USER MOD reduce.3.24.130724 H: found=0, std=0, add=1116, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 1119 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 91 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 100 LYS NZ :NH3+ -147:sc= 0.844 (180deg=-0.462!) USER MOD Set 2.1: A 46 ASN : amide:sc= -14.9! C(o=-20!,f=-8.9!) USER MOD Set 2.2: A 49 HIS : no HD1:sc= -4.97! K(o=-20!,f=-8.9) USER MOD Set 3.1: A 48 GLN : amide:sc= -0.984 K(o=-1,f=0.66) USER MOD Set 3.2: A 74 TYR OH : rot 165:sc= -0.0591 USER MOD Set 4.1: A 32 THR OG1 : rot 88:sc= 1.14 USER MOD Set 4.2: A 33 HIS : no HD1:sc= 1.67 K(o=2.8,f=-6.8!) USER MOD Set 5.1: A 18 HIS : no HD1:sc= 0.858 K(o=0.6,f=-10!) USER MOD Set 5.2: A 105 TYR OH : rot -164:sc= -0.26! USER MOD Set 5.3: A 119 HIS : no HD1:sc=-0.00104 X(o=0.6,f=0.58) USER MOD Single : A 11 GLN : amide:sc= 0.621 K(o=0.62,f=-4.4!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 GLN : amide:sc= -0.0144 X(o=-0.014,f=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 THR OG1 : rot 180:sc= -0.143 USER MOD Single : A 36 MET CE :methyl 166:sc= -1.35 (180deg=-1.87!) USER MOD Single : A 44 HIS : no HD1:sc= 0 X(o=0,f=-0.055) USER MOD Single : A 45 SER OG : rot 43:sc= 0.422 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 HIS : no HD1:sc= 1.01 K(o=1,f=-4.9!) USER MOD Single : A 59 HIS : no HD1:sc= -0.135 X(o=-0.14,f=-0.0065) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.0592) USER MOD Single : A 69 CYS SG : rot 120:sc= 0.507 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ -151:sc= 1.33 (180deg=1.02) USER MOD Single : A 79 SER OG : rot 19:sc= 0.0281 USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ 159:sc= 1.29 (180deg=1.14) USER MOD Single : A 94 ASN : amide:sc= -1.47! C(o=-1.5!,f=-5.3!) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 118 ASN : amide:sc= -0.926 K(o=-0.93,f=-2.4!) USER MOD Single : A 122 CYS SG : rot 32:sc= 0.0292 USER MOD Single : A 124 LYS NZ :NH3+ -131:sc= -1.99! (180deg=-4.48!) USER MOD Single : A 126 THR OG1 : rot 180:sc= 0 USER MOD Single : A 128 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 129 ASN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 131 THR OG1 : rot 180:sc= -0.185 USER MOD Single : A 137 LYS NZ :NH3+ 164:sc= 0.72 (180deg=-0.0574) USER MOD Single : A 140 LYS NZ :NH3+ -153:sc= -0.0632 (180deg=-0.466) USER MOD ----------------------------------------------------------------- ATOM 99 N ALA A 9 23.239 2.638 8.104 1.00 0.00 N ATOM 100 CA ALA A 9 21.828 2.291 8.052 1.00 0.00 C ATOM 101 C ALA A 9 21.102 3.179 7.053 1.00 0.00 C ATOM 102 O ALA A 9 20.900 4.373 7.294 1.00 0.00 O ATOM 103 CB ALA A 9 21.186 2.396 9.430 1.00 0.00 C ATOM 0 HA ALA A 9 21.745 1.255 7.723 1.00 0.00 H new ATOM 0 HB1 ALA A 9 20.131 2.131 9.361 1.00 0.00 H new ATOM 0 HB2 ALA A 9 21.687 1.715 10.118 1.00 0.00 H new ATOM 0 HB3 ALA A 9 21.280 3.418 9.798 1.00 0.00 H new ATOM 109 N VAL A 10 20.715 2.596 5.930 1.00 0.00 N ATOM 110 CA VAL A 10 20.001 3.329 4.906 1.00 0.00 C ATOM 111 C VAL A 10 18.522 3.036 5.046 1.00 0.00 C ATOM 112 O VAL