USER MOD reduce.3.24.130724 H: found=0, std=0, add=1066, rem=0, adj=31 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 115 ASN : amide:sc= 0.93 K(o=2.1,f=-6.2) USER MOD Set 1.2: A 118 LYS NZ :NH3+ -162:sc= 1.22 (180deg=-0.0531) USER MOD Set 2.1: A 112 MET CE :methyl -142:sc= -0.242 (180deg=-1.01) USER MOD Set 2.2: A 134 HIS : no HD1:sc= 0 X(o=-0.24,f=-0.26) USER MOD Set 2.3: A 138 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 85 THR OG1 : rot -171:sc= 1.35 USER MOD Set 3.2: A 98 GLN : amide:sc= -4.34! C(o=-3!,f=-8.4!) USER MOD Set 4.1: A 84 SER OG : rot 175:sc= -2.84! USER MOD Set 4.2: A 99 SER OG : rot 180:sc= -0.0311 USER MOD Set 5.1: A 72 ASN : amide:sc= -2.13! C(o=-2.4!,f=-5.8!) USER MOD Set 5.2: A 87 HIS : no HE2:sc= -0.285 K(o=-2.4,f=-3.4) USER MOD Set 6.1: A 66 SER OG : rot -176:sc= 2.81 USER MOD Set 6.2: A 69 SER OG : rot -94:sc= 0.85 USER MOD Set 7.1: A 14 GLN : amide:sc= 0.718 K(o=1.2,f=-1.3) USER MOD Set 7.2: A 55 TYR OH : rot 16:sc= 0.455 USER MOD Set 8.1: A 10 GLN : amide:sc=-0.00337 K(o=-0.28,f=-1.2) USER MOD Set 8.2: A 12 HIS : no HD1:sc= -0.279 X(o=-0.28,f=-0.0034) USER MOD Single : A 17 LYS NZ :NH3+ -135:sc= 0.0631 (180deg=0) USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 28 HIS : no HD1:sc= -0.117 X(o=-0.12,f=0) USER MOD Single : A 29 LYS NZ :NH3+ -161:sc= 1.25 (180deg=1.17) USER MOD Single : A 30 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 SER OG : rot 180:sc=-1.83e-05 USER MOD Single : A 36 MET CE :methyl 174:sc= -0.608 (180deg=-0.703) USER MOD Single : A 43 TYR OH : rot 22:sc= 1.28 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 GLN : amide:sc= -1.66 K(o=-1.7,f=-0.64) USER MOD Single : A 52 LYS NZ :NH3+ -162:sc= 1.2 (180deg=1.09) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 167:sc= -0.151 (180deg=-0.499) USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 MET CE :methyl -131:sc= -0.0974 (180deg=-1.63!) USER MOD Single : A 70 LYS NZ :NH3+ -147:sc= 1.22 (180deg=0.0182!) 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= 0 X(o=0,f=0) USER MOD Single : A 94 SER OG : rot 32:sc= 0.143 USER MOD Single : A 102 GLN : amide:sc= -2.06 K(o=-2.1,f=-1.4) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 111 HIS : no HD1:sc=-0.00471 X(o=-0.0047,f=0) USER MOD Single : A 113 GLN : amide:sc= -0.318 K(o=-0.32,f=-2.4!) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 THR OG1 : rot 89:sc= 1.26 USER MOD Single : A 125 LYS NZ :NH3+ 178:sc= 2.34 (180deg=2.28) USER MOD Single : A 135 MET CE :methyl -126:sc= -0.911 (180deg=-2.21!) 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 1:sc= 0.288 USER MOD ----------------------------------------------------------------- ATOM 97 N GLU A 7 36.113 -0.563 3.654 1.00 0.00 N ATOM 98 CA GLU A 7 35.085 -1.534 3.875 1.00 0.00 C ATOM 99 C GLU A 7 33.862 -1.122 3.040 1.00 0.00 C ATOM 100 O GLU A 7 33.809 0.014 2.539 1.00 0.00 O ATOM 101 CB GLU A 7 34.721 -1.560 5.371 1.00 0.00 C ATOM 102 CG GLU A 7 35.892 -1.854 6.293 1.00 0.00 C ATOM 103 CD GLU A 7 35.465 -1.995 7.730 1.00 0.00 C ATOM 104 OE1 GLU A 7 35.301 -0.983 8.427 1.00 0.00 O ATOM 105 OE2 GLU A 7 35.280 -3.137 8.192 1.00 0.00 O ATOM 0 HA GLU A 7 35.421 -2.529 3.582 1.00 0.00 H new ATOM 0 HB2 GLU A 7 34.290 -0.597 5.645 1.00 0.00 H new ATOM 0 HB3 GLU A 7 33.949 -2.312 5.532 1.00 0.00 H new ATOM 0 HG2 GLU A 7 36.384 -2.772 5.971 1.00 0.00 H new ATOM 0 HG3 GLU A 7 36.626 -1.053 6.211 1.00 0.00 H new ATOM 112 N PRO A 8 32.891 -2.019 2.822 1.00 0.00 N ATOM 113 CA PRO A 8 31.684 -1.666 2.099 1.00 0.00 C ATOM 114 C PRO A 8 30.711 -0.822 2.951 1.00 0.00 C ATOM 115 O PRO A 8 30.981 -0.521 4.124 1.00 0.00 O ATOM 116 CB PRO A 8 31.083 -3.009 1.707 1.00 0.00 C ATOM 117 CG PRO A 8 31.589 -3.972 2.727 1.00 0.00 C ATOM 118 CD PRO A 8 32.910 -3.443 3.211 1.00 0.00 C ATOM 0 HA PRO A 8 31.894 -1.035 1.235 1.00 0.00 H new ATOM 0 HB2 PRO A 8 29.994 -2.969 1.708 1.00 0.00 H new ATOM 0 HB3 PRO A 8 31.390 -3.301 0.703 1.00 0.00 H new ATOM 0 HG2 PRO A 8 30.884 -4.065 3.553 1.00 0.00 H new ATOM 0 HG3 PRO A 8 31.706 -4.966 2.295 1.00 0.00 H new ATOM 0 HD2 PRO A 8 33.016 -3.560 4.290 1.00 0.00 H new ATOM 0 HD3 PRO A 8 33.744 -3.971 2.750 1.00 0.00 H new ATOM 126 N LEU A 9 29.575 -0.501 2.382 1.00 0.00 N ATOM 127 CA LEU A 9 28.642 0.449 2.991 1.00 0.00 C ATOM 128 C LEU A 9 27.411 -0.294 3.451 1.00 0.00 C ATOM 129 O LEU A 9 26.762 -0.940 2.638 1.00 0.00 O ATOM 130 CB LEU A 9 28.215 1.502 1.924 1.00 0.00 C ATOM 131 CG LEU A 9 27.831 2.931 2.409 1.00 0.00 C ATOM 132 CD1 LEU A 9 26.609 2.937 3.316 1.00 0.00 C ATOM 133 CD2 LEU A 9 29.002 3.597 3.103 1.00 0.00 C ATOM 0 H LEU A 9 29.261 -0.882 1.489 1.00 0.00 H new ATOM 0 HA LEU A 9 29.122 0.943 3.836 1.00 0.00 H new ATOM 0 HB2 LEU A 9 29.032 1.602 1.210 1.00 0.00 H new ATOM 0 HB3 LEU A 9 27.363 1.096 1.379 1.00 0.00 H new ATOM 0 HG LEU A 9 27.571 3.501 1.517 1.00 0.00 H new ATOM 0 HD11 LEU A 9 26.389 3.959 3.623 1.00 0.00 H new ATOM 0 HD12 LEU A 9 25.754 2.527 2.778 1.00 0.00 H new ATOM 0 HD13 LEU A 9 26.808 2.328 4.198 1.00 0.00 H new ATOM 0 HD21 LEU A 9 28.710 4.594 3.433 1.00 0.00 H new ATOM 0 HD22 LEU A 9 29.300 3.002 3.966 1.00 0.00 H new ATOM 0 HD23 LEU A 9 29.839 3.675 2.410 1.00 0.00 H new ATOM 145 N GLN A 10 27.108 -0.227 4.730 1.00 0.00 N ATOM 146 CA GLN A 10 25.899 -0.822 5.248 1.00 0.00 C ATOM 147 C GLN A 10 24.695 0.051 4.988 1.00 0.00 C ATOM 148 O GLN A 10 24.493 1.084 5.641 1.00 0.00 O ATOM 149 CB GLN A 10 25.983 -1.151 6.724 1.00 0.00 C ATOM 150 CG GLN A 10 26.760 -2.392 7.043 1.00 0.00 C ATOM 151 CD GLN A 10 26.669 -2.789 8.495 1.00 0.00 C ATOM 152 OE1 GLN A 10 25.674 -2.520 9.178 1.00 0.00 O ATOM 153 NE2 GLN A 10 27.670 -3.470 8.963 1.00 0.00 N ATOM 0 H GLN A 10 27.686 0.236 5.431 1.00 0.00 H new ATOM 0 HA GLN A 10 25.783 -1.762 4.709 1.00 0.00 H new ATOM 0 HB2 GLN A 10 26.438 -0.309 7.245 1.00 0.00 H new ATOM 0 HB3 GLN A 10 24.972 -1.260 7.117 1.00 0.00 H new ATOM 0 HG2 GLN A 10 26.394 -3.212 6.425 1.00 0.00 H new ATOM 0 HG3 GLN A 10 27.806 -2.236 6.780 1.00 0.00 H new ATOM 0 HE21 GLN A 10 28.473 -3.671 8.367 1.00 0.00 H new ATOM 0 HE22 GLN A 10 27.654 -3.804 9.927 1.00 0.00 H new ATOM 162 N VAL A 11 23.923 -0.359 4.041 1.00 0.00 N ATOM 163 CA VAL A 11 22.731 0.314 3.663 1.00 0.00 C ATOM 164 C VAL A 11 21.564 -0.492 4.176 1.00 0.00 C ATOM 165 O VAL A 11 21.394 -1.650 3.800 1.00 0.00 O ATOM 166 CB VAL A 11 22.580 0.396 2.137 1.00 0.00 C ATOM 167 CG1 VAL A 11 21.527 1.408 1.751 1.00 0.00 C ATOM 168 CG2 VAL A 11 23.897 0.659 1.444 1.00 0.00 C ATOM 0 H VAL A 11 24.111 -1.198 3.492 1.00 0.00 H new ATOM 0 HA VAL A 11 22.766 1.324 4.073 1.00 0.00 H new ATOM 0 HB VAL A 11 22.243 -0.581 1.791 1.00 0.00 H new ATOM 0 HG11 VAL A 11 21.440 1.446 0.665 1.00 0.00 H new ATOM 0 HG12 VAL A 11 20.569 1.118 2.182 1.00 0.00 H new ATOM 0 HG13 VAL A 11 21.812 2.391 2.127 1.00 0.00 H new ATOM 0 HG21 VAL A 11 23.738 0.708 0.367 1.00 0.00 H new ATOM 0 HG22 VAL A 11 24.309 1.605 1.794 1.00 0.00 H new ATOM 0 HG23 VAL A 11 24.595 -0.147 1.671 1.00 0.00 H new ATOM 178 N HIS A 12 20.796 0.096 5.014 1.00 0.00 N ATOM 179 CA HIS A 12 19.623 -0.518 5.544 1.00 0.00 C ATOM 180 C HIS A 12 18.465 -0.001 4.735 1.00 0.00 C ATOM 181 O HIS A 12 18.155 1.184 4.770 1.00 0.00 O ATOM 182 CB HIS A 12 19.419 -0.153 7.022 1.00 0.00 C ATOM 183 CG HIS A 12 20.479 -0.640 7.988 1.00 0.00 C ATOM 184 ND1 HIS A 12 20.195 -1.163 9.234 1.00 0.00 N ATOM 185 CD2 HIS A 12 21.837 -0.644 7.888 1.00 0.00 C ATOM 186 CE1 HIS A 12 21.350 -1.461 9.833 1.00 0.00 C ATOM 187 NE2 HIS A 12 22.382 -1.166 9.056 1.00 0.00 N ATOM 0 H HIS A 12 20.963 1.040 5.363 1.00 0.00 H new ATOM 0 HA HIS A 12 19.709 -1.603 5.487 1.00 0.00 H new ATOM 0 HB2 HIS A 12 19.358 0.932 7.101 1.00 0.00 H new ATOM 0 HB3 HIS A 12 18.456 -0.551 7.342 1.00 0.00 H new ATOM 0 HD2 HIS A 12 22.402 -0.296 7.036 1.00 0.00 H new ATOM 0 HE1 HIS A 12 21.433 -1.887 10.822 1.00 0.00 H new ATOM 0 HE2 HIS A 12 23.371 -1.295 9.270 1.00 0.00 H new ATOM 195 N VAL A 13 17.894 -0.843 3.949 1.00 0.00 N ATOM 196 CA VAL A 13 16.823 -0.461 3.104 1.00 0.00 C ATOM 197 C VAL A 13 15.512 -0.956 3.656 1.00 0.00 C ATOM 198 O VAL A 13 15.402 -2.102 4.126 1.00 0.00 O ATOM 199 CB VAL A 13 17.026 -0.959 1.640 1.00 0.00 C ATOM 200 CG1 VAL A 13 18.367 -0.552 1.133 1.00 0.00 C ATOM 201 CG2 VAL A 13 16.888 -2.446 1.503 1.00 0.00 C ATOM 0 H VAL A 13 18.161 -1.825 3.875 1.00 0.00 H new ATOM 0 HA VAL A 13 16.804 0.628 3.075 1.00 0.00 H new ATOM 0 HB VAL A 13 16.237 -0.494 1.049 1.00 0.00 H new ATOM 0 HG11 VAL A 13 18.493 -0.907 0.110 1.00 0.00 H new ATOM 0 HG12 VAL A 13 18.449 0.535 1.152 1.00 0.00 H new ATOM 0 HG13 VAL A 13 19.142 -0.985 1.765 1.00 0.00 H new ATOM 0 HG21 VAL A 13 17.040 -2.731 0.462 1.00 0.00 H new ATOM 0 HG22 VAL A 13 17.633 -2.940 2.127 1.00 0.00 H new ATOM 0 HG23 VAL A 13 15.890 -2.750 1.821 1.00 0.00 H new ATOM 211 N GLN A 14 14.562 -0.092 3.662 1.00 0.00 N ATOM 212 CA GLN A 14 13.239 -0.437 4.050 1.00 0.00 C ATOM 213 C GLN A 14 12.435 -0.595 2.801 1.00 0.00 C ATOM 214 O GLN A 14 12.322 0.343 2.010 1.00 0.00 O ATOM 215 CB GLN A 14 12.626 0.621 4.975 1.00 0.00 C ATOM 216 CG GLN A 14 11.161 0.369 5.314 1.00 0.00 C ATOM 217 CD GLN A 14 10.597 1.361 6.310 1.00 0.00 C ATOM 218 OE1 GLN A 14 11.303 1.863 7.192 1.00 0.00 O ATOM 219 NE2 GLN A 14 9.332 1.663 6.178 1.00 0.00 N ATOM 0 H GLN A 14 14.681 0.885 3.395 1.00 0.00 H new ATOM 0 HA GLN A 14 13.247 -1.367 4.619 1.00 0.00 H new ATOM 0 HB2 GLN A 14 13.202 0.659 5.900 1.00 0.00 H new ATOM 0 HB3 GLN A 14 12.717 1.599 4.503 1.00 0.00 H new ATOM 0 HG2 GLN A 14 10.571 0.409 4.398 1.00 0.00 H new ATOM 0 HG3 GLN A 14 11.057 -0.639 5.716 1.00 0.00 H new ATOM 0 HE21 GLN A 14 8.779 1.230 5.439 1.00 0.00 H new ATOM 0 HE22 GLN A 14 8.898 2.332 6.814 1.00 0.00 H new ATOM 228 N LEU A 15 11.952 -1.773 2.580 1.00 0.00 N ATOM 229 CA LEU A 15 11.173 -2.035 1.432 1.00 0.00 C ATOM 230 C LEU A 15 9.722 -2.074 1.802 1.00 0.00 C ATOM 231 O LEU A 15 9.319 -2.864 2.660 1.00 0.00 O ATOM 232 CB LEU A 15 11.543 -3.360 0.780 1.00 0.00 C ATOM 233 CG LEU A 15 12.974 -3.556 0.268 1.00 0.00 C ATOM 234 CD1 LEU A 15 13.609 -2.290 -0.300 1.00 0.00 C ATOM 235 CD2 LEU A 15 13.842 -4.236 1.264 1.00 0.00 C ATOM 0 H LEU A 15 12.090 -2.576 3.194 1.00 0.00 H new ATOM 0 HA LEU A 15 11.369 -1.234 0.720 1.00 0.00 H new ATOM 0 HB2 LEU A 15 11.339 -4.151 1.501 1.00 0.00 H new ATOM 0 HB3 LEU A 15 10.867 -3.514 -0.061 1.00 0.00 H new ATOM 0 HG LEU A 15 12.884 -4.230 -0.584 1.00 0.00 H new ATOM 0 HD11 LEU A 15 14.620 -2.512 -0.641 1.00 0.00 H new ATOM 0 HD12 LEU A 15 13.014 -1.930 -1.139 1.00 0.00 H new ATOM 0 HD13 LEU A 15 13.647 -1.523 0.474 1.00 0.00 H new ATOM 0 HD21 LEU A 15 14.845 -4.351 0.854 1.00 0.00 H new ATOM 0 HD22 LEU A 15 13.889 -3.638 2.174 1.00 0.00 H new ATOM 0 HD23 LEU A 15 13.430 -5.218 1.496 1.00 0.00 H new ATOM 247 N GLU A 16 8.954 -1.221 1.200 1.00 0.00 N ATOM 248 CA GLU A 16 7.531 -1.225 1.395 1.00 0.00 C ATOM 249 C GLU A 16 6.896 -1.880 0.193 1.00 0.00 C ATOM 250 O GLU A 16 7.164 -1.494 -0.939 1.00 0.00 O ATOM 251 CB GLU A 16 7.000 0.192 1.526 1.00 0.00 C ATOM 252 CG GLU A 16 7.680 1.014 2.591 1.00 0.00 C ATOM 253 CD GLU A 16 7.106 2.398 2.687 1.00 0.00 C ATOM 254 OE1 GLU A 16 7.225 3.182 1.718 1.00 0.00 O ATOM 255 OE2 GLU A 16 6.557 2.744 3.746 1.00 0.00 O ATOM 0 H GLU A 16 9.291 -0.502 0.560 1.00 0.00 H new ATOM 0 HA GLU A 16 7.293 -1.767 2.310 1.00 0.00 H new ATOM 0 HB2 GLU A 16 7.110 0.699 0.567 1.00 0.00 H new ATOM 0 HB3 GLU A 16 5.933 0.149 1.743 1.00 0.00 H new ATOM 0 HG2 GLU A 16 7.581 0.513 3.554 1.00 0.00 H new ATOM 0 HG3 GLU A 16 8.746 1.078 2.374 1.00 0.00 H new ATOM 262 N LYS A 17 6.102 -2.866 0.418 1.00 0.00 N ATOM 263 CA LYS A 17 5.415 -3.548 -0.657 1.00 0.00 C ATOM 264 C LYS A 17 4.002 -3.048 -0.665 1.00 0.00 C ATOM 265 O LYS A 17 3.250 -3.398 0.221 1.00 0.00 O ATOM 266 CB LYS A 17 5.412 -5.058 -0.393 1.00 0.00 C ATOM 267 CG LYS A 17 6.784 -5.713 -0.354 1.00 0.00 C ATOM 268 CD LYS A 17 7.366 -5.929 -1.744 1.00 0.00 C ATOM 269 CE LYS A 17 8.720 -6.595 -1.644 1.00 0.00 C ATOM 270 NZ LYS A 17 9.305 -6.944 -2.955 1.00 0.00 N ATOM 0 H LYS A 17 5.900 -3.234 1.348 1.00 0.00 H new ATOM 0 HA LYS A 17 5.907 -3.359 -1.611 1.00 0.00 H new ATOM 0 HB2 LYS A 17 4.912 -5.243 0.558 1.00 0.00 H new ATOM 0 HB3 LYS A 17 4.817 -5.544 -1.166 1.00 0.00 H new ATOM 0 HG2 LYS A 17 7.464 -5.091 0.228 1.00 0.00 H new ATOM 0 HG3 LYS A 17 6.711 -6.672 0.159 1.00 0.00 H new ATOM 0 HD2 LYS A 17 6.691 -6.547 -2.337 1.00 0.00 H new ATOM 0 HD3 LYS A 17 7.460 -4.973 -2.260 1.00 0.00 H new ATOM 0 HE2 LYS A 17 9.404 -5.931 -1.115 1.00 0.00 H new ATOM 0 HE3 LYS A 17 8.627 -7.500 -1.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 9.692 -7.908 -2.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 8.569 -6.896 -3.688 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 10.066 -6.274 -3.185 1.00 0.00 H new ATOM 284 N VAL A 18 3.626 -2.217 -1.617 1.00 0.00 N ATOM 285 CA VAL A 18 2.293 -1.672 -1.560 1.00 0.00 C ATOM 286 C VAL A 18 1.362 -2.596 -2.295 1.00 0.00 C ATOM 287 O VAL A 18 1.404 -2.699 -3.525 1.00 0.00 O ATOM 288 CB VAL A 18 2.170 -0.222 -2.127 1.00 0.00 C ATOM 289 CG1 VAL A 18 0.834 0.401 -1.741 1.00 0.00 C ATOM 290 CG2 VAL A 18 3.343 0.655 -1.698 1.00 0.00 C ATOM 0 H VAL A 18 4.199 -1.917 -2.406 1.00 0.00 H new ATOM 0 HA VAL A 18 2.025 -1.596 -0.506 1.00 0.00 H new ATOM 0 HB VAL A 18 2.206 -0.289 -3.214 1.00 0.00 H new ATOM 0 HG11 VAL A 18 0.772 1.410 -2.147 1.00 0.00 H new ATOM 0 HG12 VAL A 18 0.021 -0.203 -2.144 1.00 0.00 H new ATOM 0 HG13 VAL A 18 0.752 0.442 -0.655 1.00 0.00 H new ATOM 0 HG21 VAL A 18 3.220 1.655 -2.113 1.00 0.00 H new ATOM 0 HG22 VAL A 18 3.374 0.715 -0.610 1.00 0.00 H new ATOM 0 HG23 VAL A 18 4.274 0.222 -2.064 1.00 0.00 H new ATOM 300 N TYR A 19 0.590 -3.314 -1.545 1.00 0.00 N ATOM 301 CA TYR A 19 -0.366 -4.213 -2.098 1.00 0.00 C ATOM 302 C TYR A 19 -1.626 -3.466 -2.416 1.00 0.00 C ATOM 303 O TYR A 19 -1.980 -2.513 -1.719 1.00 0.00 O ATOM 304 CB TYR A 19 -0.692 -5.319 -1.106 1.00 0.00 C ATOM 305 CG TYR A 19 0.391 -6.342 -0.890 1.00 0.00 C ATOM 306 CD1 TYR A 19 1.456 -6.118 -0.022 1.00 0.00 C ATOM 307 CD2 TYR A 19 0.316 -7.555 -1.539 1.00 0.00 C ATOM 308 CE1 TYR A 19 2.413 -7.095 0.179 1.00 0.00 C ATOM 309 CE2 TYR A 19 1.248 -8.530 -1.359 1.00 0.00 C ATOM 310 CZ TYR A 19 2.308 -8.303 -0.493 1.00 0.00 C ATOM 311 OH TYR A 19 3.257 -9.282 -0.284 1.00 0.00 O ATOM 0 H TYR A 19 0.606 -3.292 -0.525 1.00 0.00 H new ATOM 0 HA TYR A 19 0.053 -4.653 -3.003 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -0.931 -4.862 -0.146 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -1.590 -5.834 -1.446 1.00 0.00 H new ATOM 0 HD1 TYR A 19 1.535 -5.175 0.498 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -0.509 -7.738 -2.212 1.00 0.00 H new ATOM 0 HE1 TYR A 19 3.237 -6.918 0.855 1.00 0.00 H new ATOM 0 HE2 TYR A 19 1.164 -9.470 -1.884 1.00 0.00 H new ATOM 0 HH TYR A 19 3.041 -10.068 -0.827 1.00 0.00 H new ATOM 321 N LEU A 20 -2.336 -3.920 -3.431 1.00 0.00 N ATOM 322 CA LEU A 20 -3.616 -3.310 -3.800 1.00 0.00 C ATOM 323 C LEU A 20 -4.679 -3.770 -2.838 1.00 0.00 C ATOM 324 O LEU A 20 -5.816 -3.362 -2.880 1.00 0.00 O ATOM 325 CB LEU A 20 -4.004 -3.673 -5.207 1.00 0.00 C ATOM 326 CG LEU A 20 -2.982 -3.358 -6.263 1.00 0.00 C ATOM 327 CD1 LEU A 20 -3.512 -3.778 -7.590 1.00 0.00 C ATOM 328 CD2 LEU A 20 -2.634 -1.888 -6.243 1.00 0.00 C ATOM 0 H LEU A 20 -2.056 -4.706 -4.018 1.00 0.00 H new ATOM 0 HA LEU A 20 -3.514 -2.226 -3.750 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -4.219 -4.741 -5.242 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -4.929 -3.153 -5.455 1.00 0.00 H new ATOM 0 HG LEU A 20 -2.062 -3.908 -6.063 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -2.777 -3.553 -8.363 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -3.712 -4.850 -7.580 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -4.436 -3.239 -7.800 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -1.893 -1.679 -7.014 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -3.531 -1.299 -6.433 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -2.227 -1.624 -5.267 1.00 0.00 H new ATOM 340 N ASP