493 1.00 0.00 C ATOM 1287 O GLY A 81 -16.361 6.636 2.459 1.00 0.00 O ATOM 0 H GLY A 81 -18.901 5.898 5.613 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -18.793 5.358 3.418 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -18.803 7.049 2.958 1.00 0.00 H new ATOM 1291 N VAL A 82 -16.214 5.888 4.526 1.00 0.00 N ATOM 1292 CA VAL A 82 -14.760 5.863 4.534 1.00 0.00 C ATOM 1293 C VAL A 82 -14.259 4.606 3.781 1.00 0.00 C ATOM 1294 O VAL A 82 -14.435 3.522 4.244 1.00 0.00 O ATOM 1295 CB VAL A 82 -14.225 5.892 5.992 1.00 0.00 C ATOM 1296 CG1 VAL A 82 -12.719 6.087 6.025 1.00 0.00 C ATOM 1297 CG2 VAL A 82 -14.938 6.979 6.816 1.00 0.00 C ATOM 0 H VAL A 82 -16.645 5.561 5.391 1.00 0.00 H new ATOM 0 HA VAL A 82 -14.381 6.749 4.024 1.00 0.00 H new ATOM 0 HB VAL A 82 -14.443 4.925 6.444 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -12.377 6.103 7.060 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -12.234 5.267 5.495 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -12.464 7.031 5.544 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -14.546 6.980 7.833 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -14.765 7.954 6.360 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -16.008 6.774 6.839 1.00 0.00 H new ATOM 1307 N ILE A 83 -13.535 4.825 2.702 1.00 0.00 N ATOM 1308 CA ILE A 83 -13.145 3.820 1.636 1.00 0.00 C ATOM 1309 C ILE A 83 -11.946 2.925 2.026 1.00 0.00 C ATOM 1310 O ILE A 83 -11.083 2.618 1.226 1.00 0.00 O ATOM 1311 CB ILE A 83 -12.929 4.531 0.235 1.00 0.00 C ATOM 1312 CG1 ILE A 83 -14.152 5.383 -0.080 1.00 0.00 C ATOM 1313 CG2 ILE A 83 -12.732 3.517 -0.917 1.00 0.00 C ATOM 1314 CD1 ILE A 83 -15.437 4.596 -0.015 1.00 0.00 C ATOM 0 H ILE A 83 -13.163 5.753 2.499 1.00 0.00 H new ATOM 0 HA ILE A 83 -13.987 3.135 1.543 1.00 0.00 H new ATOM 0 HB ILE A 83 -12.026 5.137 0.311 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -14.203 6.214 0.624 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -14.044 5.814 -1.075 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -12.588 4.055 -1.854 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -11.856 2.901 -0.714 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -13.613 2.880 -0.996 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -16.277 5.251 -0.248 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -15.401 3.781 -0.738 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -15.563 4.187 0.987 1.00 0.00 H new ATOM 1326 N SER A 84 -11.858 2.569 3.243 1.00 0.00 N ATOM 1327 CA SER A 84 -10.622 1.950 3.694 1.00 0.00 C ATOM 1328 C SER A 84 -10.689 0.410 3.613 1.00 0.00 C ATOM 1329 O SER A 84 -11.742 -0.179 3.640 1.00 0.00 O ATOM 1330 CB SER A 84 -10.371 2.415 5.104 1.00 0.00 C ATOM 1331 OG SER A 84 -10.530 3.822 5.146 1.00 0.00 O ATOM 0 H SER A 84 -12.587 2.678 3.949 1.00 0.00 H new ATOM 0 HA SER A 84 -9.799 2.248 3.044 1.00 0.00 H new ATOM 0 HB2 SER A 84 -11.067 1.934 5.791 1.00 0.00 H new ATOM 0 HB3 SER A 84 -9.366 2.137 5.422 1.00 0.00 H new ATOM 0 HG SER A 84 -10.371 4.142 6.059 1.00 0.00 H new ATOM 1337 N THR A 85 -9.584 -0.224 3.430 1.00 0.00 N ATOM 1338 CA THR A 85 -9.585 -1.645 3.449 1.00 0.00 C ATOM 1339 C THR A 85 -9.327 -2.093 4.862 1.00 0.00 C ATOM 1340 O THR A 85 -8.620 -1.395 5.640 1.00 0.00 O ATOM 1341 CB THR A 85 -8.572 -2.274 2.452 1.00 0.00 C ATOM 1342 OG1 THR A 85 -7.246 -1.824 2.718 1.00 0.00 O ATOM 1343 CG2 THR A 85 -8.950 -1.921 1.022 1.00 0.00 C ATOM 0 H THR A 85 -8.677 0.213 3.267 1.00 0.00 H new ATOM 0 HA THR A 85 -10.560 -1.997 3.113 1.00 0.00 H new ATOM 0 HB THR A 85 -8.606 -3.356 2.580 1.00 0.00 H new ATOM 0 HG1 THR A 85 -6.812 -1.570 1.877 1.00 0.00 H new ATOM 0 HG21 THR A 85 -8.232 -2.368 0.335 1.00 0.00 H new ATOM 0 HG22 THR A 85 -9.947 -2.303 0.804 1.00 0.00 H new ATOM 0 HG23 THR A 85 -8.942 -0.838 0.900 1.00 0.00 H new ATOM 1351 N PHE A 86 -9.930 -3.183 5.241 1.00 0.00 N ATOM 1352 CA PHE A 86 -9.794 -3.675 6.573 1.00 0.00 C ATOM 1353 C PHE A 86 -9.559 -5.163 6.557 1.00 0.00 C ATOM 1354 O PHE A 86 -9.870 -5.832 5.577 1.00 0.00 O ATOM 1355 CB PHE A 86 -11.034 -3.378 7.423 1.00 0.00 C ATOM 1356 CG PHE A 86 -11.254 -1.938 7.790 1.00 0.00 C ATOM 1357 CD1 PHE A 86 -11.895 -1.072 6.925 1.00 0.00 C ATOM 1358 CD2 PHE A 86 -10.847 -1.467 9.021 1.00 0.00 C ATOM 1359 CE1 PHE A 86 -12.124 0.241 7.282 1.00 0.00 C ATOM 1360 CE2 PHE A 86 -11.076 -0.159 9.389 1.00 0.00 C ATOM 1361 CZ PHE A 86 -11.718 0.698 8.519 1.00 0.00 C ATOM 0 H PHE A 86 -10.525 -3.749 4.637 1.00 0.00 H new ATOM 0 HA PHE A 86 -8.940 -3.163 7.017 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -11.912 -3.733 6.884 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -10.967 -3.960 8.342 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -12.221 -1.427 5.958 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -10.342 -2.132 9.706 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -12.620 0.910 6.594 1.00 0.00 H new ATOM 0 HE2 PHE A 86 -10.753 0.195 10.357 1.00 0.00 H new ATOM 0 HZ PHE A 86 -11.902 1.723 8.805 1.00 0.00 H new ATOM 1371 N HIS A 87 -9.030 -5.681 7.632 1.00 0.00 N ATOM 1372 CA HIS A 87 -8.818 -7.100 7.751 1.00 0.00 C ATOM 1373 C HIS A 87 -10.008 -7.717 8.478 1.00 0.00 C ATOM 1374 O HIS A 87 -10.326 -7.334 9.620 1.00 0.00 O ATOM 1375 CB HIS A 87 -7.456 -7.437 8.423 1.00 0.00 C ATOM 1376 CG HIS A 87 -7.250 -6.895 9.818 1.00 0.00 C ATOM 1377 ND1 HIS A 87 -7.222 -7.678 10.953 1.00 0.00 N ATOM 1378 CD2 HIS A 87 -7.024 -5.628 10.236 1.00 0.00 C ATOM 1379 CE1 HIS A 87 -6.988 -6.880 11.999 1.00 0.00 C ATOM 1380 NE2 HIS A 87 -6.859 -5.624 11.615 1.00 0.00 N ATOM 0 H HIS A 87 -8.736 -5.138 8.444 1.00 0.00 H new ATOM 0 HA HIS A 87 -8.755 -7.539 6.755 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -7.350 -8.521 8.457 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -6.656 -7.058 7.786 1.00 0.00 H new ATOM 0 HD1 HIS A 87 -7.356 -8.689 10.988 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -6.979 -4.758 9.598 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -6.914 -7.218 13.022 1.00 0.00 H new ATOM 1388 N GLY A 88 -10.687 -8.618 7.806 1.00 0.00 N ATOM 1389 CA GLY A 88 -11.883 -9.211 8.332 1.00 0.00 C ATOM 1390 C GLY A 88 -13.041 -8.250 8.217 1.00 0.00 C ATOM 1391 O GLY A 88 -12.936 -7.236 7.512 1.00 0.00 O ATOM 0 H GLY A 88 -10.422 -8.956 6.881 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -12.109 -10.130 7.791 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -11.732 -9.485 9.376 1.00 0.00 H new ATOM 1395 N ARG A 89 -14.139 -8.574 8.866 1.00 0.00 N ATOM 1396 CA ARG A 89 -15.292 -7.698 8.945 1.00 0.00 C ATOM 1397 C ARG A 89 -14.874 -6.346 9.542 1.00 0.00 C ATOM 1398 O ARG A 89 -14.322 -6.296 10.653 1.00 0.00 O ATOM 1399 CB ARG A 89 -16.384 -8.333 9.810 1.00 0.00 C ATOM 1400 CG ARG A 89 -17.066 -9.561 9.211 1.00 0.00 C ATOM 1401 CD ARG A 89 -17.880 -9.199 7.974 1.00 0.00 C ATOM 1402 NE ARG A 89 -18.619 -10.338 7.436 1.00 0.00 N ATOM 1403 CZ ARG A 89 -18.991 -10.488 6.160 1.00 0.00 C ATOM 1404 NH1 ARG A 89 -18.634 -9.592 5.234 1.00 0.00 N ATOM 1405 NH2 ARG A 89 -19.709 -11.543 5.813 1.00 0.00 N ATOM 0 H ARG A 89 -14.259 -9.459 9.358 1.00 0.00 H new ATOM 0 HA ARG A 89 -15.687 -7.543 7.941 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -15.947 -8.613 10.768 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -17.145 -7.580 10.015 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -16.314 -10.305 8.948 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -17.718 -10.017 9.956 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -18.580 -8.402 8.224 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -17.213 -8.808 7.206 1.00 0.00 H new ATOM 0 HE ARG A 89 -18.873 -11.081 8.087 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -18.072 -8.783 5.497 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -18.924 -9.718 4.264 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -19.974 -12.233 6.516 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -19.998 -11.667 4.843 1.00 0.00 H new ATOM 1419 N PRO A 90 -15.073 -5.259 8.794 1.00 0.00 N ATOM 1420 CA PRO A 90 -14.703 -3.928 9.222 1.00 0.00 C ATOM 1421 C PRO A 90 -15.488 -3.477 10.443 1.00 0.00 C ATOM 1422 O PRO A 90 -16.684 -3.160 10.375 1.00 0.00 O ATOM 1423 CB PRO A 90 -14.979 -3.023 8.017 1.00 0.00 C ATOM 1424 CG PRO A 90 -15.801 -3.830 7.078 1.00 0.00 C ATOM 1425 CD PRO A 90 -15.649 -5.275 7.459 1.00 0.00 C ATOM 0 HA PRO A 90 -13.658 -3.892 9.528 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -15.508 -2.119 8.321 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -14.049 -2.705 7.547 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -16.847 -3.529 7.131 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -15.475 -3.670 6.050 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -16.611 -5.787 7.451 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -15.002 -5.801 6.757 1.00 0.00 H new ATOM 1433 N GLU A 91 -14.830 -3.536 11.546 1.00 0.00 N ATOM 1434 CA GLU A 91 -15.347 -3.116 12.805 1.00 0.00 C ATOM 1435 C GLU A 91 -14.374 -2.059 13.331 1.00 0.00 C ATOM 1436 O GLU A 91 -13.257 -1.976 12.819 1.00 0.00 O ATOM 1437 CB GLU A 91 -15.434 -4.342 13.753 1.00 0.00 C ATOM 1438 CG GLU A 91 -14.101 -5.020 14.041 1.00 0.00 C ATOM 1439 CD GLU A 91 -14.241 -6.218 14.945 1.00 0.00 C ATOM 1440 OE1 GLU A 91 -14.421 -6.040 16.166 1.00 0.00 O ATOM 1441 OE2 GLU A 91 -14.154 -7.358 14.459 1.00 0.00 O ATOM 0 H GLU A 91 -13.876 -3.893 11.601 1.00 0.00 H new ATOM 0 HA GLU A 91 -16.350 -2.697 12.730 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -15.875 -4.023 14.697 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -16.112 -5.075 13.316 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -13.645 -5.331 13.101 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -13.424 -4.300 14.501 1.00 0.00 H new ATOM 1448 N PRO A 92 -14.737 -1.248 14.343 1.00 0.00 N ATOM 1449 CA PRO A 92 -13.835 -0.199 14.872 1.00 0.00 C ATOM 1450 C PRO A 92 -12.632 -0.787 15.600 1.00 0.00 C ATOM 1451 O PRO A 92 -11.657 -0.089 15.913 1.00 0.00 O ATOM 1452 CB PRO A 92 -14.705 0.596 15.840 1.00 0.00 C ATOM 1453 CG PRO A 92 -15.834 -0.313 16.198 1.00 0.00 C ATOM 1454 CD PRO A 92 -16.030 -1.258 15.041 1.00 0.00 C ATOM 0 HA PRO A 92 -13.420 0.410 14.069 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -14.141 0.889 16.725 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -15.070 1.513 15.377 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -15.609 -0.864 17.111 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -16.743 0.258 16.386 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -16.289 -2.259 15.385 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -16.837 -0.926 14.388 1.00 0.00 H new ATOM 1462 N ALA A 93 -12.710 -2.062 15.861 1.00 0.00 N ATOM 1463 CA ALA A 93 -11.648 -2.766 16.496 1.00 0.00 C ATOM 1464 C ALA A 93 -10.691 -3.329 15.458 1.00 0.00 C ATOM 1465 O ALA A 93 -9.647 -3.872 15.798 1.00 0.00 O ATOM 1466 CB ALA A 93 -12.201 -3.853 17.381 1.00 0.00 C ATOM 0 H ALA A 93 -13.520 -2.639 15.635 1.00 0.00 H new ATOM 0 HA ALA A 93 -11.088 -2.073 17.124 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -11.379 -4.384 17.861 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -12.842 -3.410 18.144 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -12.782 -4.552 16.779 1.00 0.00 H new ATOM 1472 N SER A 94 -11.043 -3.194 14.196 1.00 0.00 N ATOM 1473 CA SER A 94 -10.169 -3.651 13.144 1.00 0.00 C ATOM 1474 C SER A 94 -9.228 -2.507 12.821 1.00 0.00 C ATOM 1475 O SER A 94 -9.537 -1.330 13.119 1.00 0.00 O ATOM 1476 CB SER A 94 -10.970 -4.084 11.898 1.00 0.00 C ATOM 1477 OG SER A 94 -10.149 -4.708 10.911 1.00 0.00 O ATOM 0 H SER A 94 -11.918 -2.776 13.880 1.00 0.00 H new ATOM 0 HA SER A 94 -9.609 -4.529 13.467 1.00 0.00 H new ATOM 0 HB2 SER A 94 -11.759 -4.773 12.199 1.00 0.00 H new ATOM 0 HB3 SER A 94 -11.458 -3.212 11.462 1.00 0.00 H new ATOM 0 HG SER A 94 -10.493 -5.605 10.718 1.00 0.00 H new ATOM 1483 N GLU A 95 -8.114 -2.815 12.245 1.00 0.00 N ATOM 1484 CA GLU A 95 -7.135 -1.807 11.951 1.00 0.00 C ATOM 1485 C GLU A 95 -7.329 -1.278 10.558 1.00 0.00 C ATOM 1486 O GLU A 95 -7.367 -2.059 9.594 1.00 0.00 O ATOM 1487 CB GLU A 95 -5.711 -2.336 12.079 1.00 0.00 C ATOM 1488 CG GLU A 95 -5.339 -2.855 13.449 1.00 0.00 C ATOM 1489 CD GLU A 95 -3.870 -3.167 13.535 1.00 0.00 C ATOM 1490 OE1 GLU A 95 -3.441 -4.249 13.068 1.00 0.00 O ATOM 1491 OE2 GLU A 95 -3.104 -2.324 14.071 1.00 0.00 O ATOM 0 H GLU A 95 -7.852 -3.760 11.965 1.00 0.00 H new ATOM 0 HA GLU A 95 -7.276 -1.010 12.681 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -5.572 -3.138 11.354 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -5.018 -1.539 11.810 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -5.600 -2.114 14.204 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -5.917 -3.752 13.670 1.00 0.00 H new ATOM 1498 N PRO A 96 -7.507 0.042 10.412 1.00 0.00 N ATOM 1499 CA PRO A 96 -7.542 0.660 9.118 1.00 0.00 C ATOM 1500 C PRO A 96 -6.181 0.518 8.495 1.00 0.00 C ATOM 1501 O PRO A 96 -5.161 0.982 9.049 1.00 0.00 O ATOM 1502 CB PRO A 96 -7.853 2.130 9.383 1.00 0.00 C ATOM 1503 CG PRO A 96 -8.333 2.178 10.781 1.00 0.00 C ATOM 1504 CD PRO A 96 -7.711 1.012 11.489 1.00 0.00 C ATOM 0 HA PRO A 96 -8.278 0.216 8.448 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -6.967 2.750 9.249 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -8.610 2.503 8.693 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -8.048 3.117 11.256 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -9.421 2.119 10.819 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -6.771 1.286 11.969 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -8.364 0.618 12.268 1.00 0.00 H new ATOM 1512 N ILE A 97 -6.152 -0.159 7.408 1.00 0.00 N ATOM 1513 CA ILE A 97 -4.922 -0.448 6.707 1.00 0.00 C ATOM 1514 C ILE A 97 -4.397 0.829 6.054 1.00 0.00 C ATOM 1515 O ILE A 97 -3.195 1.031 5.908 1.00 0.00 O ATOM 1516 CB ILE A 97 -5.173 -1.558 5.668 1.00 0.00 C ATOM 1517 CG1 ILE A 97 -5.745 -2.794 6.376 1.00 0.00 C ATOM 1518 CG2 ILE A 97 -3.891 -1.916 4.946 1.00 0.00 C ATOM 1519 CD1 ILE A 97 -6.239 -3.860 5.437 1.00 0.00 C ATOM 0 H ILE A 97 -6.985 -0.541 6.960 1.00 0.00 H new ATOM 0 HA ILE A 97 -4.164 -0.805 7.404 1.00 0.00 H new ATOM 0 HB ILE A 97 -5.888 -1.197 4.929 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -4.976 -3.220 7.021 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -6.566 -2.483 7.022 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -4.091 -2.701 4.217 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -3.504 -1.035 4.433 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -3.154 -2.269 5.667 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -6.628 -4.700 6.012 