A 21 -4.297 -4.694 -2.036 1.00 0.00 N ATOM 341 CA ASP A 21 -5.117 -5.165 -0.946 1.00 0.00 C ATOM 342 C ASP A 21 -5.225 -4.060 0.083 1.00 0.00 C ATOM 343 O ASP A 21 -6.300 -3.771 0.591 1.00 0.00 O ATOM 344 CB ASP A 21 -4.493 -6.395 -0.299 1.00 0.00 C ATOM 345 CG ASP A 21 -5.302 -6.989 0.851 1.00 0.00 C ATOM 346 OD1 ASP A 21 -6.454 -6.566 1.084 1.00 0.00 O ATOM 347 OD2 ASP A 21 -4.798 -7.925 1.484 1.00 0.00 O ATOM 0 H ASP A 21 -3.393 -5.162 -2.107 1.00 0.00 H new ATOM 0 HA ASP A 21 -6.102 -5.436 -1.325 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -4.356 -7.161 -1.063 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -3.502 -6.132 0.070 1.00 0.00 H new ATOM 352 N GLY A 22 -4.125 -3.392 0.292 1.00 0.00 N ATOM 353 CA GLY A 22 -4.038 -2.399 1.310 1.00 0.00 C ATOM 354 C GLY A 22 -3.018 -2.816 2.319 1.00 0.00 C ATOM 355 O GLY A 22 -2.711 -2.085 3.259 1.00 0.00 O ATOM 0 H GLY A 22 -3.266 -3.525 -0.242 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -3.764 -1.438 0.875 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -5.008 -2.267 1.789 1.00 0.00 H new ATOM 359 N ASP A 23 -2.533 -4.023 2.129 1.00 0.00 N ATOM 360 CA ASP A 23 -1.477 -4.589 2.933 1.00 0.00 C ATOM 361 C ASP A 23 -0.155 -4.044 2.442 1.00 0.00 C ATOM 362 O ASP A 23 -0.044 -3.572 1.305 1.00 0.00 O ATOM 363 CB ASP A 23 -1.498 -6.143 2.846 1.00 0.00 C ATOM 364 CG ASP A 23 -0.345 -6.828 3.592 1.00 0.00 C ATOM 365 OD1 ASP A 23 -0.118 -6.517 4.790 1.00 0.00 O ATOM 366 OD2 ASP A 23 0.334 -7.701 3.005 1.00 0.00 O ATOM 0 H ASP A 23 -2.869 -4.649 1.397 1.00 0.00 H new ATOM 0 HA ASP A 23 -1.621 -4.315 3.978 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -2.444 -6.506 3.249 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -1.464 -6.438 1.797 1.00 0.00 H new ATOM 371 N VAL A 24 0.808 -4.063 3.284 1.00 0.00 N ATOM 372 CA VAL A 24 2.117 -3.611 2.963 1.00 0.00 C ATOM 373 C VAL A 24 3.116 -4.299 3.842 1.00 0.00 C ATOM 374 O VAL A 24 3.075 -4.197 5.073 1.00 0.00 O ATOM 375 CB VAL A 24 2.245 -2.053 2.997 1.00 0.00 C ATOM 376 CG1 VAL A 24 1.577 -1.486 4.222 1.00 0.00 C ATOM 377 CG2 VAL A 24 3.702 -1.600 2.924 1.00 0.00 C ATOM 0 H VAL A 24 0.710 -4.401 4.241 1.00 0.00 H new ATOM 0 HA VAL A 24 2.330 -3.883 1.929 1.00 0.00 H new ATOM 0 HB VAL A 24 1.736 -1.669 2.113 1.00 0.00 H new ATOM 0 HG11 VAL A 24 1.680 -0.401 4.223 1.00 0.00 H new ATOM 0 HG12 VAL A 24 0.520 -1.751 4.215 1.00 0.00 H new ATOM 0 HG13 VAL A 24 2.048 -1.896 5.116 1.00 0.00 H new ATOM 0 HG21 VAL A 24 3.746 -0.511 2.950 1.00 0.00 H new ATOM 0 HG22 VAL A 24 4.252 -2.006 3.773 1.00 0.00 H new ATOM 0 HG23 VAL A 24 4.149 -1.959 1.997 1.00 0.00 H new ATOM 387 N SER A 25 3.947 -5.063 3.224 1.00 0.00 N ATOM 388 CA SER A 25 4.958 -5.766 3.912 1.00 0.00 C ATOM 389 C SER A 25 6.164 -4.862 3.998 1.00 0.00 C ATOM 390 O SER A 25 6.577 -4.268 2.991 1.00 0.00 O ATOM 391 CB SER A 25 5.273 -7.081 3.180 1.00 0.00 C ATOM 392 OG SER A 25 6.135 -7.929 3.929 1.00 0.00 O ATOM 0 H SER A 25 3.939 -5.215 2.215 1.00 0.00 H new ATOM 0 HA SER A 25 4.639 -6.035 4.919 1.00 0.00 H new ATOM 0 HB2 SER A 25 4.342 -7.608 2.971 1.00 0.00 H new ATOM 0 HB3 SER A 25 5.735 -6.856 2.219 1.00 0.00 H new ATOM 0 HG SER A 25 6.304 -8.752 3.424 1.00 0.00 H new ATOM 398 N ILE A 26 6.658 -4.692 5.200 1.00 0.00 N ATOM 399 CA ILE A 26 7.799 -3.862 5.458 1.00 0.00 C ATOM 400 C ILE A 26 8.991 -4.754 5.688 1.00 0.00 C ATOM 401 O ILE A 26 9.020 -5.529 6.646 1.00 0.00 O ATOM 402 CB ILE A 26 7.572 -2.962 6.707 1.00 0.00 C ATOM 403 CG1 ILE A 26 6.341 -2.064 6.519 1.00 0.00 C ATOM 404 CG2 ILE A 26 8.803 -2.120 7.021 1.00 0.00 C ATOM 405 CD1 ILE A 26 6.406 -1.164 5.309 1.00 0.00 C ATOM 0 H ILE A 26 6.271 -5.134 6.034 1.00 0.00 H new ATOM 0 HA ILE A 26 7.965 -3.208 4.602 1.00 0.00 H new ATOM 0 HB ILE A 26 7.393 -3.622 7.556 1.00 0.00 H new ATOM 0 HG12 ILE A 26 5.455 -2.694 6.441 1.00 0.00 H new ATOM 0 HG13 ILE A 26 6.216 -1.448 7.409 1.00 0.00 H new ATOM 0 HG21 ILE A 26 8.608 -1.504 7.899 1.00 0.00 H new ATOM 0 HG22 ILE A 26 9.651 -2.775 7.218 1.00 0.00 H new ATOM 0 HG23 ILE A 26 9.031 -1.478 6.170 1.00 0.00 H new ATOM 0 HD11 ILE A 26 5.497 -0.565 5.252 1.00 0.00 H new ATOM 0 HD12 ILE A 26 7.271 -0.505 5.392 1.00 0.00 H new ATOM 0 HD13 ILE A 26 6.497 -1.771 4.408 1.00 0.00 H new ATOM 417 N GLU A 27 9.929 -4.669 4.820 1.00 0.00 N ATOM 418 CA GLU A 27 11.110 -5.461 4.897 1.00 0.00 C ATOM 419 C GLU A 27 12.313 -4.568 5.161 1.00 0.00 C ATOM 420 O GLU A 27 12.321 -3.413 4.760 1.00 0.00 O ATOM 421 CB GLU A 27 11.290 -6.205 3.581 1.00 0.00 C ATOM 422 CG GLU A 27 12.598 -6.936 3.454 1.00 0.00 C ATOM 423 CD GLU A 27 12.703 -8.137 4.351 1.00 0.00 C ATOM 424 OE1 GLU A 27 12.722 -7.977 5.577 1.00 0.00 O ATOM 425 OE2 GLU A 27 12.792 -9.270 3.832 1.00 0.00 O ATOM 0 H GLU A 27 9.902 -4.037 4.020 1.00 0.00 H new ATOM 0 HA GLU A 27 11.023 -6.178 5.713 1.00 0.00 H new ATOM 0 HB2 GLU A 27 10.476 -6.920 3.468 1.00 0.00 H new ATOM 0 HB3 GLU A 27 11.205 -5.493 2.760 1.00 0.00 H new ATOM 0 HG2 GLU A 27 12.729 -7.253 2.419 1.00 0.00 H new ATOM 0 HG3 GLU A 27 13.413 -6.249 3.683 1.00 0.00 H new ATOM 432 N HIS A 28 13.302 -5.099 5.834 1.00 0.00 N ATOM 433 CA HIS A 28 14.528 -4.390 6.099 1.00 0.00 C ATOM 434 C HIS A 28 15.703 -5.234 5.649 1.00 0.00 C ATOM 435 O HIS A 28 16.023 -6.270 6.257 1.00 0.00 O ATOM 436 CB HIS A 28 14.692 -4.054 7.589 1.00 0.00 C ATOM 437 CG HIS A 28 13.610 -3.187 8.160 1.00 0.00 C ATOM 438 ND1 HIS A 28 13.088 -3.335 9.421 1.00 0.00 N ATOM 439 CD2 HIS A 28 12.990 -2.124 7.624 1.00 0.00 C ATOM 440 CE1 HIS A 28 12.186 -2.379 9.614 1.00 0.00 C ATOM 441 NE2 HIS A 28 12.086 -1.601 8.546 1.00 0.00 N ATOM 0 H HIS A 28 13.279 -6.044 6.217 1.00 0.00 H new ATOM 0 HA HIS A 28 14.493 -3.451 5.546 1.00 0.00 H new ATOM 0 HB2 HIS A 28 14.729 -4.985 8.155 1.00 0.00 H new ATOM 0 HB3 HIS A 28 15.651 -3.556 7.731 1.00 0.00 H new ATOM 0 HD2 HIS A 28 13.165 -1.735 6.632 1.00 0.00 H new ATOM 0 HE1 HIS A 28 11.611 -2.253 10.520 1.00 0.00 H new ATOM 0 HE2 HIS A 28 11.477 -0.792 8.425 1.00 0.00 H new ATOM 449 N LYS A 29 16.325 -4.825 4.590 1.00 0.00 N ATOM 450 CA LYS A 29 17.496 -5.517 4.092 1.00 0.00 C ATOM 451 C LYS A 29 18.656 -4.649 4.370 1.00 0.00 C ATOM 452 O LYS A 29 18.646 -3.496 3.991 1.00 0.00 O ATOM 453 CB LYS A 29 17.471 -5.731 2.571 1.00 0.00 C ATOM 454 CG LYS A 29 16.294 -6.402 1.999 1.00 0.00 C ATOM 455 CD LYS A 29 16.078 -7.760 2.544 1.00 0.00 C ATOM 456 CE LYS A 29 15.298 -8.519 1.519 1.00 0.00 C ATOM 457 NZ LYS A 29 14.748 -9.799 2.019 1.00 0.00 N ATOM 0 H LYS A 29 16.048 -4.011 4.042 1.00 0.00 H new ATOM 0 HA LYS A 29 17.536 -6.494 4.574 1.00 0.00 H new ATOM 0 HB2 LYS A 29 17.568 -4.756 2.093 1.00 0.00 H new ATOM 0 HB3 LYS A 29 18.354 -6.309 2.298 1.00 0.00 H new ATOM 0 HG2 LYS A 29 15.409 -5.795 2.190 1.00 0.00 H new ATOM 0 HG3 LYS A 29 16.409 -6.465 0.917 1.00 0.00 H new ATOM 0 HD2 LYS A 29 17.030 -8.251 2.747 1.00 0.00 H new ATOM 0 HD3 LYS A 29 15.535 -7.716 3.488 1.00 0.00 H new ATOM 0 HE2 LYS A 29 14.478 -7.895 1.164 1.00 0.00 H new ATOM 0 HE3 LYS A 29 15.940 -8.720 0.661 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 14.508 -10.412 1.214 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 15.457 -10.272 2.615 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 13.892 -9.614 2.580 1.00 0.00 H new ATOM 471 N HIS A 30 19.632 -5.141 5.022 1.00 0.00 N ATOM 472 CA HIS A 30 20.787 -4.327 5.190 1.00 0.00 C ATOM 473 C HIS A 30 21.918 -4.941 4.425 1.00 0.00 C ATOM 474 O HIS A 30 22.307 -6.094 4.668 1.00 0.00 O ATOM 475 CB HIS A 30 21.125 -3.985 6.670 1.00 0.00 C ATOM 476 CG HIS A 30 21.790 -5.036 7.507 1.00 0.00 C ATOM 477 ND1 HIS A 30 21.126 -5.961 8.268 1.00 0.00 N ATOM 478 CD2 HIS A 30 23.109 -5.245 7.732 1.00 0.00 C ATOM 479 CE1 HIS A 30 22.036 -6.684 8.924 1.00 0.00 C ATOM 480 NE2 HIS A 30 23.261 -6.288 8.627 1.00 0.00 N ATOM 0 H HIS A 30 19.668 -6.071 5.440 1.00 0.00 H new ATOM 0 HA HIS A 30 20.579 -3.341 4.774 1.00 0.00 H new ATOM 0 HB2 HIS A 30 21.767 -3.104 6.670 1.00 0.00 H new ATOM 0 HB3 HIS A 30 20.197 -3.702 7.167 1.00 0.00 H new ATOM 0 HD2 HIS A 30 23.916 -4.685 7.283 1.00 0.00 H new ATOM 0 HE1 HIS A 30 21.802 -7.487 9.607 1.00 0.00 H new ATOM 0 HE2 HIS A 30 24.136 -6.672 8.984 1.00 0.00 H new ATOM 488 N GLU A 31 22.393 -4.239 3.465 1.00 0.00 N ATOM 489 CA GLU A 31 23.422 -4.771 2.625 1.00 0.00 C ATOM 490 C GLU A 31 24.660 -3.971 2.731 1.00 0.00 C ATOM 491 O GLU A 31 24.638 -2.869 3.216 1.00 0.00 O ATOM 492 CB GLU A 31 22.992 -4.865 1.162 1.00 0.00 C ATOM 493 CG GLU A 31 22.635 -3.564 0.478 1.00 0.00 C ATOM 494 CD GLU A 31 22.424 -3.792 -0.994 1.00 0.00 C ATOM 495 OE1 GLU A 31 21.332 -4.240 -1.389 1.00 0.00 O ATOM 496 OE2 GLU A 31 23.377 -3.600 -1.778 1.00 0.00 O ATOM 0 H GLU A 31 22.092 -3.292 3.233 1.00 0.00 H new ATOM 0 HA GLU A 31 23.616 -5.783 2.980 1.00 0.00 H new ATOM 0 HB2 GLU A 31 23.798 -5.336 0.599 1.00 0.00 H new ATOM 0 HB3 GLU A 31 22.130 -5.530 1.102 1.00 0.00 H new ATOM 0 HG2 GLU A 31 21.731 -3.147 0.922 1.00 0.00 H new ATOM 0 HG3 GLU A 31 23.430 -2.834 0.630 1.00 0.00 H new ATOM 503 N LYS A 32 25.737 -4.539 2.325 1.00 0.00 N ATOM 504 CA LYS A 32 26.952 -3.842 2.257 1.00 0.00 C ATOM 505 C LYS A 32 27.353 -3.710 0.824 1.00 0.00 C ATOM 506 O LYS A 32 27.502 -4.702 0.117 1.00 0.00 O ATOM 507 CB LYS A 32 28.024 -4.510 3.067 1.00 0.00 C ATOM 508 CG LYS A 32 27.811 -4.440 4.570 1.00 0.00 C ATOM 509 CD LYS A 32 28.974 -5.039 5.339 1.00 0.00 C ATOM 510 CE LYS A 32 29.334 -6.404 4.800 1.00 0.00 C ATOM 511 NZ LYS A 32 30.352 -7.085 5.618 1.00 0.00 N ATOM 0 H LYS A 32 25.792 -5.513 2.029 1.00 0.00 H new ATOM 0 HA LYS A 32 26.817 -2.850 2.688 1.00 0.00 H new ATOM 0 HB2 LYS A 32 28.088 -5.557 2.770 1.00 0.00 H new ATOM 0 HB3 LYS A 32 28.983 -4.051 2.827 1.00 0.00 H new ATOM 0 HG2 LYS A 32 27.676 -3.400 4.869 1.00 0.00 H new ATOM 0 HG3 LYS A 32 26.894 -4.968 4.831 1.00 0.00 H new ATOM 0 HD2 LYS A 32 29.838 -4.378 5.272 1.00 0.00 H new ATOM 0 HD3 LYS A 32 28.714 -5.118 6.395 1.00 0.00 H new ATOM 0 HE2 LYS A 32 28.437 -7.021 4.755 1.00 0.00 H new ATOM 0 HE3 LYS A 32 29.702 -6.302 3.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 30.563 -8.016 5.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 31.219 -6.512 5.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 29.993 -7.209 6.586 1.00 0.00 H new ATOM 525 N VAL A 33 27.463 -2.503 0.386 1.00 0.00 N ATOM 526 CA VAL A 33 27.797 -2.221 -0.988 1.00 0.00 C ATOM 527 C VAL A 33 29.007 -1.285 -1.112 1.00 0.00 C ATOM 528 O VAL A 33 29.149 -0.365 -0.345 1.00 0.00 O ATOM 529 CB VAL A 33 26.544 -1.717 -1.790 1.00 0.00 C ATOM 530 CG1 VAL A 33 25.692 -0.774 -0.993 1.00 0.00 C ATOM 531 CG2 VAL A 33 26.940 -1.058 -3.065 1.00 0.00 C ATOM 0 H VAL A 33 27.326 -1.674 0.964 1.00 0.00 H new ATOM 0 HA VAL A 33 28.105 -3.159 -1.449 1.00 0.00 H new ATOM 0 HB VAL A 33 25.956 -2.608 -2.010 1.00 0.00 H new ATOM 0 HG11 VAL A 33 24.840 -0.456 -1.594 1.00 0.00 H new ATOM 0 HG12 VAL A 33 25.334 -1.277 -0.095 1.00 0.00 H new ATOM 0 HG13 VAL A 33 26.281 0.098 -0.710 1.00 0.00 H new ATOM 0 HG21 VAL A 33 26.048 -0.722 -3.593 1.00 0.00 H new ATOM 0 HG22 VAL A 33 27.578 -0.201 -2.849 1.00 0.00 H new ATOM 0 HG23 VAL A 33 27.485 -1.768 -3.688 1.00 0.00 H new ATOM 541 N PHE A 34 29.899 -1.579 -2.048 1.00 0.00 N ATOM 542 CA PHE A 34 31.100 -0.784 -2.266 1.00 0.00 C ATOM 543 C PHE A 34 30.831 0.476 -3.083 1.00 0.00 C ATOM 544 O PHE A 34 31.522 1.480 -2.920 1.00 0.00 O ATOM 545 CB PHE A 34 32.171 -1.597 -2.971 1.00 0.00 C ATOM 546 CG PHE A 34 32.733 -2.733 -2.188 1.00 0.00 C ATOM 547 CD1 PHE A 34 33.450 -2.497 -1.032 1.00 0.00 C ATOM 548 CD2 PHE A 34 32.594 -4.032 -2.635 1.00 0.00 C ATOM 549 CE1 PHE A 34 34.017 -3.535 -0.331 1.00 0.00 C ATOM 550 CE2 PHE A 34 33.151 -5.080 -1.933 1.00 0.00 C ATOM 551 CZ PHE A 34 33.867 -4.829 -0.780 1.00 0.00 C ATOM 0 H PHE A 34 29.810 -2.376 -2.678 1.00 0.00 H new ATOM 0 HA PHE A 34 31.444 -0.487 -1.275 1.00 0.00 H new ATOM 0 HB2 PHE A 34 31.753 -1.989 -3.898 1.00 0.00 H new ATOM 0 HB3 PHE A 34 32.987 -0.929 -3.246 1.00 0.00 H new ATOM 0 HD1 PHE A 34 33.567 -1.485 -0.674 1.00 0.00 H new ATOM 0 HD2 PHE A 34 32.044 -4.229 -3.543 1.00 0.00 H new ATOM 0 HE1 PHE A 34 34.579 -3.337 0.570 1.00 0.00 H new ATOM 0 HE2 PHE A 34 33.027 -6.094 -2.284 1.00 0.00 H new ATOM 0 HZ PHE A 34 34.309 -5.646 -0.230 1.00 0.00 H new ATOM 561 N SER A 35 29.877 0.421 -3.976 1.00 0.00 N ATOM 562 CA SER A 35 29.570 1.559 -4.791 1.00 0.00 C ATOM 563 C SER A 35 28.092 1.757 -4.801 1.00 0.00 C ATOM 564 O SER A 35 27.352 0.904 -5.306 1.00 0.00 O ATOM 565 CB SER A 35 30.078 1.361 -6.224 1.00 0.00 C ATOM 566 OG SER A 35 29.806 2.497 -7.039 1.00 0.00 O ATOM 0 H SER A 35 29.301 -0.402 -4.155 1.00 0.00 H new ATOM 0 HA SER A 35 30.065 2.437 -4.377 1.00 0.00 H new ATOM 0 HB2 SER A 35 31.152 1.173 -6.207 1.00 0.00 H new ATOM 0 HB3 SER A 35 29.607 0.479 -6.659 1.00 0.00 H new ATOM 0 HG SER A 35 30.144 2.338 -7.945 1.00 0.00 H new ATOM 572 N MET A 36 27.652 2.869 -4.252 1.00 0.00 N ATOM 573 CA MET A 36 26.236 3.215 -4.200 1.00 0.00 C ATOM 574 C MET A 36 25.591 3.184 -5.565 1.00 0.00 C ATOM 575 O MET A 36 24.421 2.885 -5.688 1.00 0.00 O ATOM 576 CB MET A 36 26.033 4.569 -3.549 1.00 0.00 C ATOM 577 CG MET A 36 26.193 4.548 -2.043 1.00 0.00 C ATOM 578 SD MET A 36 24.659 4.972 -1.195 1.00 0.00 S ATOM 579 CE MET A 36 23.555 3.730 -1.852 1.00 0.00 C ATOM 0 H MET A 36 28.264 3.565 -3.826 1.00 0.00 H new ATOM 0 HA MET A 36 25.746 2.456 -3.590 1.00 0.00 H new ATOM 0 HB2 MET A 36 26.746 5.277 -3.972 1.00 0.00 H new ATOM 0 HB3 MET A 36 25.036 4.935 -3.795 1.00 0.00 H new ATOM 0 HG2 MET A 36 26.520 3.557 -1.727 1.00 0.00 H new ATOM 0 HG3 MET A 36 26.974 5.250 -1.752 1.00 0.00 H new ATOM 0 HE1 MET A 36 22.593 3.793 -1.343 1.00 0.00 H new ATOM 0 HE2 MET A 36 23.413 3.898 -2.920 1.00 0.00 H new ATOM 0 HE3 MET A 36 23.985 2.741 -1.694 1.00 0.00 H new ATOM 589 N ASP A 37 26.387 3.422 -6.578 1.00 0.00 N ATOM 590 CA ASP A 37 25.933 3.400 -7.969 1.00 0.00 C ATOM 591 C ASP A 37 25.363 2.034 -8.334 1.00 0.00 C ATOM 592 O ASP A 37 24.286 1.937 -8.926 1.00 0.00 O ATOM 593 CB ASP A 37 27.082 3.749 -8.911 1.00 0.00 C ATOM 594 CG ASP A 37 26.711 3.575 -10.366 1.00 0.00 C ATOM 595 OD1 ASP A 37 25.995 4.433 -10.918 1.00 0.00 O ATOM 596 OD2 ASP A 37 27.135 2.576 -10.982 1.00 0.00 O ATOM 0 H ASP A 37 27.378 3.639 -6.472 1.00 0.00 H new ATOM 0 HA ASP A 37 25.145 4.146 -8.076 1.00 0.00 H new ATOM 0 HB2 ASP A 37 27.388 4.781 -8.738 1.00 0.00 H new ATOM 0 HB3 ASP A 37 27.941 3.119 -8.680 1.00 0.00 H new ATOM 601 N ASP A 38 26.053 0.979 -7.900 1.00 0.00 N ATOM 602 CA ASP A 38 25.645 -0.394 -8.206 1.00 0.00 C ATOM 603 C ASP A 38 24.340 -0.692 -7.475 1.00 0.00 C ATOM 604 O ASP A 38 23.459 -1.390 -7.980 1.00 0.00 O ATOM 605 CB ASP A 38 26.724 -1.361 -7.743 1.00 0.00 C ATOM 606 CG ASP A 38 26.541 -2.766 -8.267 1.00 0.00 C ATOM 607 OD1 ASP A 38 27.060 -3.078 -9.370 1.00 0.00 O ATOM 608 OD2 ASP A 38 25.918 -3.588 -7.599 1.00 0.00 O ATOM 0 H ASP A 38 26.899 1.048 -7.334 1.00 0.00 H new ATOM 0 HA ASP A 38 25.502 -0.509 -9.280 1.00 0.00 H new ATOM 0 HB2 ASP A 38 27.697 -0.987 -8.062 1.00 0.00 H new ATOM 0 HB3 ASP A 38 26.734 -1.387 -6.653 1.00 0.00 H new ATOM 613 N PHE A 39 24.222 -0.103 -6.291 1.00 0.00 N ATOM 614 CA PHE A 39 23.049 -0.204 -5.461 1.00 0.00 C ATOM 615 C PHE A 39 21.840 0.458 -6.148 1.00 0.00 C ATOM 616 O PHE A 39 20.749 -0.118 -6.190 1.00 0.00 O ATOM 617 CB PHE A 39 23.333 0.464 -4.111 1.00 0.00 C ATOM 618 CG PHE A 39 22.166 0.520 -3.180 1.00 0.00 C ATOM 619 CD1 PHE A 39 21.292 1.585 -3.225 1.00 0.00 C ATOM 620 CD2 PHE A 39 21.948 -0.478 -2.264 1.00 0.00 C ATOM 621 CE1 PHE A 39 20.224 1.655 -2.380 1.00 0.00 C ATOM 622 CE2 PHE A 39 20.874 -0.413 -1.410 1.00 0.00 C ATOM 623 CZ PHE A 39 20.013 0.661 -1.476 1.00 0.00 C ATOM 0 H PHE A 39 24.961 0.468 -5.881 1.00 0.00 H new ATOM 0 HA PHE A 39 22.808 -1.255 -5.302 1.00 0.00 H new ATOM 0 HB2 PHE A 39 24.145 -0.072 -3.620 1.00 0.00 H new ATOM 0 HB3 PHE A 39 23.685 1.480 -4.291 1.00 0.00 H new ATOM 0 HD1 PHE A 39 21.456 2.377 -3.941 1.00 0.00 H new ATOM 0 HD2 PHE A 39 22.624 -1.319 -2.214 1.00 0.00 H new ATOM 0 HE1 PHE A 39 19.548 2.496 -2.428 1.00 0.00 H new ATOM 0 HE2 PHE A 