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -7.031 -3.453 4.809 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -5.416 -4.201 4.808 1.00 0.00 H new ATOM 1531 N GLN A 98 -5.324 1.672 5.698 1.00 0.00 N ATOM 1532 CA GLN A 98 -5.083 2.985 5.147 1.00 0.00 C ATOM 1533 C GLN A 98 -6.443 3.651 5.178 1.00 0.00 C ATOM 1534 O GLN A 98 -7.386 3.047 5.695 1.00 0.00 O ATOM 1535 CB GLN A 98 -4.561 2.904 3.664 1.00 0.00 C ATOM 1536 CG GLN A 98 -5.654 2.766 2.577 1.00 0.00 C ATOM 1537 CD GLN A 98 -6.534 1.542 2.715 1.00 0.00 C ATOM 1538 OE1 GLN A 98 -7.709 1.584 2.410 1.00 0.00 O ATOM 1539 NE2 GLN A 98 -5.975 0.465 3.121 1.00 0.00 N ATOM 0 H GLN A 98 -6.317 1.457 5.786 1.00 0.00 H new ATOM 0 HA GLN A 98 -4.321 3.526 5.708 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -3.976 3.800 3.454 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -3.883 2.054 3.582 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -6.285 3.655 2.601 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -5.173 2.743 1.599 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -4.986 0.466 3.369 1.00 0.00 H new ATOM 0 HE22 GLN A 98 -6.519 -0.395 3.197 1.00 0.00 H new ATOM 1548 N SER A 99 -6.558 4.829 4.651 1.00 0.00 N ATOM 1549 CA SER A 99 -7.830 5.444 4.466 1.00 0.00 C ATOM 1550 C SER A 99 -7.795 6.293 3.192 1.00 0.00 C ATOM 1551 O SER A 99 -7.111 7.320 3.139 1.00 0.00 O ATOM 1552 CB SER A 99 -8.243 6.244 5.714 1.00 0.00 C ATOM 1553 OG SER A 99 -7.172 7.050 6.184 1.00 0.00 O ATOM 0 H SER A 99 -5.768 5.392 4.336 1.00 0.00 H new ATOM 0 HA SER A 99 -8.598 4.681 4.337 1.00 0.00 H new ATOM 0 HB2 SER A 99 -9.100 6.875 5.478 1.00 0.00 H new ATOM 0 HB3 SER A 99 -8.559 5.559 6.501 1.00 0.00 H new ATOM 0 HG SER A 99 -6.714 7.463 5.422 1.00 0.00 H new ATOM 1559 N PHE A 100 -8.473 5.830 2.146 1.00 0.00 N ATOM 1560 CA PHE A 100 -8.479 6.542 0.873 1.00 0.00 C ATOM 1561 C PHE A 100 -9.252 7.855 0.938 1.00 0.00 C ATOM 1562 O PHE A 100 -8.646 8.934 0.938 1.00 0.00 O ATOM 1563 CB PHE A 100 -8.975 5.666 -0.286 1.00 0.00 C ATOM 1564 CG PHE A 100 -8.058 4.523 -0.617 1.00 0.00 C ATOM 1565 CD1 PHE A 100 -6.820 4.763 -1.187 1.00 0.00 C ATOM 1566 CD2 PHE A 100 -8.426 3.217 -0.355 1.00 0.00 C ATOM 1567 CE1 PHE A 100 -5.969 3.722 -1.488 1.00 0.00 C ATOM 1568 CE2 PHE A 100 -7.579 2.172 -0.657 1.00 0.00 C ATOM 1569 CZ PHE A 100 -6.349 2.426 -1.223 1.00 0.00 C ATOM 0 H PHE A 100 -9.022 4.970 2.154 1.00 0.00 H new ATOM 0 HA PHE A 100 -7.437 6.791 0.671 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -9.959 5.269 -0.034 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -9.099 6.288 -1.172 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -6.517 5.778 -1.398 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -9.388 3.013 0.091 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -5.005 3.923 -1.931 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -7.879 1.155 -0.450 1.00 0.00 H new ATOM 0 HZ PHE A 100 -5.683 1.609 -1.459 1.00 0.00 H new ATOM 1579 N PHE A 101 -10.564 7.785 1.020 1.00 0.00 N ATOM 1580 CA PHE A 101 -11.366 8.990 1.032 1.00 0.00 C ATOM 1581 C PHE A 101 -12.719 8.670 1.673 1.00 0.00 C ATOM 1582 O PHE A 101 -12.937 7.518 2.082 1.00 0.00 O ATOM 1583 CB PHE A 101 -11.515 9.515 -0.412 1.00 0.00 C ATOM 1584 CG PHE A 101 -11.887 10.962 -0.507 1.00 0.00 C ATOM 1585 CD1 PHE A 101 -11.064 11.929 0.047 1.00 0.00 C ATOM 1586 CD2 PHE A 101 -13.036 11.359 -1.155 1.00 0.00 C ATOM 1587 CE1 PHE A 101 -11.387 13.262 -0.042 1.00 0.00 C ATOM 1588 CE2 PHE A 101 -13.361 12.692 -1.245 1.00 0.00 C ATOM 1589 CZ PHE A 101 -12.538 13.644 -0.689 1.00 0.00 C ATOM 0 H PHE A 101 -11.094 6.915 1.079 1.00 0.00 H new ATOM 0 HA PHE A 101 -10.889 9.775 1.619 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -10.575 9.358 -0.942 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -12.273 8.923 -0.925 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -10.158 11.632 0.555 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -13.686 10.618 -1.596 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -10.739 14.007 0.395 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -14.265 12.993 -1.754 1.00 0.00 H new ATOM 0 HZ PHE A 101 -12.796 14.690 -0.761 1.00 0.00 H new ATOM 1599 N GLN A 102 -13.595 9.654 1.775 1.00 0.00 N ATOM 1600 CA GLN A 102 -14.865 9.509 2.391 1.00 0.00 C ATOM 1601 C GLN A 102 -15.957 9.852 1.361 1.00 0.00 C ATOM 1602 O GLN A 102 -15.799 10.805 0.603 1.00 0.00 O ATOM 1603 CB GLN A 102 -14.932 10.493 3.542 1.00 0.00 C ATOM 1604 CG GLN A 102 -16.109 10.303 4.389 1.00 0.00 C ATOM 1605 CD GLN A 102 -16.366 11.470 5.304 1.00 0.00 C ATOM 1606 OE1 GLN A 102 -17.097 12.396 4.958 1.00 0.00 O ATOM 1607 NE2 GLN A 102 -15.755 11.463 6.454 1.00 0.00 N ATOM 0 H GLN A 102 -13.421 10.593 1.417 1.00 0.00 H new ATOM 0 HA GLN A 102 -15.013 8.491 2.750 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -14.033 10.393 4.151 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -14.937 11.508 3.145 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -16.983 10.143 3.758 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -15.979 9.401 4.987 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -15.156 10.678 6.708 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -15.876 12.243 7.100 1.00 0.00 H new ATOM 1616 N ILE A 103 -17.023 9.065 1.314 1.00 0.00 N ATOM 1617 CA ILE A 103 -18.133 9.290 0.393 1.00 0.00 C ATOM 1618 C ILE A 103 -19.473 9.151 1.132 1.00 0.00 C ATOM 1619 O ILE A 103 -19.556 8.488 2.180 1.00 0.00 O ATOM 1620 CB ILE A 103 -18.122 8.292 -0.810 1.00 0.00 C ATOM 1621 CG1 ILE A 103 -18.438 6.868 -0.340 1.00 0.00 C ATOM 1622 CG2 ILE A 103 -16.769 8.334 -1.522 1.00 0.00 C ATOM 1623 CD1 ILE A 103 -18.559 5.871 -1.462 1.00 0.00 C ATOM 0 H ILE A 103 -17.144 8.250 1.915 1.00 0.00 H new ATOM 0 HA ILE A 103 -18.013 10.300 0.001 1.00 0.00 H new ATOM 0 HB ILE A 103 -18.896 8.596 -1.514 1.00 0.00 H new ATOM 0 HG12 ILE A 103 -17.655 6.539 0.343 1.00 0.00 H new ATOM 0 HG13 ILE A 103 -19.370 6.880 0.225 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -16.776 7.634 -2.358 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -16.585 9.342 -1.894 1.00 0.00 H new ATOM 0 HG23 ILE A 103 -15.981 8.056 -0.822 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -18.783 4.887 -1.051 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -19.361 6.175 -2.134 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -17.620 5.829 -2.014 1.00 0.00 H new ATOM 1635 N ASP A 104 -20.510 9.759 0.601 1.00 0.00 N ATOM 1636 CA ASP A 104 -21.821 9.674 1.213 1.00 0.00 C ATOM 1637 C ASP A 104 -22.500 8.363 0.925 1.00 0.00 C ATOM 1638 O ASP A 104 -22.906 8.070 -0.226 1.00 0.00 O ATOM 1639 CB ASP A 104 -22.737 10.832 0.829 1.00 0.00 C ATOM 1640 CG ASP A 104 -22.870 11.832 1.949 1.00 0.00 C ATOM 1641 OD1 ASP A 104 -23.054 11.412 3.103 1.00 0.00 O ATOM 1642 OD2 ASP A 104 -22.784 13.051 1.704 1.00 0.00 O ATOM 0 H ASP A 104 -20.473 10.317 -0.252 1.00 0.00 H new ATOM 0 HA ASP A 104 -21.639 9.741 2.286 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -22.343 11.329 -0.058 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -23.722 10.446 0.567 1.00 0.00 H new ATOM 1647 N LEU A 105 -22.677 7.576 1.955 1.00 0.00 N ATOM 1648 CA LEU A 105 -23.305 6.299 1.793 1.00 0.00 C ATOM 1649 C LEU A 105 -24.757 6.439 1.423 1.00 0.00 C ATOM 1650 O LEU A 105 -25.311 5.601 0.724 1.00 0.00 O ATOM 1651 CB LEU A 105 -23.135 