39 20.705 -1.200 -0.690 1.00 0.00 H new ATOM 0 HZ PHE A 39 19.167 0.714 -0.807 1.00 0.00 H new ATOM 633 N TRP A 40 22.046 1.662 -6.692 1.00 0.00 N ATOM 634 CA TRP A 40 20.971 2.399 -7.352 1.00 0.00 C ATOM 635 C TRP A 40 20.486 1.649 -8.565 1.00 0.00 C ATOM 636 O TRP A 40 19.310 1.572 -8.813 1.00 0.00 O ATOM 637 CB TRP A 40 21.387 3.839 -7.735 1.00 0.00 C ATOM 638 CG TRP A 40 21.818 4.681 -6.566 1.00 0.00 C ATOM 639 CD1 TRP A 40 22.975 5.397 -6.455 1.00 0.00 C ATOM 640 CD2 TRP A 40 21.115 4.868 -5.329 1.00 0.00 C ATOM 641 NE1 TRP A 40 23.043 5.992 -5.221 1.00 0.00 N ATOM 642 CE2 TRP A 40 21.914 5.688 -4.519 1.00 0.00 C ATOM 643 CE3 TRP A 40 19.889 4.422 -4.824 1.00 0.00 C ATOM 644 CZ2 TRP A 40 21.535 6.055 -3.243 1.00 0.00 C ATOM 645 CZ3 TRP A 40 19.518 4.793 -3.562 1.00 0.00 C ATOM 646 CH2 TRP A 40 20.336 5.594 -2.783 1.00 0.00 C ATOM 0 H TRP A 40 22.945 2.143 -6.687 1.00 0.00 H new ATOM 0 HA TRP A 40 20.155 2.484 -6.634 1.00 0.00 H new ATOM 0 HB2 TRP A 40 22.203 3.791 -8.456 1.00 0.00 H new ATOM 0 HB3 TRP A 40 20.550 4.328 -8.233 1.00 0.00 H new ATOM 0 HD1 TRP A 40 23.727 5.482 -7.226 1.00 0.00 H new ATOM 0 HE1 TRP A 40 23.813 6.569 -4.883 1.00 0.00 H new ATOM 0 HE3 TRP A 40 19.245 3.794 -5.422 1.00 0.00 H new ATOM 0 HZ2 TRP A 40 22.165 6.684 -2.631 1.00 0.00 H new ATOM 0 HZ3 TRP A 40 18.571 4.456 -3.166 1.00 0.00 H new ATOM 0 HH2 TRP A 40 20.017 5.861 -1.786 1.00 0.00 H new ATOM 657 N ALA A 41 21.401 1.046 -9.275 1.00 0.00 N ATOM 658 CA ALA A 41 21.062 0.267 -10.450 1.00 0.00 C ATOM 659 C ALA A 41 20.365 -1.033 -10.052 1.00 0.00 C ATOM 660 O ALA A 41 19.558 -1.581 -10.813 1.00 0.00 O ATOM 661 CB ALA A 41 22.299 -0.006 -11.284 1.00 0.00 C ATOM 0 H ALA A 41 22.398 1.076 -9.063 1.00 0.00 H new ATOM 0 HA ALA A 41 20.368 0.845 -11.060 1.00 0.00 H new ATOM 0 HB1 ALA A 41 22.024 -0.592 -12.161 1.00 0.00 H new ATOM 0 HB2 ALA A 41 22.739 0.939 -11.602 1.00 0.00 H new ATOM 0 HB3 ALA A 41 23.024 -0.562 -10.689 1.00 0.00 H new ATOM 667 N ALA A 42 20.667 -1.516 -8.866 1.00 0.00 N ATOM 668 CA ALA A 42 20.042 -2.716 -8.344 1.00 0.00 C ATOM 669 C ALA A 42 18.565 -2.470 -8.010 1.00 0.00 C ATOM 670 O ALA A 42 17.693 -3.248 -8.399 1.00 0.00 O ATOM 671 CB ALA A 42 20.795 -3.215 -7.116 1.00 0.00 C ATOM 0 H ALA A 42 21.349 -1.092 -8.238 1.00 0.00 H new ATOM 0 HA ALA A 42 20.086 -3.484 -9.116 1.00 0.00 H new ATOM 0 HB1 ALA A 42 20.314 -4.116 -6.736 1.00 0.00 H new ATOM 0 HB2 ALA A 42 21.826 -3.441 -7.388 1.00 0.00 H new ATOM 0 HB3 ALA A 42 20.784 -2.445 -6.345 1.00 0.00 H new ATOM 677 N TYR A 43 18.283 -1.360 -7.355 1.00 0.00 N ATOM 678 CA TYR A 43 16.929 -1.065 -6.890 1.00 0.00 C ATOM 679 C TYR A 43 16.282 0.036 -7.705 1.00 0.00 C ATOM 680 O TYR A 43 15.286 0.602 -7.278 1.00 0.00 O ATOM 681 CB TYR A 43 16.947 -0.665 -5.405 1.00 0.00 C ATOM 682 CG TYR A 43 17.428 -1.747 -4.455 1.00 0.00 C ATOM 683 CD1 TYR A 43 18.778 -1.961 -4.247 1.00 0.00 C ATOM 684 CD2 TYR A 43 16.524 -2.550 -3.767 1.00 0.00 C ATOM 685 CE1 TYR A 43 19.225 -2.936 -3.391 1.00 0.00 C ATOM 686 CE2 TYR A 43 16.966 -3.544 -2.894 1.00 0.00 C ATOM 687 CZ TYR A 43 18.325 -3.724 -2.716 1.00 0.00 C ATOM 688 OH TYR A 43 18.786 -4.713 -1.872 1.00 0.00 O ATOM 0 H TYR A 43 18.971 -0.642 -7.129 1.00 0.00 H new ATOM 0 HA TYR A 43 16.338 -1.972 -7.016 1.00 0.00 H new ATOM 0 HB2 TYR A 43 17.586 0.211 -5.288 1.00 0.00 H new ATOM 0 HB3 TYR A 43 15.940 -0.367 -5.112 1.00 0.00 H new ATOM 0 HD1 TYR A 43 19.497 -1.347 -4.770 1.00 0.00 H new ATOM 0 HD2 TYR A 43 15.464 -2.402 -3.911 1.00 0.00 H new ATOM 0 HE1 TYR A 43 20.285 -3.084 -3.248 1.00 0.00 H new ATOM 0 HE2 TYR A 43 16.257 -4.164 -2.365 1.00 0.00 H new ATOM 0 HH TYR A 43 19.705 -4.509 -1.600 1.00 0.00 H new ATOM 698 N ALA A 44 16.837 0.318 -8.887 1.00 0.00 N ATOM 699 CA ALA A 44 16.318 1.352 -9.809 1.00 0.00 C ATOM 700 C ALA A 44 14.800 1.250 -10.086 1.00 0.00 C ATOM 701 O ALA A 44 14.153 2.250 -10.426 1.00 0.00 O ATOM 702 CB ALA A 44 17.083 1.313 -11.123 1.00 0.00 C ATOM 0 H ALA A 44 17.664 -0.163 -9.240 1.00 0.00 H new ATOM 0 HA ALA A 44 16.472 2.305 -9.303 1.00 0.00 H new ATOM 0 HB1 ALA A 44 16.693 2.078 -11.794 1.00 0.00 H new ATOM 0 HB2 ALA A 44 18.140 1.501 -10.934 1.00 0.00 H new ATOM 0 HB3 ALA A 44 16.965 0.332 -11.584 1.00 0.00 H new ATOM 708 N GLY A 45 14.245 0.060 -9.961 1.00 0.00 N ATOM 709 CA GLY A 45 12.835 -0.125 -10.206 1.00 0.00 C ATOM 710 C GLY A 45 11.969 0.302 -9.032 1.00 0.00 C ATOM 711 O GLY A 45 10.833 0.705 -9.221 1.00 0.00 O ATOM 0 H GLY A 45 14.748 -0.786 -9.693 1.00 0.00 H new ATOM 0 HA2 GLY A 45 12.547 0.445 -11.089 1.00 0.00 H new ATOM 0 HA3 GLY A 45 12.645 -1.175 -10.428 1.00 0.00 H new ATOM 715 N TRP A 46 12.476 0.138 -7.815 1.00 0.00 N ATOM 716 CA TRP A 46 11.779 0.568 -6.617 1.00 0.00 C ATOM 717 C TRP A 46 11.607 2.095 -6.615 1.00 0.00 C ATOM 718 O TRP A 46 12.383 2.815 -7.249 1.00 0.00 O ATOM 719 CB TRP A 46 12.599 0.191 -5.391 1.00 0.00 C ATOM 720 CG TRP A 46 12.863 -1.263 -5.190 1.00 0.00 C ATOM 721 CD1 TRP A 46 13.728 -2.055 -5.878 1.00 0.00 C ATOM 722 CD2 TRP A 46 12.274 -2.081 -4.205 1.00 0.00 C ATOM 723 NE1 TRP A 46 13.689 -3.331 -5.386 1.00 0.00 N ATOM 724 CE2 TRP A 46 12.802 -3.372 -4.350 1.00 0.00 C ATOM 725 CE3 TRP A 46 11.340 -1.846 -3.217 1.00 0.00 C ATOM 726 CZ2 TRP A 46 12.419 -4.423 -3.531 1.00 0.00 C ATOM 727 CZ3 TRP A 46 10.955 -2.884 -2.420 1.00 0.00 C ATOM 728 CH2 TRP A 46 11.496 -4.160 -2.581 1.00 0.00 C ATOM 0 H TRP A 46 13.381 -0.297 -7.635 1.00 0.00 H new ATOM 0 HA TRP A 46 10.803 0.084 -6.597 1.00 0.00 H new ATOM 0 HB2 TRP A 46 13.557 0.707 -5.449 1.00 0.00 H new ATOM 0 HB3 TRP A 46 12.086 0.570 -4.507 1.00 0.00 H new ATOM 0 HD1 TRP A 46 14.354 -1.725 -6.694 1.00 0.00 H new ATOM 0 HE1 TRP A 46 14.232 -4.120 -5.735 1.00 0.00 H new ATOM 0 HE3 TRP A 46 10.922 -0.860 -3.077 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 12.841 -5.410 -3.648 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 10.217 -2.715 -1.650 1.00 0.00 H new ATOM 0 HH2 TRP A 46 11.169 -4.957 -1.930 1.00 0.00 H new ATOM 739 N THR A 47 10.606 2.579 -5.919 1.00 0.00 N ATOM 740 CA THR A 47 10.396 3.971 -5.780 1.00 0.00 C ATOM 741 C THR A 47 11.233 4.470 -4.597 1.00 0.00 C ATOM 742 O THR A 47 11.029 4.026 -3.456 1.00 0.00 O ATOM 743 CB THR A 47 8.918 4.223 -5.505 1.00 0.00 C ATOM 744 OG1 THR A 47 8.126 3.557 -6.503 1.00 0.00 O ATOM 745 CG2 THR A 47 8.606 5.702 -5.498 1.00 0.00 C ATOM 0 H THR A 47 9.918 2.001 -5.436 1.00 0.00 H new ATOM 0 HA THR A 47 10.689 4.496 -6.689 1.00 0.00 H new ATOM 0 HB THR A 47 8.677 3.826 -4.519 1.00 0.00 H new ATOM 0 HG1 THR A 47 7.175 3.717 -6.326 1.00 0.00 H new ATOM 0 HG21 THR A 47 7.544 5.849 -5.299 1.00 0.00 H new ATOM 0 HG22 THR A 47 9.192 6.194 -4.722 1.00 0.00 H new ATOM 0 HG23 THR A 47 8.856 6.131 -6.468 1.00 0.00 H new ATOM 753 N LEU A 48 12.195 5.323 -4.881 1.00 0.00 N ATOM 754 CA LEU A 48 13.049 5.896 -3.867 1.00 0.00 C ATOM 755 C LEU A 48 12.253 6.953 -3.128 1.00 0.00 C ATOM 756 O LEU A 48 11.939 8.010 -3.685 1.00 0.00 O ATOM 757 CB LEU A 48 14.337 6.481 -4.541 1.00 0.00 C ATOM 758 CG LEU A 48 15.507 7.010 -3.645 1.00 0.00 C ATOM 759 CD1 LEU A 48 15.248 8.384 -3.047 1.00 0.00 C ATOM 760 CD2 LEU A 48 15.813 6.034 -2.542 1.00 0.00 C ATOM 0 H LEU A 48 12.406 5.639 -5.828 1.00 0.00 H new ATOM 0 HA LEU A 48 13.377 5.145 -3.149 1.00 0.00 H new ATOM 0 HB2 LEU A 48 14.747 5.706 -5.188 1.00 0.00 H new ATOM 0 HB3 LEU A 48 14.023 7.302 -5.186 1.00 0.00 H new ATOM 0 HG LEU A 48 16.364 7.110 -4.310 1.00 0.00 H new ATOM 0 HD11 LEU A 48 16.102 8.683 -2.439 1.00 0.00 H new ATOM 0 HD12 LEU A 48 15.102 9.108 -3.849 1.00 0.00 H new ATOM 0 HD13 LEU A 48 14.354 8.347 -2.424 1.00 0.00 H new ATOM 0 HD21 LEU A 48 16.629 6.420 -1.931 1.00 0.00 H new ATOM 0 HD22 LEU A 48 14.928 5.897 -1.921 1.00 0.00 H new ATOM 0 HD23 LEU A 48 16.105 5.077 -2.974 1.00 0.00 H new ATOM 772 N VAL A 49 11.890 6.661 -1.904 1.00 0.00 N ATOM 773 CA VAL A 49 11.104 7.588 -1.136 1.00 0.00 C ATOM 774 C VAL A 49 12.029 8.561 -0.432 1.00 0.00 C ATOM 775 O VAL A 49 11.860 9.774 -0.537 1.00 0.00 O ATOM 776 CB VAL A 49 10.130 6.873 -0.149 1.00 0.00 C ATOM 777 CG1 VAL A 49 9.326 7.877 0.667 1.00 0.00 C ATOM 778 CG2 VAL A 49 9.191 5.972 -0.929 1.00 0.00 C ATOM 0 H VAL A 49 12.125 5.793 -1.422 1.00 0.00 H new ATOM 0 HA VAL A 49 10.460 8.145 -1.816 1.00 0.00 H new ATOM 0 HB VAL A 49 10.724 6.278 0.545 1.00 0.00 H new ATOM 0 HG11 VAL A 49 8.658 7.344 1.344 1.00 0.00 H new ATOM 0 HG12 VAL A 49 10.005 8.503 1.246 1.00 0.00 H new ATOM 0 HG13 VAL A 49 8.738 8.504 -0.004 1.00 0.00 H new ATOM 0 HG21 VAL A 49 8.510 5.472 -0.240 1.00 0.00 H new ATOM 0 HG22 VAL A 49 8.617 6.570 -1.636 1.00 0.00 H new ATOM 0 HG23 VAL A 49 9.771 5.225 -1.472 1.00 0.00 H new ATOM 788 N GLU A 50 13.044 8.040 0.234 1.00 0.00 N ATOM 789 CA GLU A 50 14.039 8.883 0.867 1.00 0.00 C ATOM 790 C GLU A 50 15.261 8.078 1.198 1.00 0.00 C ATOM 791 O GLU A 50 15.204 6.867 1.278 1.00 0.00 O ATOM 792 CB GLU A 50 13.497 9.604 2.119 1.00 0.00 C ATOM 793 CG GLU A 50 13.043 8.712 3.231 1.00 0.00 C ATOM 794 CD GLU A 50 12.406 9.495 4.355 1.00 0.00 C ATOM 795 OE1 GLU A 50 13.131 10.093 5.182 1.00 0.00 O ATOM 796 OE2 GLU A 50 11.167 9.535 4.440 1.00 0.00 O ATOM 0 H GLU A 50 13.200 7.039 0.350 1.00 0.00 H new ATOM 0 HA GLU A 50 14.306 9.663 0.154 1.00 0.00 H new ATOM 0 HB2 GLU A 50 14.275 10.265 2.501 1.00 0.00 H new ATOM 0 HB3 GLU A 50 12.661 10.236 1.819 1.00 0.00 H new ATOM 0 HG2 GLU A 50 12.329 7.985 2.845 1.00 0.00 H new ATOM 0 HG3 GLU A 50 13.894 8.150 3.616 1.00 0.00 H new ATOM 803 N GLN A 51 16.353 8.738 1.320 1.00 0.00 N ATOM 804 CA GLN A 51 17.592 8.140 1.693 1.00 0.00 C ATOM 805 C GLN A 51 18.330 9.042 2.651 1.00 0.00 C ATOM 806 O GLN A 51 18.275 10.261 2.531 1.00 0.00 O ATOM 807 CB GLN A 51 18.430 7.856 0.466 1.00 0.00 C ATOM 808 CG GLN A 51 18.624 9.048 -0.450 1.00 0.00 C ATOM 809 CD GLN A 51 19.563 8.729 -1.557 1.00 0.00 C ATOM 810 OE1 GLN A 51 20.774 8.947 -1.448 1.00 0.00 O ATOM 811 NE2 GLN A 51 19.036 8.195 -2.620 1.00 0.00 N ATOM 0 H GLN A 51 16.417 9.743 1.159 1.00 0.00 H new ATOM 0 HA GLN A 51 17.393 7.192 2.193 1.00 0.00 H new ATOM 0 HB2 GLN A 51 19.408 7.495 0.785 1.00 0.00 H new ATOM 0 HB3 GLN A 51 17.962 7.051 -0.100 1.00 0.00 H new ATOM 0 HG2 GLN A 51 17.662 9.353 -0.862 1.00 0.00 H new ATOM 0 HG3 GLN A 51 19.007 9.892 0.124 1.00 0.00 H new ATOM 0 HE21 GLN A 51 18.030 8.034 -2.664 1.00 0.00 H new ATOM 0 HE22 GLN A 51 19.629 7.938 -3.409 1.00 0.00 H new ATOM 820 N LYS A 52 18.966 8.447 3.611 1.00 0.00 N ATOM 821 CA LYS A 52 19.723 9.158 4.613 1.00 0.00 C ATOM 822 C LYS A 52 20.947 8.362 5.023 1.00 0.00 C ATOM 823 O LYS A 52 20.831 7.370 5.733 1.00 0.00 O ATOM 824 CB LYS A 52 18.829 9.474 5.816 1.00 0.00 C ATOM 825 CG LYS A 52 18.018 8.288 6.318 1.00 0.00 C ATOM 826 CD LYS A 52 16.930 8.675 7.292 1.00 0.00 C ATOM 827 CE LYS A 52 15.807 9.344 6.550 1.00 0.00 C ATOM 828 NZ LYS A 52 14.632 9.651 7.397 1.00 0.00 N ATOM 0 H LYS A 52 18.979 7.434 3.729 1.00 0.00 H new ATOM 0 HA LYS A 52 20.073 10.101 4.193 1.00 0.00 H new ATOM 0 HB2 LYS A 52 19.452 9.845 6.630 1.00 0.00 H new ATOM 0 HB3 LYS A 52 18.146 10.279 5.545 1.00 0.00 H new ATOM 0 HG2 LYS A 52 17.568 7.778 5.466 1.00 0.00 H new ATOM 0 HG3 LYS A 52 18.689 7.576 6.798 1.00 0.00 H new ATOM 0 HD2 LYS A 52 16.561 7.791 7.811 1.00 0.00 H new ATOM 0 HD3 LYS A 52 17.329 9.347 8.051 1.00 0.00 H new ATOM 0 HE2 LYS A 52 16.176 10.269 6.108 1.00 0.00 H new ATOM 0 HE3 LYS A 52 15.493 8.701 5.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 13.803 9.820 6.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 14.441 8.848 8.030 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 14.826 10.501 7.964 1.00 0.00 H new ATOM 842 N LYS A 53 22.108 8.815 4.554 1.00 0.00 N ATOM 843 CA LYS A 53 23.399 8.219 4.766 1.00 0.00 C ATOM 844 C LYS A 53 23.463 6.746 4.389 1.00 0.00 C ATOM 845 O LYS A 53 23.924 6.389 3.312 1.00 0.00 O ATOM 846 CB LYS A 53 23.907 8.537 6.185 1.00 0.00 C ATOM 847 CG LYS A 53 25.379 8.261 6.399 1.00 0.00 C ATOM 848 CD LYS A 53 25.668 6.788 6.599 1.00 0.00 C ATOM 849 CE LYS A 53 27.137 6.453 6.483 1.00 0.00 C ATOM 850 NZ LYS A 53 27.950 7.094 7.526 1.00 0.00 N ATOM 0 H LYS A 53 22.161 9.659 3.983 1.00 0.00 H new ATOM 0 HA LYS A 53 24.098 8.680 4.068 1.00 0.00 H new ATOM 0 HB2 LYS A 53 23.712 9.587 6.401 1.00 0.00 H new ATOM 0 HB3 LYS A 53 23.332 7.952 6.903 1.00 0.00 H new ATOM 0 HG2 LYS A 53 25.943 8.626 5.540 1.00 0.00 H new ATOM 0 HG3 LYS A 53 25.727 8.818 7.269 1.00 0.00 H new ATOM 0 HD2 LYS A 53 25.308 6.483 7.582 1.00 0.00 H new ATOM 0 HD3 LYS A 53 25.110 6.211 5.862 1.00 0.00 H new ATOM 0 HE2 LYS A 53 27.265 5.372 6.542 1.00 0.00 H new ATOM 0 HE3 LYS A 53 27.500 6.764 5.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 28.948 6.831 7.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 27.853 8.127 7.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 27.625 6.779 8.462 1.00 0.00 H new ATOM 864 N GLY A 54 23.001 5.939 5.261 1.00 0.00 N ATOM 865 CA GLY A 54 23.073 4.533 5.092 1.00 0.00 C ATOM 866 C GLY A 54 21.742 3.862 5.218 1.00 0.00 C ATOM 867 O GLY A 54 21.681 2.668 5.267 1.00 0.00 O ATOM 0 H GLY A 54 22.554 6.235 6.129 1.00 0.00 H new ATOM 0 HA2 GLY A 54 23.495 4.311 4.112 1.00 0.00 H new ATOM 0 HA3 GLY A 54 23.755 4.118 5.834 1.00 0.00 H new ATOM 871 N TYR A 55 20.671 4.611 5.324 1.00 0.00 N ATOM 872 CA TYR A 55 19.381 4.013 5.313 1.00 0.00 C ATOM 873 C TYR A 55 18.643 4.517 4.109 1.00 0.00 C ATOM 874 O TYR A 55 18.593 5.720 3.863 1.00 0.00 O ATOM 875 CB TYR A 55 18.627 4.301 6.623 1.00 0.00 C ATOM 876 CG TYR A 55 17.121 4.147 6.538 1.00 0.00 C ATOM 877 CD1 TYR A 55 16.484 2.939 6.760 1.00 0.00 C ATOM 878 CD2 TYR A 55 16.358 5.238 6.218 1.00 0.00 C ATOM 879 CE1 TYR A 55 15.104 2.842 6.658 1.00 0.00 C ATOM 880 CE2 TYR A 55 14.993 5.165 6.110 1.00 0.00 C ATOM 881 CZ TYR A 55 14.363 3.966 6.330 1.00 0.00 C ATOM 882 OH TYR A 55 12.991 3.887 6.215 1.00 0.00 O ATOM 0 H TYR A 55 20.678 5.627 5.418 1.00 0.00 H new ATOM 0 HA TYR A 55 19.467 2.928 5.248 1.00 0.00 H new ATOM 0 HB2 TYR A 55 19.003 3.632 7.397 1.00 0.00 H new ATOM 0 HB3 TYR A 55 18.857 5.318 6.942 1.00 0.00 H new ATOM 0 HD1 TYR A 55 17.065 2.065 7.015 1.00 0.00 H new ATOM 0 HD2 TYR A 55 16.847 6.186 6.045 1.00 0.00 H new ATOM 0 HE1 TYR A 55 14.611 1.897 6.833 1.00 0.00 H new ATOM 0 HE2 TYR A 55 14.419 6.043 5.854 1.00 0.00 H new ATOM 0 HH TYR A 55 12.674 3.061 6.637 1.00 0.00 H new ATOM 892 N VAL A 56 18.105 3.628 3.346 1.00 0.00 N ATOM 893 CA VAL A 56 17.382 4.001 2.180 1.00 0.00 C ATOM 894 C VAL A 56 15.979 3.407 2.238 1.00 0.00 C ATOM 895 O VAL A 56 15.799 2.238 2.535 1.00 0.00 O ATOM 896 CB VAL A 56 18.119 3.576 0.880 1.00 0.00 C ATOM 897 CG1 VAL A 56 17.323 3.980 -0.318 1.00 0.00 C ATOM 898 CG2 VAL A 56 19.501 4.208 0.799 1.00 0.00 C ATOM 0 H VAL A 56 18.154 2.623 3.513 1.00 0.00 H new ATOM 0 HA VAL A 56 17.308 5.088 2.155 1.00 0.00 H new ATOM 0 HB VAL A 56 18.231 2.492 0.901 1.00 0.00 H new ATOM 0 HG11 VAL A 56 17.849 3.677 -1.223 1.00 0.00 H new ATOM 0 HG12 VAL A 56 16.347 3.496 -0.286 1.00 0.00 H new ATOM 0 HG13 VAL A 56 17.192 5.062 -0.320 1.00 0.00 H new ATOM 0 HG21 VAL A 56 19.992 3.892 -0.121 1.00 0.00 H new ATOM 0 HG22 VAL A 56 19.405 5.294 0.805 1.00 0.00 H new ATOM 0 HG23 VAL A 56 20.097 3.891 1.655 1.00 0.00 H new ATOM 908 N LEU A 57 15.013 4.222 1.988 1.00 0.00 N ATOM 909 CA LEU A 57 13.639 3.837 2.028 1.00 0.00 C ATOM 910 C LEU A 57 13.066 3.745 0.608 1.00 0.00 C ATOM 911 O LEU A 57 12.983 4.759 -0.123 1.00 0.00 O ATOM 912 CB LEU A 57 12.884 4.831 2.936 1.00 0.00 C ATOM 913 CG LEU A 57 11.365 4.915 2.833 1.00 0.00 C ATOM 914 CD1 LEU A 57 10.680 3.595 2.954 1.00 0.00 C ATOM 915 CD2 LEU A 57 10.808 5.906 3.832 1.00 0.00 C ATOM 0 H LEU A 57 15.158 5.202 1.743 1.00 0.00 H new ATOM 0 HA LEU A 57 13.522 2.841 2.454 1.00 0.00 H new ATOM 0 HB2 LEU A 57 13.131 4.587 3.969 1.00 0.00 H new ATOM 0 HB3 LEU A 57 13.283 5.826 2.739 1.00 0.00 H new ATOM 0 HG LEU A 57 11.154 5.270 1.824 1.00 0.00 H new ATOM 0 HD11 LEU A 57 9.602 3.735 2.871 1.00 0.00 H new ATOM 0 HD12 LEU A 57 11.022 2.933 2.158 1.00 0.00 H new ATOM 0 HD13 LEU A 57 10.915 3.151 3.921 1.00 0.00 H new ATOM 0 HD21 LEU A 57 9.723 