5.392 2.989 1.00 0.00 C ATOM 1652 CG LEU A 105 -21.736 4.891 3.293 1.00 0.00 C ATOM 1653 CD1 LEU A 105 -21.847 3.730 4.241 1.00 0.00 C ATOM 1654 CD2 LEU A 105 -20.987 4.487 2.021 1.00 0.00 C ATOM 0 H LEU A 105 -22.395 7.799 2.909 1.00 0.00 H new ATOM 0 HA LEU A 105 -22.785 5.816 0.965 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -23.501 5.922 3.868 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -23.780 4.525 2.848 1.00 0.00 H new ATOM 0 HG LEU A 105 -21.159 5.695 3.749 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -20.851 3.354 4.473 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -22.335 4.056 5.159 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -22.436 2.938 3.779 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -19.989 4.134 2.283 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -21.533 3.691 1.515 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -20.905 5.348 1.358 1.00 0.00 H new ATOM 1666 N GLU A 106 -25.354 7.512 1.867 1.00 0.00 N ATOM 1667 CA GLU A 106 -26.725 7.833 1.532 1.00 0.00 C ATOM 1668 C GLU A 106 -26.863 8.139 0.035 1.00 0.00 C ATOM 1669 O GLU A 106 -27.957 8.049 -0.530 1.00 0.00 O ATOM 1670 CB GLU A 106 -27.197 9.032 2.348 1.00 0.00 C ATOM 1671 CG GLU A 106 -26.270 10.230 2.243 1.00 0.00 C ATOM 1672 CD GLU A 106 -26.836 11.465 2.864 1.00 0.00 C ATOM 1673 OE1 GLU A 106 -26.747 11.623 4.095 1.00 0.00 O ATOM 1674 OE2 GLU A 106 -27.376 12.311 2.134 1.00 0.00 O ATOM 0 H GLU A 106 -24.904 8.196 2.476 1.00 0.00 H new ATOM 0 HA GLU A 106 -27.345 6.968 1.769 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -28.193 9.321 2.013 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -27.285 8.739 3.394 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -25.321 9.991 2.723 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -26.055 10.425 1.192 1.00 0.00 H new ATOM 1681 N ARG A 107 -25.751 8.498 -0.606 1.00 0.00 N ATOM 1682 CA ARG A 107 -25.783 8.841 -2.002 1.00 0.00 C ATOM 1683 C ARG A 107 -25.511 7.602 -2.856 1.00 0.00 C ATOM 1684 O ARG A 107 -25.742 7.602 -4.069 1.00 0.00 O ATOM 1685 CB ARG A 107 -24.854 10.009 -2.308 1.00 0.00 C ATOM 1686 CG ARG A 107 -23.512 9.646 -2.868 1.00 0.00 C ATOM 1687 CD ARG A 107 -22.646 10.869 -3.064 1.00 0.00 C ATOM 1688 NE ARG A 107 -23.323 11.939 -3.782 1.00 0.00 N ATOM 1689 CZ ARG A 107 -22.730 12.985 -4.345 1.00 0.00 C ATOM 1690 NH1 ARG A 107 -21.413 13.125 -4.282 1.00 0.00 N ATOM 1691 NH2 ARG A 107 -23.463 13.900 -4.946 1.00 0.00 N ATOM 0 H ARG A 107 -24.829 8.555 -0.173 1.00 0.00 H new ATOM 0 HA ARG A 107 -26.782 9.189 -2.263 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -25.354 10.671 -3.015 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -24.702 10.578 -1.391 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -23.012 8.949 -2.196 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -23.641 9.133 -3.821 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -22.325 11.239 -2.090 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -21.746 10.586 -3.610 1.00 0.00 H new ATOM 0 HE ARG A 107 -24.338 11.880 -3.859 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -20.848 12.426 -3.799 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -20.964 13.931 -4.717 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -24.478 13.802 -4.976 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -23.016 14.707 -5.381 1.00 0.00 H new ATOM 1705 N LEU A 108 -24.985 6.543 -2.213 1.00 0.00 N ATOM 1706 CA LEU A 108 -24.991 5.194 -2.832 1.00 0.00 C ATOM 1707 C LEU A 108 -26.457 4.812 -3.040 1.00 0.00 C ATOM 1708 O LEU A 108 -27.345 5.459 -2.450 1.00 0.00 O ATOM 1709 CB LEU A 108 -24.336 4.122 -1.902 1.00 0.00 C ATOM 1710 CG LEU A 108 -22.816 3.888 -1.992 1.00 0.00 C ATOM 1711 CD1 LEU A 108 -22.418 3.329 -3.288 1.00 0.00 C ATOM 1712 CD2 LEU A 108 -22.051 5.108 -1.651 1.00 0.00 C ATOM 0 H LEU A 108 -24.559 6.586 -1.287 1.00 0.00 H new ATOM 0 HA LEU A 108 -24.423 5.222 -3.762 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -24.567 4.394 -0.872 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -24.828 3.170 -2.099 1.00 0.00 H new ATOM 0 HG LEU A 108 -22.566 3.138 -1.242 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -21.338 3.181 -3.304 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -22.917 2.372 -3.440 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -22.702 4.017 -4.084 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -20.983 4.901 -1.726 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -22.315 5.908 -2.342 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -22.290 5.415 -0.633 1.00 0.00 H new ATOM 1724 N GLU A 109 -26.753 3.803 -3.853 1.00 0.00 N ATOM 1725 CA GLU A 109 -28.168 3.437 -4.005 1.00 0.00 C ATOM 1726 C GLU A 109 -28.685 2.907 -2.674 1.00 0.00 C ATOM 1727 O GLU A 109 -29.422 3.595 -1.975 1.00 0.00 O ATOM 1728 CB GLU A 109 -28.445 2.426 -5.122 1.00 0.00 C ATOM 1729 CG GLU A 109 -27.946 2.820 -6.488 1.00 0.00 C ATOM 1730 CD GLU A 109 -28.468 1.890 -7.543 1.00 0.00 C ATOM 1731 OE1 GLU A 109 -27.979 0.751 -7.662 1.00 0.00 O ATOM 1732 OE2 GLU A 109 -29.402 2.273 -8.271 1.00 0.00 O ATOM 0 H GLU A 109 -26.084 3.250 -4.389 1.00 0.00 H new ATOM 0 HA GLU A 109 -28.697 4.343 -4.301 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -27.990 1.474 -4.848 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -29.521 2.260 -5.181 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -28.257 3.840 -6.712 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -26.856 2.810 -6.497 1.00 0.00 H new ATOM 1739 N SER A 110 -28.271 1.713 -2.315 1.00 0.00 N ATOM 1740 CA SER A 110 -28.595 1.115 -1.031 1.00 0.00 C ATOM 1741 C SER A 110 -27.648 -0.043 -0.729 1.00 0.00 C ATOM 1742 O SER A 110 -26.830 0.036 0.165 1.00 0.00 O ATOM 1743 CB SER A 110 -30.067 0.616 -0.963 1.00 0.00 C ATOM 1744 OG SER A 110 -30.994 1.671 -1.166 1.00 0.00 O ATOM 0 H SER A 110 -27.693 1.120 -2.910 1.00 0.00 H new ATOM 0 HA SER A 110 -28.475 1.896 -0.280 1.00 0.00 H new ATOM 0 HB2 SER A 110 -30.224 -0.155 -1.717 1.00 0.00 H new ATOM 0 HB3 SER A 110 -30.249 0.154 0.007 1.00 0.00 H new ATOM 0 HG SER A 110 -30.520 2.529 -1.161 1.00 0.00 H new ATOM 1750 N HIS A 111 -27.710 -1.069 -1.536 1.00 0.00 N ATOM 1751 CA HIS A 111 -27.018 -2.328 -1.252 1.00 0.00 C ATOM 1752 C HIS A 111 -25.482 -2.256 -1.362 1.00 0.00 C ATOM 1753 O HIS A 111 -24.786 -2.940 -0.614 1.00 0.00 O ATOM 1754 CB HIS A 111 -27.618 -3.460 -2.103 1.00 0.00 C ATOM 1755 CG HIS A 111 -27.048 -4.823 -1.850 1.00 0.00 C ATOM 1756 ND1 HIS A 111 -26.257 -5.493 -2.744 1.00 0.00 N ATOM 1757 CD2 HIS A 111 -27.199 -5.654 -0.793 1.00 0.00 C ATOM 1758 CE1 HIS A 111 -25.960 -6.675 -2.230 1.00 0.00 C ATOM 1759 NE2 HIS A 111 -26.506 -6.831 -1.043 1.00 0.00 N ATOM 0 H HIS A 111 -28.236 -1.070 -2.410 1.00 0.00 H new ATOM 0 HA HIS A 111 -27.190 -2.547 -0.198 1.00 0.00 H new ATOM 0 HB2 HIS A 111 -28.693 -3.495 -1.925 1.00 0.00 H new ATOM 0 HB3 HIS A 111 -27.477 -3.215 -3.156 1.00 0.00 H new ATOM 0 HD2 HIS A 111 -27.766 -5.437 0.100 1.00 0.00 H new ATOM 0 HE1 HIS A 111 -25.348 -7.417 -2.721 1.00 0.00 H new ATOM 0 HE2 HIS A 111 -26.435 -7.646 -0.434 1.00 0.00 H new ATOM 1767 N MET A 112 -24.960 -1.413 -2.233 1.00 0.00 N ATOM 1768 CA MET A 112 -23.505 -1.320 -2.389 1.00 0.00 C ATOM 1769 C MET A 112 -22.837 -0.879 -1.119 1.00 0.00 C ATOM 1770 O MET A 112 -21.852 -1.469 -0.702 1.00 0.00 O ATOM 1771 CB MET A 112 -23.078 -0.389 -3.502 1.00 0.00 C ATOM 1772 CG MET A 112 -23.340 -0.883 -4.904 1.00 0.00 C ATOM 1773 SD MET A 112 -22.696 0.252 -6.154 1.00 0.00 S ATOM 1774 CE MET A 112 -21.054 0.576 -5.505 1.00 0.00 C ATOM 0 H MET A 112 -25.500 -0.792 -2.835 1.00 0.00 H new ATOM 0 HA MET A 112 -23.188 -2.330 -2.648 1.00 0.00 H new ATOM 0 HB2 MET A 112 -23.590 0.564 -3.370 1.00 0.00 H new ATOM 0 HB3 MET A 112 -22.011 -0.194 -3.399 1.00 0.00 H new ATOM 0 HG2 MET A 112 -22.882 -1.863 -5.034 1.00 0.00 H new ATOM 0 HG3 MET A 112 -24.413 -1.011 -5.049 1.00 0.00 H new ATOM 0 HE1 MET A 112 -20.441 1.036 -6.280 1.00 0.00 H new ATOM 0 HE2 MET A 112 -21.127 1.251 -4.652 1.00 0.00 H new ATOM 0 HE3 MET A 112 -20.596 -0.361 -5.189 1.00 0.00 H new ATOM 1784 N GLN A 113 -23.404 0.130 -0.468 1.00 0.00 N ATOM 1785 CA GLN A 113 -22.813 0.639 0.751 1.00 0.00 C ATOM 1786 C GLN A 113 -22.919 -0.395 1.855 1.00 0.00 C ATOM 1787 O GLN A 113 -22.035 -0.517 2.672 1.00 0.00 O ATOM 1788 CB GLN A 113 -23.417 1.975 1.190 1.00 0.00 C ATOM 1789 CG GLN A 113 -24.888 1.935 1.368 1.00 0.00 C ATOM 1790 CD GLN A 113 -25.375 2.505 2.679 1.00 0.00 C ATOM 1791 OE1 GLN A 113 -25.436 1.800 3.677 1.00 0.00 O ATOM 1792 NE2 GLN A 113 -25.800 3.726 2.675 1.00 0.00 N ATOM 0 H GLN A 113 -24.259 0.602 -0.763 1.00 0.00 H new ATOM 0 HA GLN A 113 -21.761 0.833 0.543 1.00 0.00 H new ATOM 0 HB2 GLN A 113 -22.955 2.282 2.128 1.00 0.00 H new ATOM 0 HB3 GLN A 113 -23.170 2.736 0.450 1.00 0.00 H new ATOM 0 HG2 GLN A 113 -25.355 2.485 0.551 1.00 0.00 H new ATOM 0 HG3 GLN A 113 -25.223 0.901 1.289 1.00 0.00 H new ATOM 0 HE21 GLN A 113 -25.734 4.286 1.825 1.00 0.00 H new ATOM 0 HE22 GLN A 113 -26.201 4.129 3.522 1.00 0.00 H new ATOM 1801 N LYS A 114 -23.994 -1.170 1.820 1.00 0.00 N ATOM 1802 CA LYS A 114 -24.233 -2.244 2.780 1.00 0.00 C ATOM 1803 C LYS A 114 -23.139 -3.305 2.653 1.00 0.00 C ATOM 1804 O LYS A 114 -22.672 -3.864 3.649 1.00 0.00 O ATOM 1805 CB LYS A 114 -25.591 -2.888 2.506 1.00 0.00 C ATOM 1806 CG LYS A 114 -26.765 -1.921 2.537 1.00 0.00 C ATOM 1807 CD LYS A 114 -27.107 -1.433 3.934 1.00 0.00 C ATOM 1808 CE LYS A 114 -27.630 -2.564 4.795 1.00 0.00 C ATOM 1809 NZ LYS A 114 -28.055 -2.103 6.131 1.00 0.00 N ATOM 0 H LYS A 114 -24.731 -1.072 1.121 1.00 0.00 H new ATOM 0 HA LYS A 114 -24.222 -1.828 3.787 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -25.560 -3.371 1.529 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -25.763 -3.672 3.244 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -26.536 -1.062 1.906 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -27.639 -2.409 2.106 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -26.221 -0.999 4.398 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -27.855 -0.642 3.873 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -28.472 -3.040 4.293 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -26.855 -3.322 4.905 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -28.405 -2.912 6.682 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -27.246 -1.672 6.623 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -28.814 -1.399 6.030 1.00 0.00 H new ATOM 1823 N ASN A 115 -22.710 -3.550 1.420 1.00 0.00 N ATOM 1824 CA ASN A 115 -21.647 -4.512 1.155 1.00 0.00 C ATOM 1825 C ASN A 115 -20.351 -3.982 1.678 1.00 0.00 C ATOM 1826 O ASN A 115 -19.523 -4.720 2.190 1.00 0.00 O ATOM 1827 CB ASN A 115 -21.498 -4.820 -0.339 1.00 0.00 C ATOM 1828 CG ASN A 115 -22.664 -5.563 -0.929 1.00 0.00 C ATOM 1829 OD1 ASN A 115 -23.350 -6.329 -0.238 1.00 0.00 O ATOM 1830 ND2 ASN A 115 -22.873 -5.386 -2.208 1.00 0.00 N ATOM 0 H ASN A 115 -23.083 -3.095 0.587 1.00 0.00 H new ATOM 0 HA ASN A 115 -21.915 -5.440 1.660 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -21.365 -3.884 -0.881 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -20.592 -5.407 -0.490 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -23.627 -5.889 -2.676 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -22.282 -4.745 -2.737 1.00 0.00 H new ATOM 1837 N LEU A 116 -20.192 -2.696 1.565 1.00 0.00 N ATOM 1838 CA LEU A 116 -19.012 -2.019 2.033 1.00 0.00 C ATOM 1839 C LEU A 116 -18.992 -1.989 3.572 1.00 0.00 C ATOM 1840 O LEU A 116 -17.929 -1.973 4.180 1.00 0.00 O ATOM 1841 CB LEU A 116 -18.977 -0.604 1.472 1.00 0.00 C ATOM 1842 CG LEU A 116 -19.067 -0.458 -0.053 1.00 0.00 C ATOM 1843 CD1 LEU A 116 -19.199 0.997 -0.441 1.00 0.00 C ATOM 1844 CD2 LEU A 116 -17.856 -1.070 -0.729 1.00 0.00 C ATOM 0 H LEU A 116 -20.884 -2.078 1.141 1.00 0.00 H new ATOM 0 HA LEU A 116 -18.129 -2.557 1.689 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -19.800 -0.043 1.915 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -18.053 -0.130 1.804 1.00 0.00 H new ATOM 0 HG LEU A 116 -19.955 -0.993 -0.389 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -19.261 1.080 -1.526 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -20.101 1.413 0.007 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -18.329 1.549 -0.084 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -17.944 -0.953 -1.809 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -16.953 -0.567 -0.382 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -17.799 -2.130 -0.482 1.00 0.00 H new ATOM 1856 N LEU A 117 -20.178 -1.968 4.188 1.00 0.00 N ATOM 1857 CA LEU A 117 -20.309 -2.004 5.647 1.00 0.00 C ATOM 1858 C LEU A 117 -19.765 -3.306 6.196 1.00 0.00 C ATOM 1859 O LEU A 117 -18.985 -3.314 7.155 1.00 0.00 O ATOM 1860 CB LEU A 117 -21.779 -1.895 6.093 1.00 0.00 C ATOM 1861 CG LEU A 117 -22.575 -0.683 5.635 1.00 0.00 C ATOM 1862 CD1 LEU A 117 -23.972 -0.712 6.221 1.00 0.00 C ATOM 1863 CD2 LEU A 117 -21.877 0.595 6.002 1.00 0.00 C ATOM 0 H LEU A 117 -21.069 -1.926 3.693 1.00 0.00 H new ATOM 0 HA LEU A 117 -19.746 -1.153 6.029 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -22.300 -2.787 5.747 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -21.800 -1.916 7.183 1.00 0.00 H new ATOM 0 HG LEU A 117 -22.652 -0.724 4.548 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -24.527 0.163 5.882 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -24.485 -1.616 5.894 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -23.910 -0.704 7.309 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -22.470 1.444 5.662 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -21.757 0.646 7.084 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -20.896 0.623 5.527 1.00 0.00 H new ATOM 1875 N LYS A 118 -20.183 -4.408 5.579 1.00 0.00 N ATOM 1876 CA LYS A 118 -19.806 -5.733 6.024 1.00 0.00 C ATOM 1877 C LYS A 118 -18.408 -6.093 5.505 1.00 0.00 C ATOM 1878 O LYS A 118 -17.756 -6.989 6.019 1.00 0.00 O ATOM 1879 CB LYS A 118 -20.834 -6.742 5.497 1.00 0.00 C ATOM 1880 CG LYS A 118 -20.663 -7.043 4.025 1.00 0.00 C ATOM 1881 CD LYS A 118 -21.878 -7.655 3.402 1.00 0.00 C ATOM 1882 CE LYS A 118 -21.555 -8.141 1.993 1.00 0.00 C ATOM 1883 NZ LYS A 118 -22.738 -8.659 1.284 1.00 0.00 N ATOM 0 H LYS A 118 -20.790 -4.401 4.760 1.00 0.00 H new ATOM 0 HA LYS A 118 -19.785 -5.758 7.114 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -20.749 -7.669 6.064 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -21.838 -6.354 5.669 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -20.419 -6.120 3.498 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -19.817 -7.718 3.895 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -22.228 -8.488 4.011 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -22.686 -6.924 3.367 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -21.124 -7.320 1.420 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -20.798 -8.923 2.