5.947 3.738 1.00 0.00 H new ATOM 0 HD22 LEU A 57 11.073 5.593 4.842 1.00 0.00 H new ATOM 0 HD23 LEU A 57 11.227 6.893 3.637 1.00 0.00 H new ATOM 927 N PHE A 58 12.713 2.523 0.226 1.00 0.00 N ATOM 928 CA PHE A 58 12.147 2.202 -1.086 1.00 0.00 C ATOM 929 C PHE A 58 10.767 1.577 -0.958 1.00 0.00 C ATOM 930 O PHE A 58 10.412 1.010 0.067 1.00 0.00 O ATOM 931 CB PHE A 58 13.005 1.169 -1.832 1.00 0.00 C ATOM 932 CG PHE A 58 14.259 1.649 -2.494 1.00 0.00 C ATOM 933 CD1 PHE A 58 14.196 2.372 -3.669 1.00 0.00 C ATOM 934 CD2 PHE A 58 15.493 1.332 -1.976 1.00 0.00 C ATOM 935 CE1 PHE A 58 15.343 2.777 -4.316 1.00 0.00 C ATOM 936 CE2 PHE A 58 16.645 1.735 -2.615 1.00 0.00 C ATOM 937 CZ PHE A 58 16.572 2.459 -3.785 1.00 0.00 C ATOM 0 H PHE A 58 12.813 1.708 0.831 1.00 0.00 H new ATOM 0 HA PHE A 58 12.106 3.147 -1.627 1.00 0.00 H new ATOM 0 HB2 PHE A 58 13.279 0.387 -1.124 1.00 0.00 H new ATOM 0 HB3 PHE A 58 12.381 0.704 -2.595 1.00 0.00 H new ATOM 0 HD1 PHE A 58 13.233 2.624 -4.087 1.00 0.00 H new ATOM 0 HD2 PHE A 58 15.559 0.762 -1.061 1.00 0.00 H new ATOM 0 HE1 PHE A 58 15.278 3.341 -5.235 1.00 0.00 H new ATOM 0 HE2 PHE A 58 17.609 1.483 -2.197 1.00 0.00 H new ATOM 0 HZ PHE A 58 17.476 2.776 -4.284 1.00 0.00 H new ATOM 947 N ARG A 59 10.007 1.662 -2.009 1.00 0.00 N ATOM 948 CA ARG A 59 8.757 0.959 -2.085 1.00 0.00 C ATOM 949 C ARG A 59 8.607 0.319 -3.439 1.00 0.00 C ATOM 950 O ARG A 59 9.060 0.857 -4.448 1.00 0.00 O ATOM 951 CB ARG A 59 7.556 1.846 -1.759 1.00 0.00 C ATOM 952 CG ARG A 59 7.420 3.056 -2.626 1.00 0.00 C ATOM 953 CD ARG A 59 6.233 3.880 -2.222 1.00 0.00 C ATOM 954 NE ARG A 59 6.253 4.191 -0.777 1.00 0.00 N ATOM 955 CZ ARG A 59 5.599 5.184 -0.174 1.00 0.00 C ATOM 956 NH1 ARG A 59 4.930 6.079 -0.879 1.00 0.00 N ATOM 957 NH2 ARG A 59 5.648 5.273 1.144 1.00 0.00 N ATOM 0 H ARG A 59 10.232 2.217 -2.835 1.00 0.00 H new ATOM 0 HA ARG A 59 8.775 0.182 -1.321 1.00 0.00 H new ATOM 0 HB2 ARG A 59 6.647 1.250 -1.845 1.00 0.00 H new ATOM 0 HB3 ARG A 59 7.630 2.167 -0.720 1.00 0.00 H new ATOM 0 HG2 ARG A 59 8.325 3.659 -2.558 1.00 0.00 H new ATOM 0 HG3 ARG A 59 7.317 2.751 -3.667 1.00 0.00 H new ATOM 0 HD2 ARG A 59 6.222 4.808 -2.794 1.00 0.00 H new ATOM 0 HD3 ARG A 59 5.316 3.343 -2.467 1.00 0.00 H new ATOM 0 HE ARG A 59 6.822 3.587 -0.184 1.00 0.00 H new ATOM 0 HH11 ARG A 59 4.910 6.015 -1.897 1.00 0.00 H new ATOM 0 HH12 ARG A 59 4.434 6.834 -0.405 1.00 0.00 H new ATOM 0 HH21 ARG A 59 6.180 4.589 1.682 1.00 0.00 H new ATOM 0 HH22 ARG A 59 5.154 6.026 1.623 1.00 0.00 H new ATOM 971 N LYS A 60 8.033 -0.830 -3.445 1.00 0.00 N ATOM 972 CA LYS A 60 7.772 -1.585 -4.636 1.00 0.00 C ATOM 973 C LYS A 60 6.368 -2.098 -4.527 1.00 0.00 C ATOM 974 O LYS A 60 6.008 -2.770 -3.559 1.00 0.00 O ATOM 975 CB LYS A 60 8.746 -2.751 -4.750 1.00 0.00 C ATOM 976 CG LYS A 60 8.565 -3.657 -5.936 1.00 0.00 C ATOM 977 CD LYS A 60 9.068 -3.044 -7.221 1.00 0.00 C ATOM 978 CE LYS A 60 10.579 -2.897 -7.234 1.00 0.00 C ATOM 979 NZ LYS A 60 11.052 -2.664 -8.600 1.00 0.00 N ATOM 0 H LYS A 60 7.717 -1.295 -2.594 1.00 0.00 H new ATOM 0 HA LYS A 60 7.896 -0.963 -5.523 1.00 0.00 H new ATOM 0 HB2 LYS A 60 9.759 -2.349 -4.778 1.00 0.00 H new ATOM 0 HB3 LYS A 60 8.667 -3.353 -3.845 1.00 0.00 H new ATOM 0 HG2 LYS A 60 9.091 -4.594 -5.755 1.00 0.00 H new ATOM 0 HG3 LYS A 60 7.508 -3.900 -6.044 1.00 0.00 H new ATOM 0 HD2 LYS A 60 8.758 -3.663 -8.063 1.00 0.00 H new ATOM 0 HD3 LYS A 60 8.608 -2.065 -7.359 1.00 0.00 H new ATOM 0 HE2 LYS A 60 10.877 -2.068 -6.592 1.00 0.00 H new ATOM 0 HE3 LYS A 60 11.043 -3.796 -6.829 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 12.043 -2.349 -8.575 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 10.983 -3.546 -9.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 10.467 -1.931 -9.050 1.00 0.00 H new ATOM 993 N GLN A 61 5.587 -1.737 -5.445 1.00 0.00 N ATOM 994 CA GLN A 61 4.221 -2.098 -5.464 1.00 0.00 C ATOM 995 C GLN A 61 3.917 -2.843 -6.736 1.00 0.00 C ATOM 996 O GLN A 61 4.482 -2.534 -7.791 1.00 0.00 O ATOM 997 CB GLN A 61 3.387 -0.850 -5.265 1.00 0.00 C ATOM 998 CG GLN A 61 3.760 0.282 -6.174 1.00 0.00 C ATOM 999 CD GLN A 61 3.070 1.568 -5.830 1.00 0.00 C ATOM 1000 OE1 GLN A 61 1.989 1.876 -6.333 1.00 0.00 O ATOM 1001 NE2 GLN A 61 3.693 2.335 -4.969 1.00 0.00 N ATOM 0 H GLN A 61 5.876 -1.163 -6.237 1.00 0.00 H new ATOM 0 HA GLN A 61 3.972 -2.778 -4.649 1.00 0.00 H new ATOM 0 HB2 GLN A 61 2.337 -1.098 -5.422 1.00 0.00 H new ATOM 0 HB3 GLN A 61 3.486 -0.520 -4.231 1.00 0.00 H new ATOM 0 HG2 GLN A 61 4.839 0.433 -6.131 1.00 0.00 H new ATOM 0 HG3 GLN A 61 3.517 0.010 -7.201 1.00 0.00 H new ATOM 0 HE21 GLN A 61 4.587 2.040 -4.577 1.00 0.00 H new ATOM 0 HE22 GLN A 61 3.283 3.227 -4.691 1.00 0.00 H new ATOM 1010 N MET A 62 3.080 -3.830 -6.632 1.00 0.00 N ATOM 1011 CA MET A 62 2.782 -4.694 -7.747 1.00 0.00 C ATOM 1012 C MET A 62 1.319 -4.634 -8.099 1.00 0.00 C ATOM 1013 O MET A 62 0.476 -4.302 -7.254 1.00 0.00 O ATOM 1014 CB MET A 62 3.214 -6.154 -7.470 1.00 0.00 C ATOM 1015 CG MET A 62 4.726 -6.431 -7.576 1.00 0.00 C ATOM 1016 SD MET A 62 5.772 -5.620 -6.325 1.00 0.00 S ATOM 1017 CE MET A 62 5.319 -6.482 -4.821 1.00 0.00 C ATOM 0 H MET A 62 2.581 -4.064 -5.774 1.00 0.00 H new ATOM 0 HA MET A 62 3.358 -4.333 -8.599 1.00 0.00 H new ATOM 0 HB2 MET A 62 2.881 -6.429 -6.469 1.00 0.00 H new ATOM 0 HB3 MET A 62 2.693 -6.807 -8.170 1.00 0.00 H new ATOM 0 HG2 MET A 62 4.884 -7.508 -7.511 1.00 0.00 H new ATOM 0 HG3 MET A 62 5.065 -6.118 -8.564 1.00 0.00 H new ATOM 0 HE1 MET A 62 5.102 -5.756 -4.037 1.00 0.00 H new ATOM 0 HE2 MET A 62 4.435 -7.094 -5.004 1.00 0.00 H new ATOM 0 HE3 MET A 62 6.144 -7.121 -4.506 1.00 0.00 H new ATOM 1027 N ASP A 63 1.011 -4.971 -9.333 1.00 0.00 N ATOM 1028 CA ASP A 63 -0.353 -4.943 -9.824 1.00 0.00 C ATOM 1029 C ASP A 63 -1.059 -6.258 -9.522 1.00 0.00 C ATOM 1030 O ASP A 63 -1.237 -7.126 -10.389 1.00 0.00 O ATOM 1031 CB ASP A 63 -0.412 -4.578 -11.327 1.00 0.00 C ATOM 1032 CG ASP A 63 -1.818 -4.603 -11.917 1.00 0.00 C ATOM 1033 OD1 ASP A 63 -2.648 -3.750 -11.572 1.00 0.00 O ATOM 1034 OD2 ASP A 63 -2.099 -5.471 -12.785 1.00 0.00 O ATOM 0 H ASP A 63 1.697 -5.272 -10.025 1.00 0.00 H new ATOM 0 HA ASP A 63 -0.888 -4.154 -9.295 1.00 0.00 H new ATOM 0 HB2 ASP A 63 0.011 -3.583 -11.466 1.00 0.00 H new ATOM 0 HB3 ASP A 63 0.217 -5.273 -11.884 1.00 0.00 H new ATOM 1039 N ASP A 64 -1.326 -6.441 -8.258 1.00 0.00 N ATOM 1040 CA ASP A 64 -2.066 -7.569 -7.728 1.00 0.00 C ATOM 1041 C ASP A 64 -2.423 -7.233 -6.310 1.00 0.00 C ATOM 1042 O ASP A 64 -1.735 -6.427 -5.670 1.00 0.00 O ATOM 1043 CB ASP A 64 -1.278 -8.894 -7.797 1.00 0.00 C ATOM 1044 CG ASP A 64 -2.125 -10.100 -7.396 1.00 0.00 C ATOM 1045 OD1 ASP A 64 -3.111 -10.417 -8.096 1.00 0.00 O ATOM 1046 OD2 ASP A 64 -1.812 -10.772 -6.403 1.00 0.00 O ATOM 0 H ASP A 64 -1.025 -5.787 -7.535 1.00 0.00 H new ATOM 0 HA ASP A 64 -2.956 -7.732 -8.336 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -0.904 -9.038 -8.811 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -0.409 -8.831 -7.142 1.00 0.00 H new ATOM 1051 N ILE A 65 -3.496 -7.778 -5.832 1.00 0.00 N ATOM 1052 CA ILE A 65 -3.969 -7.455 -4.508 1.00 0.00 C ATOM 1053 C ILE A 65 -3.115 -8.017 -3.346 1.00 0.00 C ATOM 1054 O ILE A 65 -2.494 -7.236 -2.655 1.00 0.00 O ATOM 1055 CB ILE A 65 -5.482 -7.698 -4.347 1.00 0.00 C ATOM 1056 CG1 ILE A 65 -5.894 -9.066 -4.925 1.00 0.00 C ATOM 1057 CG2 ILE A 65 -6.263 -6.556 -4.983 1.00 0.00 C ATOM 1058 CD1 ILE A 65 -7.364 -9.385 -4.787 1.00 0.00 C ATOM 0 H ILE A 65 -4.070 -8.454 -6.336 1.00 0.00 H new ATOM 0 HA ILE A 65 -3.821 -6.379 -4.418 1.00 0.00 H new ATOM 0 HB ILE A 65 -5.721 -7.722 -3.284 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -5.626 -9.096 -5.981 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -5.317 -9.846 -4.427 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -7.332 -6.736 -4.865 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -5.997 -5.618 -4.496 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -6.020 -6.496 -6.044 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -7.566 -10.365 -5.220 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -7.638 -9.391 -3.732 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -7.951 -8.630 -5.310 1.00 0.00 H new ATOM 1070 N SER A 66 -3.088 -9.338 -3.162 1.00 0.00 N ATOM 1071 CA SER A 66 -2.330 -10.056 -2.120 1.00 0.00 C ATOM 1072 C SER A 66 -2.885 -11.477 -2.131 1.00 0.00 C ATOM 1073 O SER A 66 -3.915 -11.699 -2.758 1.00 0.00 O ATOM 1074 CB SER A 66 -2.545 -9.445 -0.696 1.00 0.00 C ATOM 1075 OG SER A 66 -3.871 -9.653 -0.227 1.00 0.00 O ATOM 0 H SER A 66 -3.617 -9.972 -3.761 1.00 0.00 H new ATOM 0 HA SER A 66 -1.261 -9.999 -2.327 1.00 0.00 H new ATOM 0 HB2 SER A 66 -1.838 -9.893 0.002 1.00 0.00 H new ATOM 0 HB3 SER A 66 -2.332 -8.376 -0.723 1.00 0.00 H new ATOM 0 HG SER A 66 -3.986 -9.206 0.637 1.00 0.00 H new ATOM 1081 N PRO A 67 -2.257 -12.466 -1.473 1.00 0.00 N ATOM 1082 CA PRO A 67 -2.838 -13.802 -1.407 1.00 0.00 C ATOM 1083 C PRO A 67 -4.054 -13.838 -0.465 1.00 0.00 C ATOM 1084 O PRO A 67 -4.987 -14.610 -0.658 1.00 0.00 O ATOM 1085 CB PRO A 67 -1.718 -14.686 -0.833 1.00 0.00 C ATOM 1086 CG PRO A 67 -0.499 -13.822 -0.730 1.00 0.00 C ATOM 1087 CD PRO A 67 -0.948 -12.389 -0.797 1.00 0.00 C ATOM 0 HA PRO A 67 -3.188 -14.133 -2.385 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -1.998 -15.079 0.144 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -1.531 -15.543 -1.480 1.00 0.00 H new ATOM 0 HG2 PRO A 67 0.028 -14.014 0.204 1.00 0.00 H new ATOM 0 HG3 PRO A 67 0.196 -14.043 -1.540 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -1.035 -11.950 0.197 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -0.243 -11.774 -1.357 1.00 0.00 H new ATOM 1095 N LEU A 68 -4.059 -12.941 0.501 1.00 0.00 N ATOM 1096 CA LEU A 68 -5.043 -12.949 1.559 1.00 0.00 C ATOM 1097 C LEU A 68 -6.337 -12.253 1.117 1.00 0.00 C ATOM 1098 O LEU A 68 -7.424 -12.633 1.535 1.00 0.00 O ATOM 1099 CB LEU A 68 -4.447 -12.302 2.827 1.00 0.00 C ATOM 1100 CG LEU A 68 -4.850 -12.913 4.195 1.00 0.00 C ATOM 1101 CD1 LEU A 68 -6.334 -12.763 4.478 1.00 0.00 C ATOM 1102 CD2 LEU A 68 -4.449 -14.386 4.250 1.00 0.00 C ATOM 0 H LEU A 68 -3.378 -12.185 0.572 1.00 0.00 H new ATOM 0 HA LEU A 68 -5.306 -13.981 1.792 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -3.361 -12.342 2.747 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -4.728 -11.249 2.832 1.00 0.00 H new ATOM 0 HG LEU A 68 -4.316 -12.360 4.968 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -6.566 -13.206 5.446 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -6.597 -11.705 4.490 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -6.906 -13.270 3.701 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -4.736 -14.806 5.214 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -4.954 -14.931 3.452 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -3.370 -14.474 4.123 1.00 0.00 H new ATOM 1114 N SER A 69 -6.238 -11.276 0.256 1.00 0.00 N ATOM 1115 CA SER A 69 -7.426 -10.584 -0.232 1.00 0.00 C ATOM 1116 C SER A 69 -8.278 -11.491 -1.130 1.00 0.00 C ATOM 1117 O SER A 69 -9.475 -11.294 -1.281 1.00 0.00 O ATOM 1118 CB SER A 69 -7.027 -9.311 -0.943 1.00 0.00 C ATOM 1119 OG SER A 69 -5.974 -9.573 -1.839 1.00 0.00 O ATOM 0 H SER A 69 -5.357 -10.934 -0.127 1.00 0.00 H new ATOM 0 HA SER A 69 -8.047 -10.319 0.624 1.00 0.00 H new ATOM 0 HB2 SER A 69 -7.882 -8.902 -1.482 1.00 0.00 H new ATOM 0 HB3 SER A 69 -6.719 -8.559 -0.216 1.00 0.00 H new ATOM 0 HG SER A 69 -5.117 -9.390 -1.400 1.00 0.00 H new ATOM 1125 N LYS A 70 -7.648 -12.482 -1.709 1.00 0.00 N ATOM 1126 CA LYS A 70 -8.341 -13.452 -2.517 1.00 0.00 C ATOM 1127 C LYS A 70 -9.060 -14.473 -1.623 1.00 0.00 C ATOM 1128 O LYS A 70 -10.027 -15.107 -2.045 1.00 0.00 O ATOM 1129 CB LYS A 70 -7.336 -14.123 -3.449 1.00 0.00 C ATOM 1130 CG LYS A 70 -6.551 -13.092 -4.230 1.00 0.00 C ATOM 1131 CD LYS A 70 -5.441 -13.673 -5.066 1.00 0.00 C ATOM 1132 CE LYS A 70 -4.575 -12.540 -5.578 1.00 0.00 C ATOM 1133 NZ LYS A 70 -3.475 -12.976 -6.466 1.00 0.00 N ATOM 0 H LYS A 70 -6.643 -12.638 -1.634 1.00 0.00 H new ATOM 0 HA LYS A 70 -9.104 -12.962 -3.122 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -6.653 -14.742 -2.868 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -7.859 -14.786 -4.138 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -7.234 -12.546 -4.880 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -6.127 -12.369 -3.533 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -4.845 -14.366 -4.473 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -5.853 -14.240 -5.900 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -5.204 -11.831 -6.117 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -4.151 -12.007 -4.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -2.654 -12.351 -6.335 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -3.207 -13.953 -6.232 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -3.790 -12.931 -7.456 1.00 0.00 H new ATOM 1147 N VAL A 71 -8.611 -14.606 -0.378 1.00 0.00 N ATOM 1148 CA VAL A 71 -9.232 -15.555 0.544 1.00 0.00 C ATOM 1149 C VAL A 71 -10.296 -14.834 1.381 1.00 0.00 C ATOM 1150 O VAL A 71 -11.410 -15.308 1.531 1.00 0.00 O ATOM 1151 CB VAL A 71 -8.177 -16.319 1.455 1.00 0.00 C ATOM 1152 CG1 VAL A 71 -6.981 -16.728 0.648 1.00 0.00 C ATOM 1153 CG2 VAL A 71 -7.725 -15.540 2.676 1.00 0.00 C ATOM 0 H VAL A 71 -7.831 -14.078 0.013 1.00 0.00 H new ATOM 0 HA VAL A 71 -9.713 -16.332 -0.050 1.00 0.00 H new ATOM 0 HB VAL A 71 -8.703 -17.198 1.828 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -6.270 -17.249 1.289 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -7.296 -17.390 -0.159 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -6.507 -15.842 0.226 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -7.007 -16.134 3.241 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -7.257 -14.608 2.360 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -8.587 -15.318 3.305 1.00 0.00 H new ATOM 1163 N ASN A 72 -9.946 -13.659 1.862 1.00 0.00 N ATOM 1164 CA ASN A 72 -10.844 -12.836 2.641 1.00 0.00 C ATOM 1165 C ASN A 72 -11.300 -11.687 1.783 1.00 0.00 C ATOM 1166 O ASN A 72 -12.366 -11.760 1.190 1.00 0.00 O ATOM 1167 CB ASN A 72 -10.160 -12.331 3.937 1.00 0.00 C ATOM 1168 CG ASN A 72 -11.020 -11.370 4.760 1.00 0.00 C ATOM 1169 OD1 ASN A 72 -10.962 -10.156 4.575 1.00 0.00 O ATOM 1170 ND2 ASN A 72 -11.779 -11.894 5.681 1.00 0.00 N ATOM 0 H ASN A 72 -9.024 -13.247 1.722 1.00 0.00 H new ATOM 0 HA ASN A 72 -11.706 -13.427 2.951 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -9.899 -13.189 4.556 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -9.227 -11.833 3.673 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -12.349 -11.292 6.275 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -11.803 -12.906 5.807 1.00 0.00 H new ATOM 1177 N GLY A 73 -10.436 -10.675 1.673 1.00 0.00 N ATOM 1178 CA GLY A 73 -10.671 -9.517 0.839 1.00 0.00 C ATOM 1179 C GLY A 73 -11.989 -8.816 1.066 1.00 0.00 C ATOM 1180 O GLY A 73 -12.925 -9.058 0.353 1.00 0.00 O ATOM 0 H GLY A 73 -9.546 -10.646 2.171 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -9.865 -8.802 1.003 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -10.617 -9.825 -0.205 1.00 0.00 H new ATOM 1184 N TYR A 74 -11.992 -7.864 1.970 1.00 0.00 N ATOM 1185 CA TYR A 74 -13.145 -7.109 2.354 1.00 0.00 C ATOM 1186 C TYR A 74 -12.753 -5.673 2.369 1.00 0.00 C ATOM 1187 O TYR A 74 -11.824 -5.265 3.070 1.00 0.00 O ATOM 1188 CB TYR A 74 -13.634 -7.503 3.755 1.00 0.00 C ATOM 1189 CG TYR A 74 -14.585 -8.684 3.838 1.00 0.00 C ATOM 1190 CD1 TYR A 74 -14.229 -9.956 3.422 1.00 0.00 C ATOM 1191 CD2 TYR A 74 -15.841 -8.509 4.388 1.00 0.00 C ATOM 1192 CE1 TYR A 74 -15.107 -11.014 3.556 1.00 0.00 C ATOM 1193 CE2 TYR A 74 -16.722 -9.546 4.519 1.00 0.00 C ATOM 1194 CZ TYR A 74 -16.355 -10.797 4.104 1.00 0.00 C ATOM 1195 OH TYR A 74 -17.228 -11.845 4.257 1.00 0.00 O ATOM 0 H TYR A 74 -11.150 -7.589 2.475 1.00 0.00 H new ATOM 0 HA TYR A 74 -13.954 -7.303 1.649 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -12.762 -7.725 4.370 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -14.126 -6.638 4.199 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -13.254 -10.123 2.988 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -16.135 -7.525 4.724 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -14.819 -12.004 3.234 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -17.700 -9.379 4.947 1.00 0.00 H new ATOM 0 HH TYR A 74 -18.061 -11.521 4.659 1.00 0.00 H new ATOM 1205 N ILE A 75 -13.380 -4.937 1.556 1.00 0.00 N ATOM 1206 CA ILE A 75 -13.189 -3.532 1.517 1.00 0.00 C ATOM 1207 C ILE A 75 -14.163 -2.935 2.487 1.00 0.00 C ATOM 1208 O ILE A 75 -15.374 -3.122 2.350 1.00 0.00 O ATOM 1209 CB ILE A 75 -13.412 -3.032 0.095 1.00 0.00 C ATOM 1210 CG1 ILE A 75 -12.260 -3.488 -0.785 1.00 0.00 C ATOM 1211 CG2 ILE A 75 -13.592 -1.506 0.027 1.00 0.00 C ATOM 1212 CD1 ILE A 75 -12.495 -3.304 -2.264 1.00 0.00 C ATOM 0 H ILE A 75 -14.058 -5.287 0.879 1.00 0.00 H new ATOM 0 HA ILE A 75 -12.176 -3.245 1.798 1.00 0.00 H new ATOM 0 HB ILE A 75 -14.344 -3.463 -0.272 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -11.362 -2.939 -0.501 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -12.064 -4.542 -0.589 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -13.747 -1.204 -1.009 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -14.456 -1.215 0.624 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -12.700 -1.017 0.418 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -11.624 -3.655 -2.817 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -13.372 -3.876 -2.567 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -12.659 -2.248 -2.478 1.00 0.00 H new ATOM 1224 N GLY A 76 -13.634 -2.276 3.465 1.00 0.00 N ATOM 1225 CA GLY A 76 -14.417 -1.766 4.522 1.00 0.00 C ATOM 1226 C GLY A 76 -14.443 -0.279 4.543 1.00 0.00 C ATOM 1227 O GLY A 76 -13.420 0.405 4.811 1.00 0.00 O ATOM 0 H GLY A 76 -12.636 -2.079 3.546 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -15.436 -2.143 4.431 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -14.025 -2.133 5.471 1.00 0.00 H new ATOM 1231 N VAL A 77 -15.571 0.237 4.264 1.00 0.00 N ATOM 1232 CA VAL A 77 -15.740 1.625 4.262 1.00 0.00 C ATOM 1233 C VAL A 77 -16.558 2.019 5.445 1.00 0.00 C ATOM 1234 O VAL A 77 -17.579 1.416 5.733 1.00 0.00 O ATOM 1235 CB VAL A 77 -16.323 2.137 2.935 1.00 0.00 C ATOM 1236 CG1 VAL A 77 -16.550 3.631 2.951 1.00 0.00 C ATOM 1237 CG2 VAL A 77 -15.411 1.741 1.784 1.00 0.00 C ATOM 0 H VAL A 77 -16.408 -0.297 4.029 1.00 0.00 H new ATOM 0 HA VAL A 77 -14.764 2.103 4.345 1.00 0.00 H new ATOM 0 HB VAL A 77 -17.299 1.672 2.797 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -16.963 3.947 1.993 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -17.249 3.884 3.748 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -15.602 4.141 3.124 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -15.829 2.106 0.846 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -14.424 2.177 1.935 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -15.326 0.655 1.744 1.00 0.00 H new ATOM 1247 N SER A 78 -16.080 2.990 6.152 1.00 0.00 N ATOM 1248 CA SER A 78 -16.714 3.420 7.346 1.00 0.00 C ATOM 1249 C SER A 78 -17.571 4.633 7.025 1.00 0.00 C ATOM 1250 O SER A 78 -17.457 5.174 5.926 1.00 0.00 O ATOM 1251 CB SER A 78 -15.638 3.740 8.365 1.00 0.00 C ATOM 1252 OG SER A 78 -14.685 2.679 8.412 1.00 0.00 O ATOM 0 H SER A 78 -15.234 3.507 5.913 1.00 0.00 H new ATOM 0 HA SER A 78 -17.362 2.648 7.762 1.00 0.00 H new ATOM 0 HB2 SER A 78 -15.142 4.675 8.103 1.00 0.00 H new ATOM 0 HB3 SER A 78 -16.086 3.882 9.348 1.00 0.00 H new ATOM 0 HG SER A 78 -13.991 2.891 9.071 1.00 0.00 H new ATOM 1258 N ASP A 79 -18.365 5.067 7.992 1.00 0.00 N ATOM 1259 CA ASP A 79 -19.385 6.136 7.883 1.00 0.00 C ATOM 1260 C ASP A 79 -18.860 7.403 7.210 1.00 0.00 C ATOM 1261 O ASP A 79 -19.555 8.034 6.417 1.00 0.00 O ATOM 1262 CB ASP A 79 -19.863 6.507 9.283 1.00 0.00 C ATOM 1263 CG ASP A 79 -20.168 5.314 10.163 1.00 0.00 C ATOM 1264 OD1 ASP A 79 -19.208 4.635 10.599 1.00 0.00 O ATOM 1265 OD2 ASP A 79 -21.346 5.044 10.456 1.00 0.00 O ATOM 0 H ASP A 79 -18.324 4.671 8.931 1.00 0.00 H new ATOM 0 HA ASP A 79 -20.192 5.742 7.265 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -19.100 7.117 9.767 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -20.759 7.123 9.199 1.00 0.00 H new ATOM 1270 N ASN A 80 -17.631 7.750 7.513 1.00 0.00 N ATOM 1271 CA ASN A 80 -17.002 8.949 6.966 1.00 0.00 C ATOM 1272 C ASN A 80 -16.330 8.659 5.632 1.00 0.00 C ATOM 1273 O ASN A 80 -15.442 9.393 5.199 1.00 0.00 O ATOM 1274 CB ASN A 80 -15.997 9.550 7.962 1.00 0.00 C ATOM 1275 CG ASN A 80 -16.663 10.201 9.169 1.00 0.00 C ATOM 1276 OD1 ASN A 80 -16.977 11.387 9.150 1.00 0.00 O ATOM 1277 ND2 ASN A 80 -16.868 9.445 10.217 1.00 0.00 N ATOM 0 H ASN A 80 -17.033 7.216 8.143 1.00 0.00 H new ATOM 0 HA ASN A 80 -17.789 9.684 6.793 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -15.323 8.765 8.306 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -15.386 10.292 7.448 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -17.301 9.838 11.053 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -16.595 8.463 10.198 1.00 0.00 H new ATOM 1284 N GLY A 81 -16.757 7.575 4.994 1.00 0.00 N ATOM 1285 CA GLY A 81 -16.281 7.195 3.690 1.00 0.00 C ATOM 1286 C GLY A 81 -14.879 6.747 3.726 1.00 0.00 C ATOM 1287 O GLY A 81 -14.119 7.019 2.830 1.00 0.00 O ATOM 0 H GLY A 81 -17.451 6.935 5.381 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -16.907 6.396 3.294 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -16.374 8.041 3.009 1.00 0.00 H new ATOM 1291 N VAL A 82 -14.539 6.074 4.771 1.00 0.00 N ATOM 1292 CA VAL A 82 -13.199 5.602 4.957 1.00 0.00 C ATOM 1293 C VAL A 82 -12.980 4.377 4.065 1.00 0.00 C ATOM 1294 O VAL A 82 -13.494 3.333 4.333 1.00 0.00 O ATOM 1295 CB VAL A 82 -12.941 5.272 6.442 1.00 0.00 C ATOM 1296 CG1 VAL A 82 -11.468 5.057 6.693 1.00 0.00 C ATOM 1297 CG2 VAL A 82 -13.486 6.382 7.336 1.00 0.00 C ATOM 0 H VAL A 82 -15.180 5.832 5.526 1.00 0.00 H new ATOM 0 HA VAL A 82 -12.489 6.379 4.673 1.00 0.00 H new ATOM 0 HB VAL A 82 -13.464 4.347 6.685 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -11.308 4.826 7.746 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -11.112 4.228 6.081 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -10.919 5.962 6.433 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -13.296 6.134 8.380 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -12.992 7.322 7.091 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -14.559 6.484 7.177 1.00 0.00 H new ATOM 1307 N ILE A 83 -12.160 4.554 3.063 1.00 0.00 N ATOM 1308 CA ILE A 83 -11.903 3.620 1.929 1.00 0.00 C ATOM 1309 C ILE A 83 -10.917 2.504 2.292 1.00 0.00 C ATOM 1310 O ILE A 83 -10.019 2.162 1.537 1.00 0.00 O ATOM 1311 CB ILE A 83 -11.511 4.381 0.600 1.00 0.00 C ATOM 1312 CG1 ILE A 83 -12.542 5.480 0.329 1.00 0.00 C ATOM 1313 CG2 ILE A 83 -11.476 3.427 -0.615 1.00 0.00 C ATOM 1314 CD1 ILE A 83 -13.970 4.969 0.322 1.00 0.00 C ATOM 0 H ILE A 83 -11.602 5.404 2.985 1.00 0.00 H new ATOM 0 HA ILE A 83 -12.850 3.120 1.723 1.00 0.00 H new ATOM 0 HB ILE A 83 -10.515 4.803 0.736 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -12.444 6.256 1.088 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -12.324 5.945 -0.633 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -11.203 3.987 -1.509 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -10.741 2.642 -0.440 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -12.460 2.979 -0.754 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -14.652 5.796 0.125 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -14.082 4.213 -0.455 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -14.204 4.530 1.292 1.00 0.00 H new ATOM 1326 N SER A 84 -11.005 2.025 3.482 1.00 0.00 N ATOM 1327 CA SER A 84 -9.973 1.143 3.965 1.00 0.00 C ATOM 1328 C SER A 84 -10.343 -0.310 3.707 1.00 0.00 C ATOM 1329 O SER A 84 -11.435 -0.614 3.258 1.00 0.00 O ATOM 1330 CB SER A 84 -9.811 1.387 5.445 1.00 0.00 C ATOM 1331 OG SER A 84 -9.615 2.764 5.662 1.00 0.00 O ATOM 0 H SER A 84 -11.762 2.217 4.138 1.00 0.00 H new ATOM 0 HA SER A 84 -9.038 1.342 3.442 1.00 0.00 H new ATOM 0 HB2 SER A 84 -10.695 1.043 5.983 1.00 0.00 H new ATOM 0 HB3 SER A 84 -8.963 0.820 5.830 1.00 0.00 H new ATOM 0 HG SER A 84 -9.590 2.943 6.625 1.00 0.00 H new ATOM 1337 N THR A 85 -9.416 -1.185 3.882 1.00 0.00 N ATOM 1338 CA THR A 85 -9.706 -2.565 3.775 1.00 0.00 C ATOM 1339 C THR A 85 -9.564 -3.206 5.129 1.00 0.00 C ATOM 1340 O THR A 85 -8.803 -2.705 5.996 1.00 0.00 O ATOM 1341 CB THR A 85 -8.847 -3.266 2.704 1.00 0.00 C ATOM 1342 OG1 THR A 85 -7.463 -3.035 2.942 1.00 0.00 O ATOM 1343 CG2 THR A 85 -9.212 -2.755 1.319 1.00 0.00 C ATOM 0 H THR A 85 -8.445 -0.964 4.101 1.00 0.00 H new ATOM 0 HA THR A 85 -10.736 -2.679 3.437 1.00 0.00 H new ATOM 0 HB THR A 85 -9.044 -4.337 2.759 1.00 0.00 H new ATOM 0 HG1 THR A 85 -6.941 -3.363 2.180 1.00 0.00 H new ATOM 0 HG21 THR A 85 -8.598 -3.258 0.572 1.00 0.00 H new ATOM 0 HG22 THR A 85 -10.264 -2.960 1.121 1.00 0.00 H new ATOM 0 HG23 THR A 85 -9.036 -1.680 1.269 1.00 0.00 H new ATOM 1351 N PHE A 86 -10.325 -4.241 5.350 1.00 0.00 N ATOM 1352 CA PHE A 86 -10.341 -4.933 6.607 1.00 0.00 C ATOM 1353 C PHE A 86 -10.387 -6.418 6.337 1.00 0.00 C ATOM 1354 O PHE A 86 -10.487 -6.845 5.176 1.00 0.00 O ATOM 1355 CB PHE A 86 -11.592 -4.563 7.436 1.00 0.00 C ATOM 1356 CG PHE A 86 -11.680 -3.150 7.948 1.00 0.00 C ATOM 1357 CD1 PHE A 86 -11.927 -2.095 7.096 1.00 0.00 C ATOM 1358 CD2 PHE A 86 -11.565 -2.898 9.295 1.00 0.00 C ATOM 1359 CE1 PHE A 86 -12.049 -0.809 7.579 1.00 0.00 C ATOM 1360 CE2 PHE A 86 -11.679 -1.616 9.790 1.00 0.00 C ATOM 1361 CZ PHE A 86 -11.922 -0.569 8.929 1.00 0.00 C ATOM 0 H PHE A 86 -10.959 -4.632 4.653 1.00 0.00 H new ATOM 0 HA PHE A 86 -9.448 -4.651 7.165 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -12.473 -4.757 6.824 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -11.643 -5.237 8.291 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -12.026 -2.278 6.036 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -11.383 -3.717 9.976 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -12.244 0.008 6.900 1.00 0.00 H new ATOM 0 HE2 PHE A 86 -11.578 -1.434 10.850 1.00 0.00 H new ATOM 0 HZ PHE A 86 -12.013 0.437 9.311 1.00 0.00 H new ATOM 1371 N HIS A 87 -10.333 -7.198 7.378 1.00 0.00 N ATOM 1372 CA HIS A 87 -10.511 -8.610 7.247 1.00 0.00 C ATOM 1373 C HIS A 87 -11.760 -9.007 7.977 1.00 0.00 C ATOM 1374 O HIS A 87 -11.786 -9.081 9.212 1.00 0.00 O ATOM 1375 CB HIS A 87 -9.294 -9.420 7.723 1.00 0.00 C ATOM 1376 CG HIS A 87 -8.069 -9.251 6.866 1.00 0.00 C ATOM 1377 ND1 HIS A 87 -8.089 -9.274 5.486 1.00 0.00 N ATOM 1378 CD2 HIS A 87 -6.776 -9.053 7.216 1.00 0.00 C ATOM 1379 CE1 HIS A 87 -6.835 -9.099 5.049 1.00 0.00 C ATOM 1380 NE2 HIS A 87 -5.995 -8.960 6.064 1.00 0.00 N ATOM 0 H HIS A 87 -10.166 -6.875 8.331 1.00 0.00 H new ATOM 0 HA HIS A 87 -10.611 -8.845 6.187 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -9.053 -9.126 8.745 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -9.562 -10.476 7.750 1.00 0.00 H new ATOM 0 HD1 HIS A 87 -8.915 -9.402 4.901 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -6.407 -8.979 8.228 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -6.547 -9.074 4.008 1.00 0.00 H new ATOM 1388 N GLY A 88 -12.799 -9.220 7.215 1.00 0.00 N ATOM 1389 CA GLY A 88 -14.083 -9.545 7.772 1.00 0.00 C ATOM 1390 C GLY A 88 -14.991 -8.338 7.738 1.00 0.00 C ATOM 1391 O GLY A 88 -14.621 -7.313 7.156 1.00 0.00 O ATOM 0 H GLY A 88 -12.779 -9.173 6.196 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -14.534 -10.363 7.211 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -13.964 -9.890 8.799 1.00 0.00 H new ATOM 1395 N ARG A 89 -16.173 -8.467 8.326 1.00 0.00 N ATOM 1396 CA ARG A 89 -17.157 -7.373 8.399 1.00 0.00 C ATOM 1397 C ARG A 89 -16.561 -6.170 9.140 1.00 0.00 C ATOM 1398 O ARG A 89 -16.216 -6.269 10.324 1.00 0.00 O ATOM 1399 CB ARG A 89 -18.417 -7.834 9.141 1.00 0.00 C ATOM 1400 CG ARG A 89 -19.197 -8.958 8.472 1.00 0.00 C ATOM 1401 CD ARG A 89 -20.035 -8.506 7.276 1.00 0.00 C ATOM 1402 NE ARG A 89 -20.542 -9.671 6.537 1.00 0.00 N ATOM 1403 CZ ARG A 89 -21.522 -9.657 5.637 1.00 0.00 C ATOM 1404 NH1 ARG A 89 -22.317 -8.601 5.516 1.00 0.00 N ATOM 1405 NH2 ARG A 89 -21.745 -10.728 4.904 1.00 0.00 N ATOM 0 H ARG A 89 -16.486 -9.331 8.769 1.00 0.00 H new ATOM 0 HA ARG A 89 -17.418 -7.086 7.380 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -18.130 -8.159 10.141 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -19.080 -6.977 9.262 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -18.497 -9.726 8.143 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -19.854 -9.420 9.209 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -20.869 -7.893 7.619 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -19.432 -7.883 6.616 1.00 0.00 H new ATOM 0 HE ARG A 89 -20.103 -10.571 6.732 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -22.180 -7.788 6.117 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -23.065 -8.602 4.822 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -21.168 -11.560 5.028 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -22.494 -10.725 4.212 1.00 0.00 H new ATOM 1419 N PRO A 90 -16.426 -5.037 8.459 1.00 0.00 N ATOM 1420 CA PRO A 90 -15.859 -3.849 9.034 1.00 0.00 C ATOM 1421 C PRO A 90 -16.782 -3.172 10.041 1.00 0.00 C ATOM 1422 O PRO A 90 -17.869 -2.678 9.719 1.00 0.00 O ATOM 1423 CB PRO A 90 -15.581 -2.939 7.843 1.00 0.00 C ATOM 1424 CG PRO A 90 -16.487 -3.413 6.769 1.00 0.00 C ATOM 1425 CD PRO A 90 -16.804 -4.846 7.063 1.00 0.00 C ATOM 0 HA PRO A 90 -14.961 -4.084 9.606 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -15.777 -1.896 8.091 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -14.538 -3.003 7.534 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -17.398 -2.815 6.741 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -16.012 -3.316 5.793 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -17.862 -5.056 6.908 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -16.247 -5.516 6.408 1.00 0.00 H new ATOM 1433 N GLU A 91 -16.375 -3.252 11.248 1.00 0.00 N ATOM 1434 CA GLU A 91 -16.983 -2.573 12.351 1.00 0.00 C ATOM 1435 C GLU A 91 -15.899 -1.642 12.916 1.00 0.00 C ATOM 1436 O GLU A 91 -14.720 -1.822 12.586 1.00 0.00 O ATOM 1437 CB GLU A 91 -17.448 -3.619 13.390 1.00 0.00 C ATOM 1438 CG GLU A 91 -16.339 -4.534 13.846 1.00 0.00 C ATOM 1439 CD GLU A 91 -16.776 -5.597 14.799 1.00 0.00 C ATOM 1440 OE1 GLU A 91 -17.401 -6.578 14.361 1.00 0.00 O ATOM 1441 OE2 GLU A 91 -16.449 -5.508 15.991 1.00 0.00 O ATOM 0 H GLU A 91 -15.571 -3.817 11.520 1.00 0.00 H new ATOM 0 HA GLU A 91 -17.862 -1.995 12.066 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -17.864 -3.103 14.255 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -18.251 -4.218 12.960 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -15.891 -5.007 12.972 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -15.560 -3.935 14.319 1.00 0.00 H new ATOM 1448 N PRO A 92 -16.234 -0.651 13.748 1.00 0.00 N ATOM 1449 CA PRO A 92 -15.231 0.265 14.299 1.00 0.00 C ATOM 1450 C PRO A 92 -14.257 -0.442 15.257 1.00 0.00 C ATOM 1451 O PRO A 92 -13.168 0.060 15.540 1.00 0.00 O ATOM 1452 CB PRO A 92 -16.046 1.342 15.019 1.00 0.00 C ATOM 1453 CG PRO A 92 -17.401 0.754 15.229 1.00 0.00 C ATOM 1454 CD PRO A 92 -17.586 -0.334 14.205 1.00 0.00 C ATOM 0 HA PRO A 92 -14.595 0.680 13.517 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -15.585 1.611 15.969 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -16.103 2.253 14.423 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -17.492 0.351 16.238 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -18.171 1.518 15.121 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -18.072 -1.208 14.640 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -18.214 0.002 13.380 1.00 0.00 H new ATOM 1462 N ALA A 93 -14.647 -1.614 15.718 1.00 0.00 N ATOM 1463 CA ALA A 93 -13.805 -2.419 16.572 1.00 0.00 C ATOM 1464 C ALA A 93 -13.045 -3.463 15.751 1.00 0.00 C ATOM 1465 O ALA A 93 -12.387 -4.338 16.300 1.00 0.00 O ATOM 1466 CB ALA A 93 -14.633 -3.086 17.657 1.00 0.00 C ATOM 0 H ALA A 93 -15.554 -2.032 15.510 1.00 0.00 H new ATOM 0 HA ALA A 93 -13.075 -1.767 17.050 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -13.983 -3.689 18.292 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -15.124 -2.323 18.261 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -15.387 -3.726 17.198 1.00 0.00 H new ATOM 1472 N SER A 94 -13.130 -3.364 14.429 1.00 0.00 N ATOM 1473 CA SER A 94 -12.408 -4.288 13.565 1.00 0.00 C ATOM 1474 C SER A 94 -10.972 -3.785 13.391 1.00 0.00 C ATOM 1475 O SER A 94 -10.571 -2.799 14.026 1.00 0.00 O ATOM 1476 CB SER A 94 -13.117 -4.436 12.202 1.00 0.00 C ATOM 1477 OG SER A 94 -12.562 -5.483 11.415 1.00 0.00 O ATOM 0 H SER A 94 -13.684 -2.663 13.938 1.00 0.00 H new ATOM 0 HA SER A 94 -12.388 -5.276 14.025 1.00 0.00 H new ATOM 0 HB2 SER A 94 -14.177 -4.630 12.366 1.00 0.00 H new ATOM 0 HB3 SER A 94 -13.046 -3.496 11.654 1.00 0.00 H new ATOM 0 HG SER A 94 -12.234 -6.196 12.003 1.00 0.00 H new ATOM 1483 N GLU A 95 -10.208 -4.431 12.555 1.00 0.00 N ATOM 1484 CA GLU A 95 -8.827 -4.076 12.378 1.00 0.00 C ATOM 1485 C GLU A 95 -8.573 -3.500 10.999 1.00 0.00 C ATOM 1486 O GLU A 95 -8.619 -4.223 9.996 1.00 0.00 O ATOM 1487 CB GLU A 95 -7.926 -5.273 12.632 1.00 0.00 C ATOM 1488 CG GLU A 95 -8.049 -5.818 14.035 1.00 0.00 C ATOM 1489 CD GLU A 95 -7.106 -6.948 14.297 1.00 0.00 C ATOM 1490 OE1 GLU A 95 -7.392 -8.092 13.883 1.00 0.00 O ATOM 1491 OE2 GLU A 95 -6.042 -6.715 14.905 1.00 0.00 O ATOM 0 H GLU A 95 -10.522 -5.213 11.980 1.00 0.00 H new ATOM 0 HA GLU A 95 -8.590 -3.303 13.109 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -8.169 -6.061 11.920 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -6.890 -4.986 12.449 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -7.859 -5.017 14.750 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -9.072 -6.157 14.201 1.00 0.00 H new ATOM 1498 N PRO A 96 -8.356 -2.179 10.918 1.00 0.00 N ATOM 1499 CA PRO A 96 -8.021 -1.524 9.666 1.00 0.00 C ATOM 1500 C PRO A 96 -6.627 -1.915 9.230 1.00 0.00 C ATOM 1501 O PRO A 96 -5.697 -1.956 10.046 1.00 0.00 O ATOM 1502 CB PRO A 96 -8.054 -0.023 9.986 1.00 0.00 C ATOM 1503 CG PRO A 96 -8.650 0.090 11.344 1.00 0.00 C ATOM 1504 CD PRO A 96 -8.428 -1.227 12.032 1.00 0.00 C ATOM 0 HA PRO A 96 -8.707 -1.799 8.865 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -7.051 0.404 9.963 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -8.649 0.520 9.252 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -8.184 0.901 11.904 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -9.714 0.317 11.280 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -7.510 -1.225 12.620 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -9.243 -1.467 12.715 1.00 0.00 H new ATOM 1512 N ILE A 97 -6.488 -2.225 7.982 1.00 0.00 N ATOM 1513 CA ILE A 97 -5.200 -2.606 7.435 1.00 0.00 C ATOM 1514 C ILE A 97 -4.423 -1.336 7.044 1.00 0.00 C ATOM 1515 O ILE A 97 -3.205 -1.267 7.165 1.00 0.00 O ATOM 1516 CB ILE A 97 -5.401 -3.531 6.206 1.00 0.00 C ATOM 1517 CG1 ILE A 97 -6.313 -4.704 6.596 1.00 0.00 C ATOM 1518 CG2 ILE A 97 -4.055 -4.058 5.702 1.00 0.00 C ATOM 1519 CD1 ILE A 97 -6.824 -5.506 5.422 1.00 0.00 C ATOM 0 H ILE A 97 -7.251 -2.225 7.306 1.00 0.00 H new ATOM 0 HA ILE A 97 -4.627 -3.155 8.182 1.00 0.00 H new ATOM 0 HB ILE A 97 -5.866 -2.958 5.403 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -5.766 -5.368 7.265 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -7.164 -4.317 7.156 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -4.217 -4.705 4.840 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -3.421 -3.220 5.413 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -3.567 -4.625 6.494 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -7.460 -6.315 5.783 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -7.401 -4.858 4.762 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -5.981 -5.925 4.873 1.00 0.00 H new ATOM 1531 N GLN A 98 -5.166 -0.335 6.598 1.00 0.00 N ATOM 1532 CA GLN A 98 -4.638 0.958 6.218 1.00 0.00 C ATOM 1533 C GLN A 98 -5.818 1.875 6.061 1.00 0.00 C ATOM 1534 O GLN A 98 -6.910 1.518 6.505 1.00 0.00 O ATOM 1535 CB GLN A 98 -3.816 0.885 4.898 1.00 0.00 C ATOM 1536 CG GLN A 98 -4.584 0.748 3.563 1.00 0.00 C ATOM 1537 CD GLN A 98 -5.816 -0.128 3.626 1.00 0.00 C ATOM 1538 OE1 GLN A 98 -6.939 0.355 3.702 1.00 0.00 O ATOM 1539 NE2 GLN A 98 -5.598 -1.336 3.849 1.00 0.00 N ATOM 0 H GLN A 98 -6.178 -0.405 6.489 1.00 0.00 H new ATOM 0 HA GLN A 98 -3.950 1.323 6.981 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -3.203 1.784 4.838 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -3.134 0.039 4.978 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -4.879 1.742 3.226 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -3.907 0.344 2.810 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -4.650 -1.705 3.777 1.00 0.00 H new ATOM 0 HE22 GLN A 98 -6.368 -1.955 4.104 1.00 0.00 H new ATOM 1548 N SER A 99 -5.629 3.035 5.487 1.00 0.00 N ATOM 1549 CA SER A 99 -6.730 3.870 5.125 1.00 0.00 C ATOM 1550 C SER A 99 -6.379 4.636 3.849 1.00 0.00 C ATOM 1551 O SER A 99 -5.470 5.449 3.859 1.00 0.00 O ATOM 1552 CB SER A 99 -7.091 4.820 6.266 1.00 0.00 C ATOM 1553 OG SER A 99 -7.401 4.084 7.450 1.00 0.00 O ATOM 0 H SER A 99 -4.712 3.420 5.261 1.00 0.00 H new ATOM 0 HA SER A 99 -7.607 3.252 4.935 1.00 0.00 H new ATOM 0 HB2 SER A 99 -6.260 5.498 6.459 1.00 0.00 H new ATOM 0 HB3 SER A 99 -7.944 5.435 5.979 1.00 0.00 H new ATOM 0 HG SER A 99 -7.629 4.706 8.172 1.00 0.00 H new ATOM 1559 N PHE A 100 -7.061 4.339 2.752 1.00 0.00 N ATOM 1560 CA PHE A 100 -6.777 5.006 1.479 1.00 0.00 C ATOM 1561 C PHE A 100 -7.230 6.473 1.444 1.00 0.00 C ATOM 1562 O PHE A 100 -6.407 7.369 1.297 1.00 0.00 O ATOM 1563 CB PHE A 100 -7.356 4.230 0.283 1.00 0.00 C ATOM 1564 CG PHE A 100 -6.654 2.926 -0.017 1.00 0.00 C ATOM 1565 CD1 PHE A 100 -5.514 2.910 -0.805 1.00 0.00 C ATOM 1566 CD2 PHE A 100 -7.137 1.723 0.470 1.00 0.00 C ATOM 1567 CE1 PHE A 100 -4.871 1.724 -1.099 1.00 0.00 C ATOM 1568 CE2 PHE A 100 -6.499 0.533 0.181 1.00 0.00 C ATOM 1569 CZ PHE A 100 -5.363 0.534 -0.605 1.00 0.00 C ATOM 0 H PHE A 100 -7.810 3.647 2.712 1.00 0.00 H new ATOM 0 HA PHE A 100 -5.690 5.011 1.392 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -8.409 4.025 0.475 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -7.310 4.865 -0.602 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -5.123 3.838 -1.195 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -8.025 1.715 1.084 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -3.984 1.728 -1.715 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -6.888 -0.397 0.569 1.00 0.00 H new ATOM 0 HZ PHE A 100 -4.861 -0.395 -0.832 1.00 0.00 H new ATOM 1579 N PHE A 101 -8.522 6.716 1.606 1.00 0.00 N ATOM 1580 CA PHE A 101 -9.071 8.071 1.490 1.00 0.00 C ATOM 1581 C PHE A 101 -10.438 8.085 2.194 1.00 0.00 C ATOM 1582 O PHE A 101 -10.881 7.024 2.668 1.00 0.00 O ATOM 1583 CB PHE A 101 -9.221 8.397 -0.028 1.00 0.00 C ATOM 1584 CG PHE A 101 -9.428 9.850 -0.385 1.00 0.00 C ATOM 1585 CD1 PHE A 101 -8.361 10.732 -0.368 1.00 0.00 C ATOM 1586 CD2 PHE A 101 -10.673 10.324 -0.761 1.00 0.00 C ATOM 1587 CE1 PHE A 101 -8.531 12.060 -0.714 1.00 0.00 C ATOM 1588 CE2 PHE A 101 -10.850 11.652 -1.103 1.00 0.00 C ATOM 1589 CZ PHE A 101 -9.778 12.519 -1.080 1.00 0.00 C ATOM 0 H PHE A 101 -9.214 5.998 1.818 1.00 0.00 H new ATOM 0 HA PHE A 101 -8.425 8.818 1.952 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -8.329 8.042 -0.544 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -10.063 7.826 -0.419 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -7.382 10.378 -0.080 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -11.516 9.649 -0.788 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -7.689 12.736 -0.697 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -11.828 12.010 -1.388 1.00 0.00 H new ATOM 0 HZ PHE A 101 -9.915 13.556 -1.348 1.00 0.00 H new ATOM 1599 N GLN A 102 -11.070 9.253 2.302 1.00 0.00 N ATOM 1600 CA GLN A 102 -12.403 9.395 2.880 1.00 0.00 C ATOM 1601 C GLN A 102 -13.336 10.201 1.982 1.00 0.00 C ATOM 1602 O GLN A 102 -12.937 11.205 1.388 1.00 0.00 O ATOM 1603 CB GLN A 102 -12.355 9.985 4.277 1.00 0.00 C ATOM 1604 CG GLN A 102 -12.022 8.966 5.343 1.00 0.00 C ATOM 1605 CD GLN A 102 -11.948 9.534 6.744 1.00 0.00 C ATOM 1606 OE1 GLN A 102 -11.197 9.041 7.583 1.00 0.00 O ATOM 1607 NE2 GLN A 102 -12.726 10.551 7.024 1.00 0.00 N ATOM 0 H GLN A 102 -10.666 10.135 1.987 1.00 0.00 H new ATOM 0 HA GLN A 102 -12.812 8.388 2.959 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -11.613 10.783 4.302 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -13.319 10.439 4.506 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -12.773 8.177 5.322 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -11.066 8.502 5.100 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -13.338 10.938 6.306 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -12.719 10.956 7.960 1.00 0.00 H new ATOM 1616 N ILE A 103 -14.575 9.755 1.895 1.00 0.00 N ATOM 1617 CA ILE A 103 -15.604 10.355 1.021 1.00 0.00 C ATOM 1618 C ILE A 103 -16.948 10.418 1.783 1.00 0.00 C ATOM 1619 O ILE A 103 -17.082 9.835 2.852 1.00 0.00 O ATOM 1620 CB ILE A 103 -15.795 9.517 -0.309 1.00 0.00 C ATOM 1621 CG1 ILE A 103 -16.309 8.117 0.038 1.00 0.00 C ATOM 1622 CG2 ILE A 103 -14.480 9.430 -1.084 1.00 0.00 C ATOM 1623 CD1 ILE A 103 -16.620 7.272 -1.157 1.00 0.00 C ATOM 0 H ILE A 103 -14.914 8.956 2.430 1.00 0.00 H new ATOM 0 HA ILE A 103 -15.275 11.357 0.747 1.00 0.00 H new ATOM 0 HB ILE A 103 -16.526 10.018 -0.943 1.00 0.00 H new ATOM 0 HG12 ILE A 103 -15.562 7.607 0.647 1.00 0.00 H new ATOM 0 HG13 ILE A 103 -17.207 8.211 0.648 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -14.632 8.850 -1.994 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -14.144 10.434 -1.345 1.00 0.00 H new ATOM 0 HG23 ILE A 103 -13.725 8.944 -0.466 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -16.978 6.296 -0.829 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -17.390 7.759 -1.756 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -15.719 7.145 -1.757 1.00 0.00 H new ATOM 1635 N ASP A 104 -17.914 11.123 1.262 1.00 0.00 N ATOM 1636 CA ASP A 104 -19.216 11.199 1.895 1.00 0.00 C ATOM 1637 C ASP A 104 -20.089 10.027 1.525 1.00 0.00 C ATOM 1638 O ASP A 104 -20.564 9.916 0.382 1.00 0.00 O ATOM 1639 CB ASP A 104 -19.954 12.501 1.555 1.00 0.00 C ATOM 1640 CG ASP A 104 -19.685 13.648 2.509 1.00 0.00 C ATOM 1641 OD1 ASP A 104 -19.362 13.410 3.695 1.00 0.00 O ATOM 1642 OD2 ASP A 104 -19.853 14.819 2.100 1.00 0.00 O ATOM 0 H ASP A 104 -17.831 11.658 0.397 1.00 0.00 H new ATOM 0 HA ASP A 104 -19.024 11.177 2.968 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -19.673 12.810 0.548 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -21.026 12.302 1.540 1.00 0.00 H new ATOM 1647 N LEU A 105 -20.350 9.166 2.479 1.00 0.00 N ATOM 1648 CA LEU A 105 -21.230 8.050 2.242 1.00 0.00 C ATOM 1649 C LEU A 105 -22.621 8.545 2.051 1.00 0.00 C ATOM 1650 O LEU A 105 -23.390 7.953 1.328 1.00 0.00 O ATOM 1651 CB LEU A 105 -21.239 7.016 3.358 1.00 0.00 C ATOM 1652 CG LEU A 105 -19.999 6.178 3.569 1.00 0.00 C ATOM 1653 CD1 LEU A 105 -20.394 4.898 4.273 1.00 0.00 C ATOM 1654 CD2 LEU A 105 -19.315 5.883 2.256 1.00 0.00 C ATOM 0 H LEU A 105 -19.967 9.217 3.423 1.00 0.00 H new ATOM 0 HA LEU A 105 -20.848 7.554 1.350 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -21.451 7.537 4.292 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -22.072 6.337 3.175 1.00 0.00 H new ATOM 0 HG LEU A 105 -19.288 6.729 4.185 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -19.509 4.282 4.432 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -20.848 5.137 5.235 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -21.110 4.352 3.660 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -18.426 5.279 2.437 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -19.998 5.338 1.604 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -19.027 6.819 1.778 1.00 0.00 H new ATOM 1666 N GLU A 106 -22.938 9.637 2.694 1.00 0.00 N ATOM 1667 CA GLU A 106 -24.229 10.267 2.539 1.00 0.00 C ATOM 1668 C GLU A 106 -24.441 10.724 1.088 1.00 0.00 C ATOM 1669 O GLU A 106 -25.563 10.866 0.639 1.00 0.00 O ATOM 1670 CB GLU A 106 -24.365 11.448 3.486 1.00 0.00 C ATOM 1671 CG GLU A 106 -23.247 12.458 3.351 1.00 0.00 C ATOM 1672 CD GLU A 106 -23.496 13.695 4.140 1.00 0.00 C ATOM 1673 OE1 GLU A 106 -23.118 13.747 5.311 1.00 0.00 O ATOM 1674 OE2 GLU A 106 -24.073 14.654 3.584 1.00 0.00 O ATOM 0 H GLU A 106 -22.312 10.117 3.340 1.00 0.00 H new ATOM 0 HA GLU A 106 -24.995 9.532 2.786 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -25.318 11.945 3.301 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -24.391 11.081 4.512 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -22.311 12.005 3.678 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -23.124 12.720 2.300 1.00 0.00 H new ATOM 1681 N ARG A 107 -23.351 10.951 0.367 1.00 0.00 N ATOM 1682 CA ARG A 107 -23.449 11.360 -1.007 1.00 0.00 C ATOM 1683 C ARG A 107 -23.452 10.110 -1.907 1.00 0.00 C ATOM 1684 O ARG A 107 -23.835 10.169 -3.073 1.00 0.00 O ATOM 1685 CB ARG A 107 -22.333 12.373 -1.361 1.00 0.00 C ATOM 1686 CG ARG A 107 -21.101 11.808 -2.023 1.00 0.00 C ATOM 1687 CD ARG A 107 -20.027 12.875 -2.236 1.00 0.00 C ATOM 1688 NE ARG A 107 -20.515 14.052 -2.954 1.00 0.00 N ATOM 1689 CZ ARG A 107 -19.742 15.031 -3.456 1.00 0.00 C ATOM 1690 NH1 ARG A 107 -18.417 14.984 -3.315 1.00 0.00 N ATOM 1691 NH2 ARG A 107 -20.303 16.060 -4.084 1.00 0.00 N ATOM 0 H ARG A 107 -22.398 10.856 0.718 1.00 0.00 H new ATOM 0 HA ARG A 107 -24.388 11.887 -1.178 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -22.757 13.132 -2.018 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -22.027 12.879 -0.445 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -20.696 11.003 -1.409 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -21.373 11.371 -2.983 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -19.636 13.185 -1.267 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -19.196 12.439 -2.790 1.00 0.00 H new ATOM 0 HE ARG A 107 -21.523 14.137 -3.084 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -17.984 14.202 -2.824 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -17.837 15.730 -3.698 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -21.317 16.105 -4.184 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -19.719 16.804 -4.466 1.00 0.00 H new ATOM 1705 N LEU A 108 -23.022 8.971 -1.332 1.00 0.00 N ATOM 1706 CA LEU A 108 -23.090 7.660 -2.018 1.00 0.00 C ATOM 1707 C LEU A 108 -24.500 7.269 -2.387 1.00 0.00 C ATOM 1708 O LEU A 108 -25.464 7.677 -1.735 1.00 0.00 O ATOM 1709 CB LEU A 108 -22.484 6.498 -1.200 1.00 0.00 C ATOM 1710 CG LEU A 108 -21.109 6.084 -1.614 1.00 0.00 C ATOM 1711 CD1 LEU A 108 -20.084 7.049 -1.205 1.00 0.00 C ATOM 1712 CD2 LEU A 108 -20.739 4.719 -1.166 1.00 0.00 C ATOM 0 H LEU A 108 -22.623 8.929 -0.394 1.00 0.00 H new ATOM 0 HA LEU A 108 -22.493 7.812 -2.918 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -22.459 6.787 -0.149 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -23.146 5.635 -1.277 1.00 0.00 H new ATOM 0 HG LEU A 108 -21.145 6.065 -2.703 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -19.104 6.699 -1.531 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -20.293 8.017 -1.660 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -20.091 7.149 -0.120 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -19.729 4.487 -1.503 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -20.779 4.670 -0.078 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -21.437 3.996 -1.588 1.00 0.00 H new ATOM 1724 N GLU A 109 -24.607 