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -22.467 -9.486 0.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -23.463 -8.937 1.976 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -23.120 -7.920 0.660 1.00 0.00 H new ATOM 1897 N GLY A 119 -17.982 -5.429 4.458 1.00 0.00 N ATOM 1898 CA GLY A 119 -16.706 -5.691 3.901 1.00 0.00 C ATOM 1899 C GLY A 119 -16.845 -6.618 2.739 1.00 0.00 C ATOM 1900 O GLY A 119 -17.522 -7.654 2.840 1.00 0.00 O ATOM 0 H GLY A 119 -18.515 -4.701 3.982 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -16.240 -4.759 3.581 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -16.053 -6.132 4.654 1.00 0.00 H new ATOM 1904 N ILE A 120 -16.281 -6.236 1.631 1.00 0.00 N ATOM 1905 CA ILE A 120 -16.337 -7.051 0.433 1.00 0.00 C ATOM 1906 C ILE A 120 -15.515 -8.314 0.668 1.00 0.00 C ATOM 1907 O ILE A 120 -14.394 -8.224 1.079 1.00 0.00 O ATOM 1908 CB ILE A 120 -15.791 -6.283 -0.806 1.00 0.00 C ATOM 1909 CG1 ILE A 120 -16.466 -4.906 -0.931 1.00 0.00 C ATOM 1910 CG2 ILE A 120 -16.004 -7.089 -2.085 1.00 0.00 C ATOM 1911 CD1 ILE A 120 -17.976 -4.956 -0.927 1.00 0.00 C ATOM 0 H ILE A 120 -15.771 -5.359 1.523 1.00 0.00 H new ATOM 0 HA ILE A 120 -17.377 -7.306 0.227 1.00 0.00 H new ATOM 0 HB ILE A 120 -14.720 -6.137 -0.664 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -16.132 -4.274 -0.108 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -16.131 -4.432 -1.854 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -15.614 -6.531 -2.936 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -15.481 -8.042 -2.006 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -17.069 -7.270 -2.228 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -18.374 -3.945 -1.019 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -18.322 -5.560 -1.766 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -18.323 -5.399 0.006 1.00 0.00 H new ATOM 1923 N PRO A 121 -16.082 -9.500 0.435 1.00 0.00 N ATOM 1924 CA PRO A 121 -15.385 -10.765 0.704 1.00 0.00 C ATOM 1925 C PRO A 121 -14.111 -10.981 -0.130 1.00 0.00 C ATOM 1926 O PRO A 121 -13.187 -11.688 0.303 1.00 0.00 O ATOM 1927 CB PRO A 121 -16.436 -11.841 0.410 1.00 0.00 C ATOM 1928 CG PRO A 121 -17.451 -11.165 -0.452 1.00 0.00 C ATOM 1929 CD PRO A 121 -17.454 -9.720 -0.050 1.00 0.00 C ATOM 0 HA PRO A 121 -15.014 -10.786 1.729 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -15.993 -12.697 -0.099 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -16.886 -12.215 1.330 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -17.199 -11.274 -1.507 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -18.437 -11.609 -0.312 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -17.692 -9.069 -0.891 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -18.192 -9.520 0.727 1.00 0.00 H new ATOM 1937 N PHE A 122 -14.055 -10.347 -1.277 1.00 0.00 N ATOM 1938 CA PHE A 122 -12.942 -10.496 -2.211 1.00 0.00 C ATOM 1939 C PHE A 122 -13.078 -9.544 -3.387 1.00 0.00 C ATOM 1940 O PHE A 122 -14.186 -9.278 -3.846 1.00 0.00 O ATOM 1941 CB PHE A 122 -12.876 -11.943 -2.745 1.00 0.00 C ATOM 1942 CG PHE A 122 -11.760 -12.198 -3.734 1.00 0.00 C ATOM 1943 CD1 PHE A 122 -10.454 -12.364 -3.306 1.00 0.00 C ATOM 1944 CD2 PHE A 122 -12.025 -12.258 -5.093 1.00 0.00 C ATOM 1945 CE1 PHE A 122 -9.439 -12.587 -4.215 1.00 0.00 C ATOM 1946 CE2 PHE A 122 -11.015 -12.478 -6.001 1.00 0.00 C ATOM 1947 CZ PHE A 122 -9.719 -12.645 -5.563 1.00 0.00 C ATOM 0 H PHE A 122 -14.781 -9.707 -1.599 1.00 0.00 H new ATOM 0 HA PHE A 122 -12.027 -10.260 -1.667 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -12.759 -12.623 -1.901 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -13.827 -12.185 -3.220 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -10.227 -12.319 -2.251 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -13.038 -12.130 -5.444 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -8.424 -12.716 -3.869 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -11.238 -12.520 -7.057 1.00 0.00 H new ATOM 0 HZ PHE A 122 -8.925 -12.821 -6.274 1.00 0.00 H new ATOM 1957 N ARG A 123 -11.950 -9.033 -3.838 1.00 0.00 N ATOM 1958 CA ARG A 123 -11.814 -8.228 -5.038 1.00 0.00 C ATOM 1959 C ARG A 123 -10.396 -8.408 -5.548 1.00 0.00 C ATOM 1960 O ARG A 123 -9.469 -8.367 -4.766 1.00 0.00 O ATOM 1961 CB ARG A 123 -12.104 -6.722 -4.778 1.00 0.00 C ATOM 1962 CG ARG A 123 -13.590 -6.346 -4.747 1.00 0.00 C ATOM 1963 CD ARG A 123 -14.202 -6.445 -6.140 1.00 0.00 C ATOM 1964 NE ARG A 123 -15.655 -6.216 -6.171 1.00 0.00 N ATOM 1965 CZ ARG A 123 -16.306 -5.458 -7.093 1.00 0.00 C ATOM 1966 NH1 ARG A 123 -15.622 -4.634 -7.907 1.00 0.00 N ATOM 1967 NH2 ARG A 123 -17.632 -5.494 -7.156 1.00 0.00 N ATOM 0 H ARG A 123 -11.062 -9.173 -3.357 1.00 0.00 H new ATOM 0 HA ARG A 123 -12.546 -8.558 -5.775 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -11.653 -6.439 -3.827 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -11.611 -6.133 -5.552 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -14.123 -7.006 -4.063 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -13.705 -5.332 -4.365 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -13.716 -5.719 -6.792 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -13.991 -7.433 -6.549 1.00 0.00 H new ATOM 0 HE ARG A 123 -16.217 -6.660 -5.445 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -14.606 -4.574 -7.836 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -16.119 -4.069 -8.596 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -18.157 -6.088 -6.515 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -18.125 -4.927 -7.846 1.00 0.00 H new ATOM 1981 N THR A 124 -10.247 -8.677 -6.827 1.00 0.00 N ATOM 1982 CA THR A 124 -8.935 -8.794 -7.451 1.00 0.00 C ATOM 1983 C THR A 124 -8.485 -7.358 -7.800 1.00 0.00 C ATOM 1984 O THR A 124 -9.311 -6.465 -7.732 1.00 0.00 O ATOM 1985 CB THR A 124 -9.049 -9.659 -8.739 1.00 0.00 C ATOM 1986 OG1 THR A 124 -9.819 -10.832 -8.462 1.00 0.00 O ATOM 1987 CG2 THR A 124 -7.688 -10.083 -9.246 1.00 0.00 C ATOM 0 H THR A 124 -11.027 -8.822 -7.468 1.00 0.00 H new ATOM 0 HA THR A 124 -8.214 -9.274 -6.789 1.00 0.00 H new ATOM 0 HB THR A 124 -9.533 -9.052 -9.504 1.00 0.00 H new ATOM 0 HG1 THR A 124 -10.770 -10.598 -8.424 1.00 0.00 H new ATOM 0 HG21 THR A 124 -7.807 -10.686 -10.147 1.00 0.00 H new ATOM 0 HG22 THR A 124 -7.094 -9.199 -9.477 1.00 0.00 H new ATOM 0 HG23 THR A 124 -7.181 -10.671 -8.480 1.00 0.00 H new ATOM 1995 N LYS A 125 -7.227 -7.139 -8.199 1.00 0.00 N ATOM 1996 CA LYS A 125 -6.699 -5.775 -8.452 1.00 0.00 C ATOM 1997 C LYS A 125 -7.580 -4.960 -9.404 1.00 0.00 C ATOM 1998 O LYS A 125 -7.869 -3.797 -9.141 1.00 0.00 O ATOM 1999 CB LYS A 125 -5.248 -5.805 -8.978 1.00 0.00 C ATOM 2000 CG LYS A 125 -5.067 -6.591 -10.270 1.00 0.00 C ATOM 2001 CD LYS A 125 -3.668 -6.450 -10.860 1.00 0.00 C ATOM 2002 CE LYS A 125 -3.376 -5.019 -11.296 1.00 0.00 C ATOM 2003 NZ LYS A 125 -2.087 -4.903 -12.008 1.00 0.00 N ATOM 0 H LYS A 125 -6.548 -7.883 -8.356 1.00 0.00 H new ATOM 0 HA LYS A 125 -6.710 -5.277 -7.482 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -4.911 -4.781 -9.139 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -4.604 -6.236 -8.211 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -5.271 -7.645 -10.080 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -5.800 -6.251 -11.002 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -2.930 -6.762 -10.122 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -3.566 -7.118 -11.715 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -4.179 -4.668 -11.943 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -3.365 -4.370 -10.