6.448 -3.409 1.00 0.00 N ATOM 1725 CA GLU A 109 -25.889 5.956 -3.865 1.00 0.00 C ATOM 1726 C GLU A 109 -26.337 4.769 -3.010 1.00 0.00 C ATOM 1727 O GLU A 109 -25.934 3.630 -3.264 1.00 0.00 O ATOM 1728 CB GLU A 109 -25.835 5.556 -5.335 1.00 0.00 C ATOM 1729 CG GLU A 109 -25.447 6.676 -6.283 1.00 0.00 C ATOM 1730 CD GLU A 109 -25.445 6.218 -7.718 1.00 0.00 C ATOM 1731 OE1 GLU A 109 -24.437 5.626 -8.164 1.00 0.00 O ATOM 1732 OE2 GLU A 109 -26.450 6.405 -8.413 1.00 0.00 O ATOM 0 H GLU A 109 -23.811 6.104 -3.946 1.00 0.00 H new ATOM 0 HA GLU A 109 -26.615 6.762 -3.761 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -25.123 4.739 -5.449 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -26.812 5.171 -5.629 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -26.143 7.507 -6.168 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -24.458 7.049 -6.019 1.00 0.00 H new ATOM 1739 N SER A 110 -27.079 5.093 -1.959 1.00 0.00 N ATOM 1740 CA SER A 110 -27.687 4.177 -0.981 1.00 0.00 C ATOM 1741 C SER A 110 -26.896 2.876 -0.682 1.00 0.00 C ATOM 1742 O SER A 110 -26.048 2.845 0.208 1.00 0.00 O ATOM 1743 CB SER A 110 -29.171 3.891 -1.309 1.00 0.00 C ATOM 1744 OG SER A 110 -29.786 3.098 -0.297 1.00 0.00 O ATOM 0 H SER A 110 -27.291 6.068 -1.746 1.00 0.00 H new ATOM 0 HA SER A 110 -27.637 4.728 -0.042 1.00 0.00 H new ATOM 0 HB2 SER A 110 -29.710 4.833 -1.412 1.00 0.00 H new ATOM 0 HB3 SER A 110 -29.240 3.377 -2.268 1.00 0.00 H new ATOM 0 HG SER A 110 -30.723 2.936 -0.533 1.00 0.00 H new ATOM 1750 N HIS A 111 -27.123 1.836 -1.474 1.00 0.00 N ATOM 1751 CA HIS A 111 -26.574 0.518 -1.178 1.00 0.00 C ATOM 1752 C HIS A 111 -25.076 0.432 -1.396 1.00 0.00 C ATOM 1753 O HIS A 111 -24.441 -0.444 -0.842 1.00 0.00 O ATOM 1754 CB HIS A 111 -27.315 -0.611 -1.929 1.00 0.00 C ATOM 1755 CG HIS A 111 -27.050 -0.681 -3.416 1.00 0.00 C ATOM 1756 ND1 HIS A 111 -26.478 -1.769 -4.033 1.00 0.00 N ATOM 1757 CD2 HIS A 111 -27.292 0.221 -4.400 1.00 0.00 C ATOM 1758 CE1 HIS A 111 -26.383 -1.507 -5.333 1.00 0.00 C ATOM 1759 NE2 HIS A 111 -26.866 -0.307 -5.615 1.00 0.00 N ATOM 0 H HIS A 111 -27.683 1.879 -2.326 1.00 0.00 H new ATOM 0 HA HIS A 111 -26.743 0.369 -0.112 1.00 0.00 H new ATOM 0 HB2 HIS A 111 -27.037 -1.565 -1.482 1.00 0.00 H new ATOM 0 HB3 HIS A 111 -28.387 -0.486 -1.773 1.00 0.00 H new ATOM 0 HD2 HIS A 111 -27.743 1.193 -4.262 1.00 0.00 H new ATOM 0 HE1 HIS A 111 -25.966 -2.185 -6.064 1.00 0.00 H new ATOM 0 HE2 HIS A 111 -26.916 0.138 -6.532 1.00 0.00 H new ATOM 1767 N MET A 112 -24.518 1.350 -2.176 1.00 0.00 N ATOM 1768 CA MET A 112 -23.071 1.366 -2.429 1.00 0.00 C ATOM 1769 C MET A 112 -22.304 1.372 -1.116 1.00 0.00 C ATOM 1770 O MET A 112 -21.502 0.482 -0.844 1.00 0.00 O ATOM 1771 CB MET A 112 -22.671 2.582 -3.276 1.00 0.00 C ATOM 1772 CG MET A 112 -22.947 2.447 -4.758 1.00 0.00 C ATOM 1773 SD MET A 112 -21.940 1.154 -5.514 1.00 0.00 S ATOM 1774 CE MET A 112 -20.275 1.740 -5.151 1.00 0.00 C ATOM 0 H MET A 112 -25.037 2.092 -2.645 1.00 0.00 H new ATOM 0 HA MET A 112 -22.818 0.463 -2.985 1.00 0.00 H new ATOM 0 HB2 MET A 112 -23.201 3.457 -2.901 1.00 0.00 H new ATOM 0 HB3 MET A 112 -21.607 2.770 -3.135 1.00 0.00 H new ATOM 0 HG2 MET A 112 -24.002 2.222 -4.912 1.00 0.00 H new ATOM 0 HG3 MET A 112 -22.748 3.398 -5.253 1.00 0.00 H new ATOM 0 HE1 MET A 112 -19.624 1.536 -6.001 1.00 0.00 H new ATOM 0 HE2 MET A 112 -20.300 2.813 -4.963 1.00 0.00 H new ATOM 0 HE3 MET A 112 -19.892 1.226 -4.269 1.00 0.00 H new ATOM 1784 N GLN A 113 -22.618 2.343 -0.283 1.00 0.00 N ATOM 1785 CA GLN A 113 -21.981 2.474 1.029 1.00 0.00 C ATOM 1786 C GLN A 113 -22.300 1.301 1.905 1.00 0.00 C ATOM 1787 O GLN A 113 -21.429 0.757 2.539 1.00 0.00 O ATOM 1788 CB GLN A 113 -22.383 3.758 1.745 1.00 0.00 C ATOM 1789 CG GLN A 113 -23.681 4.297 1.329 1.00 0.00 C ATOM 1790 CD GLN A 113 -24.510 4.736 2.475 1.00 0.00 C ATOM 1791 OE1 GLN A 113 -25.250 3.954 3.063 1.00 0.00 O ATOM 1792 NE2 GLN A 113 -24.452 5.975 2.763 1.00 0.00 N ATOM 0 H GLN A 113 -23.314 3.061 -0.485 1.00 0.00 H new ATOM 0 HA GLN A 113 -20.908 2.509 0.842 1.00 0.00 H new ATOM 0 HB2 GLN A 113 -22.408 3.570 2.818 1.00 0.00 H new ATOM 0 HB3 GLN A 113 -21.616 4.513 1.571 1.00 0.00 H new ATOM 0 HG2 GLN A 113 -23.521 5.140 0.657 1.00 0.00 H new ATOM 0 HG3 GLN A 113 -24.222 3.537 0.764 1.00 0.00 H new ATOM 0 HE21 GLN A 113 -23.822 6.589 2.248 1.00 0.00 H new ATOM 0 HE22 GLN A 113 -25.036 6.353 3.509 1.00 0.00 H new ATOM 1801 N LYS A 114 -23.557 0.895 1.894 1.00 0.00 N ATOM 1802 CA LYS A 114 -24.045 -0.220 2.706 1.00 0.00 C ATOM 1803 C LYS A 114 -23.281 -1.512 2.390 1.00 0.00 C ATOM 1804 O LYS A 114 -23.034 -2.334 3.265 1.00 0.00 O ATOM 1805 CB LYS A 114 -25.524 -0.438 2.433 1.00 0.00 C ATOM 1806 CG LYS A 114 -26.415 0.771 2.694 1.00 0.00 C ATOM 1807 CD LYS A 114 -26.582 1.092 4.176 1.00 0.00 C ATOM 1808 CE LYS A 114 -27.313 -0.020 4.908 1.00 0.00 C ATOM 1809 NZ LYS A 114 -27.571 0.319 6.320 1.00 0.00 N ATOM 0 H LYS A 114 -24.279 1.329 1.319 1.00 0.00 H new ATOM 0 HA LYS A 114 -23.887 0.030 3.755 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -25.645 -0.741 1.393 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -25.873 -1.267 3.049 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -25.994 1.639 2.187 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -27.397 0.591 2.256 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -25.602 1.244 4.629 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -27.133 2.026 4.287 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -28.259 -0.223 4.406 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -26.723 -0.935 4.858 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -28.071 -0.468 6.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -26.668 0.487 6.807 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -28.156 1.177 6.370 1.00 0.00 H new ATOM 1823 N ASN A 115 -22.922 -1.681 1.142 1.00 0.00 N ATOM 1824 CA ASN A 115 -22.179 -2.851 0.688 1.00 0.00 C ATOM 1825 C ASN A 115 -20.759 -2.797 1.166 1.00 0.00 C ATOM 1826 O ASN A 115 -20.159 -3.818 1.494 1.00 0.00 O ATOM 1827 CB ASN A 115 -22.261 -2.986 -0.836 1.00 0.00 C ATOM 1828 CG ASN A 115 -23.605 -3.534 -1.287 1.00 0.00 C ATOM 1829 OD1 ASN A 115 -24.593 -3.489 -0.539 1.00 0.00 O ATOM 1830 ND2 ASN A 115 -23.676 -3.999 -2.510 1.00 0.00 N ATOM 0 H ASN A 115 -23.134 -1.013 0.401 1.00 0.00 H new ATOM 0 HA ASN A 115 -22.635 -3.741 1.121 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -22.094 -2.012 -1.296 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -21.465 -3.644 -1.185 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -24.565 -4.339 -2.875 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -22.842 -4.021 -3.097 1.00 0.00 H new ATOM 1837 N LEU A 116 -20.244 -1.610 1.247 1.00 0.00 N ATOM 1838 CA LEU A 116 -18.911 -1.377 1.746 1.00 0.00 C ATOM 1839 C LEU A 116 -18.890 -1.512 3.283 1.00 0.00 C ATOM 1840 O LEU A 116 -17.872 -1.855 3.867 1.00 0.00 O ATOM 1841 CB LEU A 116 -18.471 0.003 1.325 1.00 0.00 C ATOM 1842 CG LEU A 116 -18.511 0.289 -0.179 1.00 0.00 C ATOM 1843 CD1 LEU A 116 -18.351 1.760 -0.440 1.00 0.00 C ATOM 1844 CD2 LEU A 116 -17.429 -0.494 -0.902 1.00 0.00 C ATOM 0 H LEU A 116 -20.737 -0.762 0.967 1.00 0.00 H new ATOM 0 HA LEU A 116 -18.224 -2.116 1.334 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -19.101 0.734 1.831 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -17.452 0.162 1.678 1.00 0.00 H new ATOM 0 HG LEU A 116 -19.481 -0.029 -0.561 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -18.382 1.944 -1.514 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -19.160 2.306 0.045 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -17.395 2.098 -0.041 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -17.474 -0.277 -1.969 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -16.452 -0.207 -0.514 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -17.584 -1.561 -0.742 1.00 0.00 H new ATOM 1856 N LEU A 117 -20.034 -1.225 3.913 1.00 0.00 N ATOM 1857 CA LEU A 117 -20.223 -1.399 5.365 1.00 0.00 C ATOM 1858 C LEU A 117 -20.164 -2.875 5.732 1.00 0.00 C ATOM 1859 O LEU A 117 -19.730 -3.236 6.819 1.00 0.00 O ATOM 1860 CB LEU A 117 -21.585 -0.861 5.828 1.00 0.00 C ATOM 1861 CG LEU A 117 -21.938 0.580 5.487 1.00 0.00 C ATOM 1862 CD1 LEU A 117 -23.275 0.943 6.078 1.00 0.00 C ATOM 1863 CD2 LEU A 117 -20.883 1.538 5.965 1.00 0.00 C ATOM 0 H LEU A 117 -20.859 -0.865 3.433 1.00 0.00 H new ATOM 0 HA LEU A 117 -19.424 -0.843 5.856 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -22.358 -1.503 5.406 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -21.636 -0.970 6.911 1.00 0.00 H new ATOM 0 HG LEU A 117 -21.992 0.659 4.401 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -23.515 1.976 5.827 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -24.043 0.283 5.674 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -23.236 0.833 7.162 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -21.171 2.556 5.703 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -20.781 1.457 7.047 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -19.931 1.297 5.492 1.00 0.00 H new ATOM 1875 N LYS A 118 -20.690 -3.725 4.849 1.00 0.00 N ATOM 1876 CA LYS A 118 -20.612 -5.160 5.034 1.00 0.00 C ATOM 1877 C LYS A 118 -19.201 -5.602 4.789 1.00 0.00 C ATOM 1878 O LYS A 118 -18.704 -6.539 5.396 1.00 0.00 O ATOM 1879 CB LYS A 118 -21.419 -5.843 3.968 1.00 0.00 C ATOM 1880 CG LYS A 118 -22.850 -5.453 3.867 1.00 0.00 C ATOM 1881 CD LYS A 118 -23.392 -5.987 2.567 1.00 0.00 C ATOM 1882 CE LYS A 118 -24.864 -5.731 2.362 1.00 0.00 C ATOM 1883 NZ LYS A 118 -25.198 -4.311 2.133 1.00 0.00 N ATOM 0 H LYS A 118 -21.174 -3.436 3.999 1.00 0.00 H new ATOM 0 HA LYS A 118 -20.963 -5.401 6.037 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -20.944 -5.651 3.006 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -21.370 -6.918 4.139 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -23.414 -5.856 4.708 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -22.952 -4.368 3.905 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -22.838 -5.538 1.743 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -23.212 -7.061 2.524 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -25.210 -6.317 1.511 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -25.410 -6.086 3.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -26.213 -4.161 2.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -24.647 -3.715 2.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -24.970 -4.055 1.151 1.00 0.00 H new ATOM 1897 N GLY A 119 -18.583 -4.919 3.872 1.00 0.00 N ATOM 1898 CA GLY A 119 -17.325 -5.307 3.390 1.00 0.00 C ATOM 1899 C GLY A 119 -17.563 -6.219 2.235 1.00 0.00 C ATOM 1900 O GLY A 119 -18.420 -7.112 2.314 1.00 0.00 O ATOM 0 H GLY A 119 -18.956 -4.071 3.444 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -16.745 -4.437 3.081 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -16.753 -5.812 4.168 1.00 0.00 H new ATOM 1904 N ILE A 120 -16.920 -5.967 1.143 1.00 0.00 N ATOM 1905 CA ILE A 120 -17.133 -6.794 -0.030 1.00 0.00 C ATOM 1906 C ILE A 120 -16.563 -8.176 0.249 1.00 0.00 C ATOM 1907 O ILE A 120 -15.434 -8.278 0.612 1.00 0.00 O ATOM 1908 CB ILE A 120 -16.480 -6.199 -1.307 1.00 0.00 C ATOM 1909 CG1 ILE A 120 -16.776 -4.691 -1.422 1.00 0.00 C ATOM 1910 CG2 ILE A 120 -17.024 -6.924 -2.536 1.00 0.00 C ATOM 1911 CD1 ILE A 120 -18.245 -4.346 -1.352 1.00 0.00 C ATOM 0 H ILE A 120 -16.248 -5.209 1.024 1.00 0.00 H new ATOM 0 HA ILE A 120 -18.205 -6.844 -0.223 1.00 0.00 H new ATOM 0 HB ILE A 120 -15.400 -6.333 -1.243 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -16.252 -4.166 -0.623 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -16.371 -4.323 -2.365 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -16.568 -6.509 -3.435 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -16.788 -7.986 -2.466 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -18.105 -6.795 -2.585 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -18.370 -3.267 -1.440 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -18.774 -4.840 -2.167 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -18.653 -4.682 -0.398 1.00 0.00 H new ATOM 1923 N PRO A 121 -17.361 -9.240 0.103 1.00 0.00 N ATOM 1924 CA PRO A 121 -16.938 -10.608 0.442 1.00 0.00 C ATOM 1925 C PRO A 121 -16.104 -11.301 -0.653 1.00 0.00 C ATOM 1926 O PRO A 121 -15.838 -12.506 -0.580 1.00 0.00 O ATOM 1927 CB PRO A 121 -18.272 -11.320 0.637 1.00 0.00 C ATOM 1928 CG PRO A 121 -19.204 -10.626 -0.300 1.00 0.00 C ATOM 1929 CD PRO A 121 -18.757 -9.201 -0.372 1.00 0.00 C ATOM 0 HA PRO A 121 -16.276 -10.622 1.308 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -18.193 -12.382 0.405 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -18.616 -11.244 1.668 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -19.178 -11.090 -1.286 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -20.232 -10.692 0.057 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -18.822 -8.813 -1.389 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -19.374 -8.557 0.255 1.00 0.00 H new ATOM 1937 N PHE A 122 -15.695 -10.547 -1.639 1.00 0.00 N ATOM 1938 CA PHE A 122 -14.890 -11.050 -2.743 1.00 0.00 C ATOM 1939 C PHE A 122 -14.356 -9.887 -3.537 1.00 0.00 C ATOM 1940 O PHE A 122 -15.081 -8.943 -3.826 1.00 0.00 O ATOM 1941 CB PHE A 122 -15.669 -12.045 -3.667 1.00 0.00 C ATOM 1942 CG PHE A 122 -16.890 -11.484 -4.370 1.00 0.00 C ATOM 1943 CD1 PHE A 122 -18.123 -11.493 -3.751 1.00 0.00 C ATOM 1944 CD2 PHE A 122 -16.794 -10.959 -5.653 1.00 0.00 C ATOM 1945 CE1 PHE A 122 -19.239 -10.986 -4.386 1.00 0.00 C ATOM 1946 CE2 PHE A 122 -17.905 -10.453 -6.295 1.00 0.00 C ATOM 1947 CZ PHE A 122 -19.129 -10.465 -5.660 1.00 0.00 C ATOM 0 H PHE A 122 -15.909 -9.552 -1.707 1.00 0.00 H new ATOM 0 HA PHE A 122 -14.065 -11.621 -2.317 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -14.980 -12.422 -4.423 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -15.981 -12.899 -3.066 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -18.216 -11.902 -2.756 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -15.837 -10.947 -6.154 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -20.197 -10.997 -3.887 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -17.817 -10.048 -7.292 1.00 0.00 H new ATOM 0 HZ PHE A 122 -20.001 -10.067 -6.159 1.00 0.00 H new ATOM 1957 N ARG A 123 -13.099 -9.919 -3.830 1.00 0.00 N ATOM 1958 CA ARG A 123 -12.482 -8.879 -4.600 1.00 0.00 C ATOM 1959 C ARG A 123 -11.286 -9.412 -5.318 1.00 0.00 C ATOM 1960 O ARG A 123 -10.514 -10.194 -4.764 1.00 0.00 O ATOM 1961 CB ARG A 123 -12.094 -7.682 -3.707 1.00 0.00 C ATOM 1962 CG ARG A 123 -11.283 -8.080 -2.495 1.00 0.00 C ATOM 1963 CD ARG A 123 -11.065 -6.927 -1.539 1.00 0.00 C ATOM 1964 NE ARG A 123 -10.028 -5.974 -1.956 1.00 0.00 N ATOM 1965 CZ ARG A 123 -8.983 -5.634 -1.170 1.00 0.00 C ATOM 1966 NH1 ARG A 123 -8.762 -6.297 -0.039 1.00 0.00 N ATOM 1967 NH2 ARG A 123 -8.155 -4.668 -1.524 1.00 0.00 N ATOM 0 H ARG A 123 -12.465 -10.666 -3.544 1.00 0.00 H new ATOM 0 HA ARG A 123 -13.203 -8.524 -5.336 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -11.523 -6.966 -4.298 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -13.000 -7.174 -3.378 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -11.791 -8.890 -1.972 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -10.317 -8.466 -2.819 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -12.006 -6.390 -1.418 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -10.799 -7.328 -0.561 1.00 0.00 H new ATOM 0 HE ARG A 123 -10.100 -5.550 -2.881 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -9.381 -7.061 0.234 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -7.974 -6.042 0.556 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -8.300 -4.168 -2.401 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -7.370 -4.422 -0.920 1.00 0.00 H new ATOM 1981 N THR A 124 -11.173 -9.053 -6.543 1.00 0.00 N ATOM 1982 CA THR A 124 -10.026 -9.350 -7.325 1.00 0.00 C ATOM 1983 C THR A 124 -9.369 -7.993 -7.628 1.00 0.00 C ATOM 1984 O THR A 124 -9.964 -6.946 -7.307 1.00 0.00 O ATOM 1985 CB THR A 124 -10.437 -10.122 -8.617 1.00 0.00 C ATOM 1986 OG1 THR A 124 -11.344 -11.183 -8.254 1.00 0.00 O ATOM 1987 CG2 THR A 124 -9.231 -10.734 -9.313 1.00 0.00 C ATOM 0 H THR A 124 -11.892 -8.531 -7.044 1.00 0.00 H new ATOM 0 HA THR A 124 -9.322 -10.002 -6.807 1.00 0.00 H new ATOM 0 HB THR A 124 -10.907 -9.415 -9.301 1.00 0.00 H new ATOM 0 HG1 THR A 124 -12.264 -10.847 -8.271 1.00 0.00 H new ATOM 0 HG21 THR A 124 -9.557 -11.263 -10.208 1.00 0.00 H new ATOM 0 HG22 THR A 124 -8.533 -9.945 -9.592 1.00 0.00 H new ATOM 0 HG23 THR A 124 -8.737 -11.433 -8.638 1.00 0.00 H new ATOM 1995 N LYS A 125 -8.190 -7.997 -8.205 1.00 0.00 N ATOM 1996 CA LYS A 125 -7.404 -6.862 -8.465 1.00 0.00 C ATOM 1997 C LYS A 125 -8.188 -5.805 -9.239 1.00 0.00 C ATOM 1998 O LYS A 125 -8.358 -4.675 -8.776 1.00 0.00 O ATOM 1999 CB LYS A 125 -6.237 -7.411 -9.252 1.00 0.00 C ATOM 2000 CG LYS A 125 -5.053 -6.580 -9.324 1.00 0.00 C ATOM 2001 CD LYS A 125 -5.209 -5.367 -10.159 1.00 0.00 C ATOM 2002 CE LYS A 125 -5.262 -5.691 -11.630 1.00 0.00 C ATOM 2003 NZ LYS A 125 -5.095 -4.493 -12.449 1.00 0.00 N ATOM 0 H LYS A 125 -7.745 -8.860 -8.517 1.00 0.00 H new ATOM 0 HA LYS A 125 -7.081 -6.348 -7.560 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -5.954 -8.370 -8.817 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -6.576 -7.610 -10.269 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -4.773 -6.278 -8.315 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -4.229 -7.175 -9.719 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -6.121 -4.844 -9.871 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -4.378 -4.687 -9.968 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -4.481 -6.411 -11.873 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -6.216 -6.164 -11.