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -2.015 -3.962 -12.445 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -1.305 -5.032 -11.334 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -2.031 -5.633 -12.746 1.00 0.00 H new ATOM 2017 N ALA A 126 -8.072 -5.605 -10.449 1.00 0.00 N ATOM 2018 CA ALA A 126 -8.858 -4.939 -11.461 1.00 0.00 C ATOM 2019 C ALA A 126 -10.236 -4.632 -10.920 1.00 0.00 C ATOM 2020 O ALA A 126 -10.834 -3.609 -11.214 1.00 0.00 O ATOM 2021 CB ALA A 126 -8.949 -5.840 -12.671 1.00 0.00 C ATOM 0 H ALA A 126 -7.935 -6.602 -10.615 1.00 0.00 H new ATOM 0 HA ALA A 126 -8.387 -3.998 -11.745 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -9.540 -5.351 -13.445 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -7.947 -6.040 -13.052 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -9.425 -6.779 -12.390 1.00 0.00 H new ATOM 2027 N GLU A 127 -10.690 -5.495 -10.057 1.00 0.00 N ATOM 2028 CA GLU A 127 -12.013 -5.392 -9.507 1.00 0.00 C ATOM 2029 C GLU A 127 -11.990 -4.413 -8.341 1.00 0.00 C ATOM 2030 O GLU A 127 -13.002 -3.833 -7.974 1.00 0.00 O ATOM 2031 CB GLU A 127 -12.453 -6.754 -9.030 1.00 0.00 C ATOM 2032 CG GLU A 127 -12.022 -7.877 -9.940 1.00 0.00 C ATOM 2033 CD GLU A 127 -12.563 -9.201 -9.499 1.00 0.00 C ATOM 2034 OE1 GLU A 127 -12.233 -9.638 -8.384 1.00 0.00 O ATOM 2035 OE2 GLU A 127 -13.317 -9.826 -10.238 1.00 0.00 O ATOM 0 H GLU A 127 -10.153 -6.291 -9.714 1.00 0.00 H new ATOM 0 HA GLU A 127 -12.711 -5.033 -10.264 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -12.049 -6.929 -8.033 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -13.539 -6.766 -8.940 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -12.359 -7.669 -10.956 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -10.933 -7.922 -9.968 1.00 0.00 H new ATOM 2042 N PHE A 128 -10.825 -4.272 -7.757 1.00 0.00 N ATOM 2043 CA PHE A 128 -10.567 -3.364 -6.677 1.00 0.00 C ATOM 2044 C PHE A 128 -10.612 -1.941 -7.194 1.00 0.00 C ATOM 2045 O PHE A 128 -11.329 -1.109 -6.666 1.00 0.00 O ATOM 2046 CB PHE A 128 -9.192 -3.677 -6.068 1.00 0.00 C ATOM 2047 CG PHE A 128 -8.750 -2.711 -5.017 1.00 0.00 C ATOM 2048 CD1 PHE A 128 -8.115 -1.537 -5.374 1.00 0.00 C ATOM 2049 CD2 PHE A 128 -8.975 -2.969 -3.687 1.00 0.00 C ATOM 2050 CE1 PHE A 128 -7.714 -0.638 -4.422 1.00 0.00 C ATOM 2051 CE2 PHE A 128 -8.578 -2.075 -2.721 1.00 0.00 C ATOM 2052 CZ PHE A 128 -7.946 -0.905 -3.087 1.00 0.00 C ATOM 0 H PHE A 128 -10.003 -4.809 -8.035 1.00 0.00 H new ATOM 0 HA PHE A 128 -11.327 -3.478 -5.904 1.00 0.00 H new ATOM 0 HB2 PHE A 128 -9.218 -4.678 -5.637 1.00 0.00 H new ATOM 0 HB3 PHE A 128 -8.449 -3.693 -6.866 1.00 0.00 H new ATOM 0 HD1 PHE A 128 -7.933 -1.326 -6.417 1.00 0.00 H new ATOM 0 HD2 PHE A 128 -9.469 -3.884 -3.397 1.00 0.00 H new ATOM 0 HE1 PHE A 128 -7.218 0.276 -4.714 1.00 0.00 H new ATOM 0 HE2 PHE A 128 -8.761 -2.288 -1.678 1.00 0.00 H new ATOM 0 HZ PHE A 128 -7.633 -0.199 -2.332 1.00 0.00 H new ATOM 2062 N GLU A 129 -9.845 -1.665 -8.230 1.00 0.00 N ATOM 2063 CA GLU A 129 -9.849 -0.341 -8.817 1.00 0.00 C ATOM 2064 C GLU A 129 -11.219 -0.018 -9.406 1.00 0.00 C ATOM 2065 O GLU A 129 -11.593 1.123 -9.483 1.00 0.00 O ATOM 2066 CB GLU A 129 -8.747 -0.165 -9.857 1.00 0.00 C ATOM 2067 CG GLU A 129 -8.713 -1.261 -10.882 1.00 0.00 C ATOM 2068 CD GLU A 129 -8.021 -0.861 -12.137 1.00 0.00 C ATOM 2069 OE1 GLU A 129 -6.779 -0.818 -12.170 1.00 0.00 O ATOM 2070 OE2 GLU A 129 -8.714 -0.559 -13.124 1.00 0.00 O ATOM 0 H GLU A 129 -9.217 -2.332 -8.679 1.00 0.00 H new ATOM 0 HA GLU A 129 -9.640 0.369 -8.016 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -8.884 0.791 -10.363 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -7.783 -0.122 -9.350 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -8.212 -2.132 -10.459 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -9.734 -1.563 -11.117 1.00 0.00 H new ATOM 2077 N ASP A 130 -11.955 -1.058 -9.775 1.00 0.00 N ATOM 2078 CA ASP A 130 -13.333 -0.944 -10.281 1.00 0.00 C ATOM 2079 C ASP A 130 -14.248 -0.385 -9.215 1.00 0.00 C ATOM 2080 O ASP A 130 -14.937 0.614 -9.415 1.00 0.00 O ATOM 2081 CB ASP A 130 -13.834 -2.327 -10.690 1.00 0.00 C ATOM 2082 CG ASP A 130 -15.333 -2.402 -10.900 1.00 0.00 C ATOM 2083 OD1 ASP A 130 -15.811 -2.043 -11.979 1.00 0.00 O ATOM 2084 OD2 ASP A 130 -16.060 -2.878 -9.976 1.00 0.00 O ATOM 0 H ASP A 130 -11.616 -2.019 -9.734 1.00 0.00 H new ATOM 0 HA ASP A 130 -13.336 -0.271 -11.138 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -13.333 -2.626 -11.611 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -13.548 -3.047 -9.923 1.00 0.00 H new ATOM 2089 N VAL A 131 -14.249 -1.030 -8.081 1.00 0.00 N ATOM 2090 CA VAL A 131 -15.073 -0.591 -6.983 1.00 0.00 C ATOM 2091 C VAL A 131 -14.581 0.767 -6.462 1.00 0.00 C ATOM 2092 O VAL A 131 -15.375 1.656 -6.181 1.00 0.00 O ATOM 2093 CB VAL A 131 -15.192 -1.677 -5.851 1.00 0.00 C ATOM 2094 CG1 VAL A 131 -13.848 -2.125 -5.362 1.00 0.00 C ATOM 2095 CG2 VAL A 131 -16.040 -1.189 -4.692 1.00 0.00 C ATOM 0 H VAL A 131 -13.690 -1.861 -7.891 1.00 0.00 H new ATOM 0 HA VAL A 131 -16.089 -0.454 -7.353 1.00 0.00 H new ATOM 0 HB VAL A 131 -15.690 -2.537 -6.298 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -13.976 -2.875 -4.581 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -13.285 -2.556 -6.190 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -13.304 -1.271 -4.959 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -16.098 -1.967 -3.931 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -15.589 -0.294 -4.263 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -17.043 -0.954 -5.048 1.00 0.00 H new ATOM 2105 N ILE A 132 -13.268 0.944 -6.431 1.00 0.00 N ATOM 2106 CA ILE A 132 -12.656 2.189 -5.995 1.00 0.00 C ATOM 2107 C ILE A 132 -12.996 3.365 -6.927 1.00 0.00 C ATOM 2108 O ILE A 132 -13.281 4.473 -6.451 1.00 0.00 O ATOM 2109 CB ILE A 132 -11.107 2.022 -5.752 1.00 0.00 C ATOM 2110 CG1 ILE A 132 -10.806 1.688 -4.273 1.00 0.00 C ATOM 2111 CG2 ILE A 132 -10.294 3.224 -6.214 1.00 0.00 C ATOM 2112 CD1 ILE A 132 -11.495 0.450 -3.738 1.00 0.00 C ATOM 0 H ILE A 132 -12.597 0.227 -6.708 1.00 0.00 H new ATOM 0 HA ILE A 132 -13.094 2.443 -5.030 1.00 0.00 H new ATOM 0 HB ILE A 132 -10.793 1.181 -6.370 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -9.729 1.564 -4.157 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -11.096 2.540 -3.658 1.00 0.00 H new ATOM 0 HG21 ILE A 132 -9.237 3.045 -6.018 1.00 0.00 H new ATOM 0 HG22 ILE A 132 -10.445 3.376 -7.283 1.00 0.00 H new ATOM 0 HG23 ILE A 132 -10.618 4.112 -5.672 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -11.219 0.303 -2.694 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -12.575 0.573 -3.814 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -11.187 -0.418 -4.321 1.00 0.00 H new ATOM 2124 N GLU A 133 -13.031 