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -5.103 -4.756 -13.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -5.874 -3.831 -12.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -4.189 -4.038 -12.217 1.00 0.00 H new ATOM 2017 N ALA A 126 -8.686 -6.204 -10.377 1.00 0.00 N ATOM 2018 CA ALA A 126 -9.437 -5.326 -11.263 1.00 0.00 C ATOM 2019 C ALA A 126 -10.706 -4.799 -10.601 1.00 0.00 C ATOM 2020 O ALA A 126 -11.155 -3.704 -10.889 1.00 0.00 O ATOM 2021 CB ALA A 126 -9.784 -6.064 -12.530 1.00 0.00 C ATOM 0 H ALA A 126 -8.586 -7.156 -10.729 1.00 0.00 H new ATOM 0 HA ALA A 126 -8.808 -4.466 -11.495 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -10.346 -5.406 -13.192 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -8.868 -6.383 -13.028 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -10.389 -6.938 -12.288 1.00 0.00 H new ATOM 2027 N GLU A 127 -11.245 -5.561 -9.681 1.00 0.00 N ATOM 2028 CA GLU A 127 -12.488 -5.189 -9.034 1.00 0.00 C ATOM 2029 C GLU A 127 -12.218 -4.169 -7.956 1.00 0.00 C ATOM 2030 O GLU A 127 -13.038 -3.310 -7.688 1.00 0.00 O ATOM 2031 CB GLU A 127 -13.150 -6.407 -8.447 1.00 0.00 C ATOM 2032 CG GLU A 127 -12.984 -7.617 -9.320 1.00 0.00 C ATOM 2033 CD GLU A 127 -13.914 -8.727 -8.957 1.00 0.00 C ATOM 2034 OE1 GLU A 127 -15.070 -8.715 -9.419 1.00 0.00 O ATOM 2035 OE2 GLU A 127 -13.499 -9.633 -8.218 1.00 0.00 O ATOM 0 H GLU A 127 -10.846 -6.443 -9.361 1.00 0.00 H new ATOM 0 HA GLU A 127 -13.158 -4.751 -9.774 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -12.727 -6.610 -7.463 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -14.212 -6.208 -8.303 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -13.151 -7.335 -10.359 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -11.956 -7.973 -9.248 1.00 0.00 H new ATOM 2042 N PHE A 128 -11.050 -4.271 -7.354 1.00 0.00 N ATOM 2043 CA PHE A 128 -10.605 -3.330 -6.354 1.00 0.00 C ATOM 2044 C PHE A 128 -10.475 -1.946 -6.957 1.00 0.00 C ATOM 2045 O PHE A 128 -11.038 -0.993 -6.448 1.00 0.00 O ATOM 2046 CB PHE A 128 -9.270 -3.786 -5.762 1.00 0.00 C ATOM 2047 CG PHE A 128 -8.550 -2.718 -4.986 1.00 0.00 C ATOM 2048 CD1 PHE A 128 -8.860 -2.468 -3.671 1.00 0.00 C ATOM 2049 CD2 PHE A 128 -7.554 -1.966 -5.595 1.00 0.00 C ATOM 2050 CE1 PHE A 128 -8.194 -1.487 -2.960 1.00 0.00 C ATOM 2051 CE2 PHE A 128 -6.882 -0.983 -4.896 1.00 0.00 C ATOM 2052 CZ PHE A 128 -7.202 -0.742 -3.574 1.00 0.00 C ATOM 0 H PHE A 128 -10.381 -5.016 -7.549 1.00 0.00 H new ATOM 0 HA PHE A 128 -11.344 -3.288 -5.554 1.00 0.00 H new ATOM 0 HB2 PHE A 128 -9.447 -4.640 -5.108 1.00 0.00 H new ATOM 0 HB3 PHE A 128 -8.625 -4.132 -6.570 1.00 0.00 H new ATOM 0 HD1 PHE A 128 -9.634 -3.045 -3.187 1.00 0.00 H new ATOM 0 HD2 PHE A 128 -7.302 -2.152 -6.628 1.00 0.00 H new ATOM 0 HE1 PHE A 128 -8.447 -1.302 -1.927 1.00 0.00 H new ATOM 0 HE2 PHE A 128 -6.109 -0.405 -5.381 1.00 0.00 H new ATOM 0 HZ PHE A 128 -6.680 0.025 -3.021 1.00 0.00 H new ATOM 2062 N GLU A 129 -9.746 -1.849 -8.043 1.00 0.00 N ATOM 2063 CA GLU A 129 -9.567 -0.580 -8.703 1.00 0.00 C ATOM 2064 C GLU A 129 -10.886 -0.077 -9.292 1.00 0.00 C ATOM 2065 O GLU A 129 -11.090 1.116 -9.418 1.00 0.00 O ATOM 2066 CB GLU A 129 -8.445 -0.653 -9.738 1.00 0.00 C ATOM 2067 CG GLU A 129 -8.537 -1.855 -10.641 1.00 0.00 C ATOM 2068 CD GLU A 129 -7.476 -1.885 -11.694 1.00 0.00 C ATOM 2069 OE1 GLU A 129 -7.704 -1.344 -12.790 1.00 0.00 O ATOM 2070 OE2 GLU A 129 -6.406 -2.459 -11.459 1.00 0.00 O ATOM 0 H GLU A 129 -9.268 -2.633 -8.487 1.00 0.00 H new ATOM 0 HA GLU A 129 -9.257 0.156 -7.961 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -8.464 0.251 -10.347 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -7.485 -0.669 -9.221 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -8.467 -2.760 -10.038 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -9.516 -1.867 -11.121 1.00 0.00 H new ATOM 2077 N ASP A 130 -11.792 -1.004 -9.572 1.00 0.00 N ATOM 2078 CA ASP A 130 -13.133 -0.686 -10.083 1.00 0.00 C ATOM 2079 C ASP A 130 -13.961 -0.012 -9.014 1.00 0.00 C ATOM 2080 O ASP A 130 -14.584 1.021 -9.242 1.00 0.00 O ATOM 2081 CB ASP A 130 -13.845 -1.958 -10.526 1.00 0.00 C ATOM 2082 CG ASP A 130 -15.279 -1.724 -10.953 1.00 0.00 C ATOM 2083 OD1 ASP A 130 -15.513 -1.156 -12.037 1.00 0.00 O ATOM 2084 OD2 ASP A 130 -16.199 -2.086 -10.201 1.00 0.00 O ATOM 0 H ASP A 130 -11.624 -2.003 -9.453 1.00 0.00 H new ATOM 0 HA ASP A 130 -13.018 -0.013 -10.933 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -13.295 -2.404 -11.354 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -13.830 -2.678 -9.708 1.00 0.00 H new ATOM 2089 N VAL A 131 -13.980 -0.593 -7.856 1.00 0.00 N ATOM 2090 CA VAL A 131 -14.725 -0.014 -6.758 1.00 0.00 C ATOM 2091 C VAL A 131 -14.020 1.254 -6.244 1.00 0.00 C ATOM 2092 O VAL A 131 -14.662 2.267 -5.957 1.00 0.00 O ATOM 2093 CB VAL A 131 -15.010 -1.054 -5.616 1.00 0.00 C ATOM 2094 CG1 VAL A 131 -13.744 -1.672 -5.087 1.00 0.00 C ATOM 2095 CG2 VAL A 131 -15.799 -0.437 -4.481 1.00 0.00 C ATOM 0 H VAL A 131 -13.495 -1.463 -7.637 1.00 0.00 H new ATOM 0 HA VAL A 131 -15.705 0.281 -7.133 1.00 0.00 H new ATOM 0 HB VAL A 131 -15.612 -1.844 -6.065 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -13.989 -2.385 -4.299 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -13.226 -2.188 -5.895 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -13.099 -0.891 -4.683 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -15.976 -1.188 -3.711 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -15.236 0.393 -4.056 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -16.754 -0.072 -4.858 1.00 0.00 H new ATOM 2105 N ILE A 132 -12.702 1.215 -6.215 1.00 0.00 N ATOM 2106 CA ILE A 132 -11.893 2.336 -5.778 1.00 0.00 C ATOM 2107 C ILE A 132 -12.021 3.546 -6.704 1.00 0.00 C ATOM 2108 O ILE A 132 -12.083 4.686 -6.228 1.00 0.00 O ATOM 2109 CB ILE A 132 -10.402 1.917 -5.515 1.00 0.00 C ATOM 2110 CG1 ILE A 132 -10.177 1.607 -4.019 1.00 0.00 C ATOM 2111 CG2 ILE A 132 -9.386 2.932 -6.029 1.00 0.00 C ATOM 2112 CD1 ILE A 132 -11.080 0.531 -3.451 1.00 0.00 C ATOM 0 H ILE A 132 -12.159 0.399 -6.496 1.00 0.00 H new ATOM 0 HA ILE A 132 -12.293 2.659 -4.817 1.00 0.00 H new ATOM 0 HB ILE A 132 -10.231 1.008 -6.092 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -9.140 1.303 -3.877 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -10.322 2.523 -3.447 1.00 0.00 H new ATOM 0 HG21 ILE A 132 -8.378 2.578 -5.814 1.00 0.00 H new ATOM 0 HG22 ILE A 132 -9.506 3.054 -7.106 1.00 0.00 H new ATOM 0 HG23 ILE A 132 -9.548 3.890 -5.536 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -10.849 0.382 -2.396 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -12.121 0.837 -3.555 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -10.920 -0.401 -3.992 1.00 0.00 H new ATOM 2124 N GLU A 133 -12.117 3.311 -8.011 1.00 0.00 N ATOM 2125 CA GLU A 133 -12.277 4.409 -8.950 1.00 0.00 C ATOM 2126 C GLU A 133 -13.646 5.065 -8.759 1.00 0.00 C ATOM 2127 O GLU A 133 -13.826 6.247 -9.034 1.00 0.00 O ATOM 2128 CB GLU A 133 -12.104 3.968 -10.408 1.00 0.00 C ATOM 2129 CG GLU A 133 -13.192 3.076 -10.909 1.00 0.00 C ATOM 2130 CD GLU A 133 -13.075 2.769 -12.359 1.00 0.00 C ATOM 2131 OE1 GLU A 133 -13.421 3.635 -13.192 1.00 0.00 O ATOM 2132 OE2 GLU A 133 -12.664 1.663 -12.704 1.00 0.00 O ATOM 0 H GLU A 133 -12.087 2.384 -8.435 1.00 0.00 H new ATOM 0 HA GLU A 133 -11.488 5.131 -8.738 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -12.055 4.854 -11.041 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -11.150 3.451 -10.509 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -13.178 2.144 -10.344 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -14.156 3.548 -10.721 1.00 0.00 H new ATOM 2139 N HIS A 134 -14.595 4.294 -8.258 1.00 0.00 N ATOM 2140 CA HIS A 134 -15.923 4.800 -8.020 1.00 0.00 C ATOM 2141 C HIS A 134 -15.920 5.581 -6.699 1.00 0.00 C ATOM 2142 O HIS A 134 -16.576 6.587 -6.563 1.00 0.00 O ATOM 2143 CB HIS A 134 -16.936 3.646 -7.996 1.00 0.00 C ATOM 2144 CG HIS A 134 -18.367 4.073 -8.159 1.00 0.00 C ATOM 2145 ND1 HIS A 134 -19.022 4.088 -9.371 1.00 0.00 N ATOM 2146 CD2 HIS A 134 -19.276 4.475 -7.242 1.00 0.00 C ATOM 2147 CE1 HIS A 134 -20.274 4.481 -9.164 1.00 0.00 C ATOM 2148 NE2 HIS A 134 -20.487 4.733 -7.880 1.00 0.00 N ATOM 0 H HIS A 134 -14.464 3.313 -8.010 1.00 0.00 H new ATOM 0 HA HIS A 134 -16.222 5.472 -8.825 1.00 0.00 H new ATOM 0 HB2 HIS A 134 -16.687 2.943 -8.791 1.00 0.00 H new ATOM 0 HB3 HIS A 134 -16.835 3.109 -7.053 1.00 0.00 H new ATOM 0 HD2 HIS A 134 -19.092 4.579 -6.183 1.00 0.00 H new ATOM 0 HE1 HIS A 134 -21.019 4.582 -9.939 1.00 0.00 H new ATOM 0 HE2 HIS A 134 -21.356 5.050 -7.449 1.00 0.00 H new ATOM 2156 N MET A 135 -15.150 5.105 -5.745 1.00 0.00 N ATOM 2157 CA MET A 135 -14.964 5.801 -4.457 1.00 0.00 C ATOM 2158 C MET A 135 -14.339 7.184 -4.691 1.00 0.00 C ATOM 2159 O MET A 135 -14.839 8.213 -4.208 1.00 0.00 O ATOM 2160 CB MET A 135 -14.050 4.998 -3.518 1.00 0.00 C ATOM 2161 CG MET A 135 -14.515 3.586 -3.121 1.00 0.00 C ATOM 2162 SD MET A 135 -16.053 3.519 -2.167 1.00 0.00 S ATOM 2163 CE MET A 135 -17.323 3.593 -3.433 1.00 0.00 C ATOM 0 H MET A 135 -14.631 4.231 -5.823 1.00 0.00 H new ATOM 0 HA MET A 135 -15.945 5.906 -3.993 1.00 0.00 H new ATOM 0 HB2 MET A 135 -13.072 4.911 -3.992 1.00 0.00 H new ATOM 0 HB3 MET A 135 -13.911 5.577 -2.605 1.00 0.00 H new ATOM 0 HG2 MET A 135 -14.643 2.995 -4.028 1.00 0.00 H new ATOM 0 HG3 MET A 135 -13.725 3.111 -2.540 1.00 0.00 H new ATOM 0 HE1 MET A 135 -18.011 4.409 -3.211 1.00 0.00 H new ATOM 0 HE2 MET A 135 -16.859 3.764 -4.404 1.00 0.00 H new ATOM 0 HE3 MET A 135 -17.872 2.651 -3.453 1.00 0.00 H new ATOM 2173 N LYS A 136 -13.280 7.210 -5.486 1.00 0.00 N ATOM 2174 CA LYS A 136 -12.575 8.451 -5.800 1.00 0.00 C ATOM 2175 C LYS A 136 -13.402 9.340 -6.714 1.00 0.00 C ATOM 2176 O LYS A 136 -13.126 10.518 -6.853 1.00 0.00 O ATOM 2177 CB LYS A 136 -11.181 8.212 -6.375 1.00 0.00 C ATOM 2178 CG LYS A 136 -11.175 7.441 -7.662 1.00 0.00 C ATOM 2179 CD LYS A 136 -9.776 7.223 -8.204 1.00 0.00 C ATOM 2180 CE LYS A 136 -8.896 6.489 -7.205 1.00 0.00 C ATOM 2181 NZ LYS A 136 -7.570 6.150 -7.764 1.00 0.00 N ATOM 0 H LYS A 136 -12.885 6.381 -5.930 1.00 0.00 H new ATOM 0 HA LYS A 136 -12.434 8.973 -4.853 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -10.697 9.175 -6.538 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -10.583 7.675 -5.639 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -11.654 6.475 -7.505 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -11.769 7.975 -8.404 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -9.829 6.652 -9.131 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -9.326 8.185 -8.448 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -8.766 7.107 -6.317 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -9.397 5.575 -6.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -7.008 5.651 -7.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -7.690 5.538 -8.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -7.078 7.022 -8.044 1.00 0.00 H new ATOM 2195 N THR A 137 -14.394 8.752 -7.365 1.00 0.00 N ATOM 2196 CA THR A 137 -15.288 9.494 -8.214 1.00 0.00 C ATOM 2197 C THR A 137 -16.126 10.483 -7.351 1.00 0.00 C ATOM 2198 O THR A 137 -16.576 11.518 -7.839 1.00 0.00 O ATOM 2199 CB THR A 137 -16.177 8.515 -9.076 1.00 0.00 C ATOM 2200 OG1 THR A 137 -16.083 8.818 -10.479 1.00 0.00 O ATOM 2201 CG2 THR A 137 -17.643 8.493 -8.645 1.00 0.00 C ATOM 0 H THR A 137 -14.594 7.753 -7.315 1.00 0.00 H new ATOM 0 HA THR A 137 -14.717 10.090 -8.926 1.00 0.00 H new ATOM 0 HB THR A 137 -15.773 7.519 -8.896 1.00 0.00 H new ATOM 0 HG1 THR A 137 -16.643 8.194 -10.987 1.00 0.00 H new ATOM 0 HG21 THR A 137 -18.198 7.800 -9.278 1.00 0.00 H new ATOM 0 HG22 THR A 137 -17.712 8.170 -7.606 1.00 0.00 H new ATOM 0 HG23 THR A 137 -18.066 9.493 -8.743 1.00 0.00 H new ATOM 2209 N TYR A 138 -16.291 10.166 -6.045 1.00 0.00 N ATOM 2210 CA TYR A 138 -16.944 11.066 -5.147 1.00 0.00 C ATOM 2211 C TYR A 138 -15.897 12.025 -4.640 1.00 0.00 C ATOM 2212 O TYR A 138 -16.006 13.238 -4.803 1.00 0.00 O ATOM 2213 CB TYR A 138 -17.545 10.308 -3.965 1.00 0.00 C ATOM 2214 CG TYR A 138 -18.642 9.335 -4.315 1.00 0.00 C ATOM 2215 CD1 TYR A 138 -19.932 9.776 -4.527 1.00 0.00 C ATOM 2216 CD2 TYR A 138 -18.394 7.974 -4.388 1.00 0.00 C ATOM 2217 CE1 TYR A 138 -20.955 8.894 -4.797 1.00 0.00 C ATOM 2218 CE2 TYR A 138 -19.406 7.081 -4.672 1.00 0.00 C ATOM 2219 CZ TYR A 138 -20.689 7.547 -4.872 1.00 0.00 C ATOM 2220 OH TYR A 138 -21.719 6.660 -5.114 1.00 0.00 O ATOM 0 H TYR A 138 -15.974 9.295 -5.620 1.00 0.00 H new ATOM 0 HA TYR A 138 -17.751 11.588 -5.660 1.00 0.00 H new ATOM 0 HB2 TYR A 138 -16.747 9.764 -3.460 1.00 0.00 H new ATOM 0 HB3 TYR A 138 -17.938 11.033 -3.252 1.00 0.00 H new ATOM 0 HD1 TYR A 138 -20.144 10.834 -4.480 1.00 0.00 H new ATOM 0 HD2 TYR A 138 -17.392 7.606 -4.220 1.00 0.00 H new ATOM 0 HE1 TYR A 138 -21.960 9.258 -4.949 1.00 0.00 H new ATOM 0 HE2 TYR A 138 -19.195 6.024 -4.737 1.00 0.00 H new ATOM 0 HH TYR A 138 -21.365 5.746 -5.138 1.00 0.00 H new ATOM 2230 N SER A 139 -14.851 11.440 -4.046 1.00 0.00 N ATOM 2231 CA SER A 139 -13.685 12.133 -3.491 1.00 0.00 C ATOM 2232 C SER A 139 -14.031 13.281 -2.530 1.00 0.00 C ATOM 2233 O SER A 139 -13.209 14.164 -2.288 1.00 0.00 O ATOM 2234 CB SER A 139 -12.733 12.587 -4.604 1.00 0.00 C ATOM 2235 OG SER A 139 -13.377 13.423 -5.568 1.00 0.00 O ATOM 0 H SER A 139 -14.792 10.428 -3.935 1.00 0.00 H new ATOM 0 HA SER A 139 -13.169 11.398 -2.873 1.00 0.00 H new ATOM 0 HB2 SER A 139 -11.894 13.126 -4.163 1.00 0.00 H new ATOM 0 HB3 SER A 139 -12.321 11.711 -5.105 1.00 0.00 H new ATOM 0 HG SER A 139 -14.315 13.553 -5.314 1.00 0.00 H new ATOM 2241 N GLY A 140 -15.208 13.252 -1.963 1.00 0.00 N ATOM 2242 CA GLY A 140 -15.596 14.249 -1.072 1.00 0.00 C ATOM 2243 C GLY A 140 -16.591 13.652 -0.215 1.00 0.00 C ATOM 2244 O GLY A 140 -17.315 12.781 -0.732 1.00 0.00 O ATOM 2245 OXT GLY A 140 -16.613 13.942 0.990 1.00 0.00 O ATOM 0 H GLY A 140 -15.906 12.526 -2.123 1.00 0.00 H new ATOM 0 HA2 GLY A 140 -14.745 14.606 -0.492 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -16.004 15.109 -1.603 1.00 0.00 H new