3.118 -8.235 1.00 0.00 N ATOM 2125 CA GLU A 133 -13.367 4.165 -9.182 1.00 0.00 C ATOM 2126 C GLU A 133 -14.845 4.538 -9.056 1.00 0.00 C ATOM 2127 O GLU A 133 -15.241 5.672 -9.302 1.00 0.00 O ATOM 2128 CB GLU A 133 -12.993 3.801 -10.633 1.00 0.00 C ATOM 2129 CG GLU A 133 -13.784 2.697 -11.252 1.00 0.00 C ATOM 2130 CD GLU A 133 -13.406 2.477 -12.686 1.00 0.00 C ATOM 2131 OE1 GLU A 133 -13.937 3.196 -13.569 1.00 0.00 O ATOM 2132 OE2 GLU A 133 -12.563 1.613 -12.969 1.00 0.00 O ATOM 0 H GLU A 133 -12.832 2.210 -8.655 1.00 0.00 H new ATOM 0 HA GLU A 133 -12.765 5.038 -8.930 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -13.104 4.692 -11.251 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -11.939 3.525 -10.658 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -13.626 1.777 -10.689 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -14.847 2.931 -11.188 1.00 0.00 H new ATOM 2139 N HIS A 134 -15.641 3.582 -8.615 1.00 0.00 N ATOM 2140 CA HIS A 134 -17.054 3.799 -8.404 1.00 0.00 C ATOM 2141 C HIS A 134 -17.238 4.586 -7.078 1.00 0.00 C ATOM 2142 O HIS A 134 -18.082 5.454 -6.967 1.00 0.00 O ATOM 2143 CB HIS A 134 -17.777 2.440 -8.362 1.00 0.00 C ATOM 2144 CG HIS A 134 -19.258 2.490 -8.647 1.00 0.00 C ATOM 2145 ND1 HIS A 134 -19.889 1.675 -9.568 1.00 0.00 N ATOM 2146 CD2 HIS A 134 -20.235 3.245 -8.097 1.00 0.00 C ATOM 2147 CE1 HIS A 134 -21.190 1.951 -9.546 1.00 0.00 C ATOM 2148 NE2 HIS A 134 -21.459 2.902 -8.666 1.00 0.00 N ATOM 0 H HIS A 134 -15.325 2.638 -8.395 1.00 0.00 H new ATOM 0 HA HIS A 134 -17.486 4.381 -9.218 1.00 0.00 H new ATOM 0 HB2 HIS A 134 -17.307 1.774 -9.085 1.00 0.00 H new ATOM 0 HB3 HIS A 134 -17.628 1.998 -7.377 1.00 0.00 H new ATOM 0 HD1 HIS A 134 -19.435 0.981 -10.162 1.00 0.00 H new ATOM 0 HD2 HIS A 134 -20.089 3.997 -7.335 1.00 0.00 H new ATOM 0 HE1 HIS A 134 -21.929 1.463 -10.165 1.00 0.00 H new ATOM 2156 N MET A 135 -16.398 4.291 -6.103 1.00 0.00 N ATOM 2157 CA MET A 135 -16.389 4.992 -4.803 1.00 0.00 C ATOM 2158 C MET A 135 -16.051 6.455 -5.009 1.00 0.00 C ATOM 2159 O MET A 135 -16.750 7.346 -4.526 1.00 0.00 O ATOM 2160 CB MET A 135 -15.352 4.391 -3.840 1.00 0.00 C ATOM 2161 CG MET A 135 -15.510 2.914 -3.448 1.00 0.00 C ATOM 2162 SD MET A 135 -17.010 2.509 -2.524 1.00 0.00 S ATOM 2163 CE MET A 135 -18.254 2.369 -3.807 1.00 0.00 C ATOM 0 H MET A 135 -15.694 3.557 -6.177 1.00 0.00 H new ATOM 0 HA MET A 135 -17.382 4.881 -4.369 1.00 0.00 H new ATOM 0 HB2 MET A 135 -14.367 4.515 -4.289 1.00 0.00 H new ATOM 0 HB3 MET A 135 -15.362 4.983 -2.925 1.00 0.00 H new ATOM 0 HG2 MET A 135 -15.490 2.311 -4.356 1.00 0.00 H new ATOM 0 HG3 MET A 135 -14.646 2.620 -2.851 1.00 0.00 H new ATOM 0 HE1 MET A 135 -18.978 3.177 -3.702 1.00 0.00 H new ATOM 0 HE2 MET A 135 -17.777 2.434 -4.785 1.00 0.00 H new ATOM 0 HE3 MET A 135 -18.764 1.410 -3.716 1.00 0.00 H new ATOM 2173 N LYS A 136 -15.012 6.705 -5.783 1.00 0.00 N ATOM 2174 CA LYS A 136 -14.571 8.064 -6.053 1.00 0.00 C ATOM 2175 C LYS A 136 -15.545 8.768 -6.960 1.00 0.00 C ATOM 2176 O LYS A 136 -15.533 9.971 -7.066 1.00 0.00 O ATOM 2177 CB LYS A 136 -13.156 8.145 -6.603 1.00 0.00 C ATOM 2178 CG LYS A 136 -12.969 7.448 -7.911 1.00 0.00 C ATOM 2179 CD LYS A 136 -11.564 7.608 -8.449 1.00 0.00 C ATOM 2180 CE LYS A 136 -10.526 7.084 -7.474 1.00 0.00 C ATOM 2181 NZ LYS A 136 -9.173 7.104 -8.048 1.00 0.00 N ATOM 0 H LYS A 136 -14.454 5.983 -6.239 1.00 0.00 H new ATOM 0 HA LYS A 136 -14.547 8.575 -5.091 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -12.883 9.194 -6.720 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -12.469 7.716 -5.873 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -13.191 6.388 -7.791 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -13.681 7.843 -8.636 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -11.474 7.076 -9.396 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -11.371 8.661 -8.655 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -10.544 7.687 -6.566 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -10.782 6.065 -7.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -8.494 6.738 -7.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -9.148 6.508 -8.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -8.918 8.080 -8.301 1.00 0.00 H new ATOM 2195 N THR A 137 -16.381 7.991 -7.627 1.00 0.00 N ATOM 2196 CA THR A 137 -17.394 8.523 -8.474 1.00 0.00 C ATOM 2197 C THR A 137 -18.454 9.239 -7.585 1.00 0.00 C ATOM 2198 O THR A 137 -19.158 10.150 -8.023 1.00 0.00 O ATOM 2199 CB THR A 137 -17.965 7.381 -9.385 1.00 0.00 C ATOM 2200 OG1 THR A 137 -17.653 7.596 -10.773 1.00 0.00 O ATOM 2201 CG2 THR A 137 -19.437 7.110 -9.177 1.00 0.00 C ATOM 0 H THR A 137 -16.363 6.972 -7.585 1.00 0.00 H new ATOM 0 HA THR A 137 -17.004 9.275 -9.159 1.00 0.00 H new ATOM 0 HB THR A 137 -17.454 6.473 -9.065 1.00 0.00 H new ATOM 0 HG1 THR A 137 -18.023 6.864 -11.309 1.00 0.00 H new ATOM 0 HG21 THR A 137 -19.757 6.308 -9.842 1.00 0.00 H new ATOM 0 HG22 THR A 137 -19.610 6.814 -8.142 1.00 0.00 H new ATOM 0 HG23 THR A 137 -20.008 8.013 -9.396 1.00 0.00 H new ATOM 2209 N TYR A 138 -18.506 8.842 -6.310 1.00 0.00 N ATOM 2210 CA TYR A 138 -19.307 9.524 -5.331 1.00 0.00 C ATOM 2211 C TYR A 138 -18.478 10.639 -4.736 1.00 0.00 C ATOM 2212 O TYR A 138 -18.893 11.790 -4.733 1.00 0.00 O ATOM 2213 CB TYR A 138 -19.800 8.551 -4.249 1.00 0.00 C ATOM 2214 CG TYR A 138 -20.723 7.520 -4.813 1.00 0.00 C ATOM 2215 CD1 TYR A 138 -21.953 7.898 -5.288 1.00 0.00 C ATOM 2216 CD2 TYR A 138 -20.368 6.187 -4.903 1.00 0.00 C ATOM 2217 CE1 TYR A 138 -22.818 6.987 -5.848 1.00 0.00 C ATOM 2218 CE2 TYR A 138 -21.218 5.279 -5.457 1.00 0.00 C ATOM 2219 CZ TYR A 138 -22.445 5.681 -5.936 1.00 0.00 C ATOM 2220 OH TYR A 138 -23.308 4.761 -6.488 1.00 0.00 O ATOM 0 H TYR A 138 -17.991 8.041 -5.945 1.00 0.00 H new ATOM 0 HA TYR A 138 -20.196 9.943 -5.803 1.00 0.00 H new ATOM 0 HB2 TYR A 138 -18.945 8.059 -3.785 1.00 0.00 H new ATOM 0 HB3 TYR A 138 -20.312 9.108 -3.464 1.00 0.00 H new ATOM 0 HD1 TYR A 138 -22.249 8.934 -5.221 1.00 0.00 H new ATOM 0 HD2 TYR A 138 -19.408 5.863 -4.530 1.00 0.00 H new ATOM 0 HE1 TYR A 138 -23.783 7.305 -6.214 1.00 0.00 H new ATOM 0 HE2 TYR A 138 -20.929 4.240 -5.521 1.00 0.00 H new ATOM 0 HH TYR A 138 -22.819 4.188 -7.115 1.00 0.00 H new ATOM 2230 N SER A 139 -17.277 10.278 -4.267 1.00 0.00 N ATOM 2231 CA SER A 139 -16.256 11.195 -3.703 1.00 0.00 C ATOM 2232 C SER A 139 -16.779 12.129 -2.607 1.00 0.00 C ATOM 2233 O SER A 139 -16.175 13.168 -2.317 1.00 0.00 O ATOM 2234 CB SER A 139 -15.568 11.995 -4.817 1.00 0.00 C ATOM 2235 OG SER A 139 -16.503 12.734 -5.617 1.00 0.00 O ATOM 0 H SER A 139 -16.970 9.305 -4.266 1.00 0.00 H new ATOM 0 HA SER A 139 -15.526 10.551 -3.212 1.00 0.00 H new ATOM 0 HB2 SER A 139 -14.848 12.684 -4.375 1.00 0.00 H new ATOM 0 HB3 SER A 139 -15.006 11.314 -5.456 1.00 0.00 H new ATOM 0 HG SER A 139 -16.020 13.228 -6.312 1.00 0.00 H new ATOM 2241 N GLY A 140 -17.861 11.787 -2.009 1.00 0.00 N ATOM 2242 CA GLY A 140 -18.403 12.611 -1.026 1.00 0.00 C ATOM 2243 C GLY A 140 -19.831 12.492 -1.158 1.00 0.00 C ATOM 2244 O GLY A 140 -20.262 11.397 -1.537 1.00 0.00 O ATOM 2245 OXT GLY A 140 -20.540 13.481 -0.969 1.00 0.00 O ATOM 0 H GLY A 140 -18.383 10.931 -2.195 1.00 0.00 H new ATOM 0 HA2 GLY A 140 -18.075 12.303 -0.033 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -18.083 13.644 -1.161 1.00 0.00 H new