A 10 18.106 1.879 5.040 1.00 0.00 O ATOM 113 CB VAL A 10 20.469 2.967 3.479 1.00 0.00 C ATOM 114 CG1 VAL A 10 19.873 3.925 2.464 1.00 0.00 C ATOM 115 CG2 VAL A 10 21.987 2.963 3.377 1.00 0.00 C ATOM 0 H VAL A 10 20.885 1.615 5.707 1.00 0.00 H new ATOM 0 HA VAL A 10 20.206 4.390 5.047 1.00 0.00 H new ATOM 0 HB VAL A 10 20.116 1.959 3.260 1.00 0.00 H new ATOM 0 HG11 VAL A 10 20.214 3.655 1.465 1.00 0.00 H new ATOM 0 HG12 VAL A 10 18.785 3.868 2.504 1.00 0.00 H new ATOM 0 HG13 VAL A 10 20.191 4.942 2.693 1.00 0.00 H new ATOM 0 HG21 VAL A 10 22.283 2.704 2.360 1.00 0.00 H new ATOM 0 HG22 VAL A 10 22.371 3.952 3.626 1.00 0.00 H new ATOM 0 HG23 VAL A 10 22.396 2.229 4.071 1.00 0.00 H new ATOM 125 N GLN A 11 17.739 4.080 5.205 1.00 0.00 N ATOM 126 CA GLN A 11 16.338 3.930 5.531 1.00 0.00 C ATOM 127 C GLN A 11 15.445 4.581 4.500 1.00 0.00 C ATOM 128 O GLN A 11 15.597 5.752 4.155 1.00 0.00 O ATOM 129 CB GLN A 11 16.041 4.454 6.927 1.00 0.00 C ATOM 130 CG GLN A 11 17.162 5.263 7.554 1.00 0.00 C ATOM 131 CD GLN A 11 17.390 6.603 6.878 1.00 0.00 C ATOM 132 OE1 GLN A 11 18.194 6.712 5.953 1.00 0.00 O ATOM 133 NE2 GLN A 11 16.695 7.627 7.334 1.00 0.00 N ATOM 0 H GLN A 11 18.051 5.047 5.113 1.00 0.00 H new ATOM 0 HA GLN A 11 16.116 2.863 5.518 1.00 0.00 H new ATOM 0 HB2 GLN A 11 15.145 5.073 6.885 1.00 0.00 H new ATOM 0 HB3 GLN A 11 15.814 3.609 7.577 1.00 0.00 H new ATOM 0 HG2 GLN A 11 16.935 5.430 8.607 1.00 0.00 H new ATOM 0 HG3 GLN A 11 18.084 4.683 7.515 1.00 0.00 H new ATOM 0 HE21 GLN A 11 16.038 7.495 8.103 1.00 0.00 H new ATOM 0 HE22 GLN A 11 16.815 8.550 6.918 1.00 0.00 H new ATOM 142 N VAL A 12 14.507 3.789 4.025 1.00 0.00 N ATOM 143 CA VAL A 12 13.591 4.192 2.990 1.00 0.00 C ATOM 144 C VAL A 12 12.216 4.446 3.610 1.00 0.00 C ATOM 145 O VAL A 12 11.884 3.849 4.637 1.00 0.00 O ATOM 146 CB VAL A 12 13.518 3.086 1.912 1.00 0.00 C ATOM 147 CG1 VAL A 12 14.849 2.960 1.181 1.00 0.00 C ATOM 148 CG2 VAL A 12 13.166 1.764 2.546 1.00 0.00 C ATOM 0 H VAL A 12 14.361 2.835 4.354 1.00 0.00 H new ATOM 0 HA VAL A 12 13.935 5.112 2.516 1.00 0.00 H new ATOM 0 HB VAL A 12 12.745 3.361 1.194 1.00 0.00 H new ATOM 0 HG11 VAL A 12 14.777 2.177 0.427 1.00 0.00 H new ATOM 0 HG12 VAL A 12 15.090 3.907 0.699 1.00 0.00 H new ATOM 0 HG13 VAL A 12 15.633 2.706 1.894 1.00 0.00 H new ATOM 0 HG21 VAL A 12 13.118 0.993 1.777 1.00 0.00 H new ATOM 0 HG22 VAL A 12 13.927 1.498 3.279 1.00 0.00 H new ATOM 0 HG23 VAL A 12 12.198 1.844 3.041 1.00 0.00 H new ATOM 158 N LYS A 13 11.429 5.334 3.018 1.00 0.00 N ATOM 159 CA LYS A 13 10.137 5.692 3.593 1.00 0.00 C ATOM 160 C LYS A 13 9.044 5.358 2.590 1.00 0.00 C ATOM 161 O LYS A 13 9.087 5.807 1.450 1.00 0.00 O ATOM 162 CB LYS A 13 10.104 7.193 3.972 1.00 0.00 C ATOM 163 CG LYS A 13 8.885 7.639 4.762 1.00 0.00 C ATOM 164 CD LYS A 13 9.098 9.061 5.264 1.00 0.00 C ATOM 165 CE LYS A 13 7.971 9.542 6.156 1.00 0.00 C ATOM 166 NZ LYS A 13 8.248 10.895 6.707 1.00 0.00 N ATOM 0 H LYS A 13 11.658 5.816 2.149 1.00 0.00 H new ATOM 0 HA LYS A 13 9.972 5.122 4.507 1.00 0.00 H new ATOM 0 HB2 LYS A 13 10.997 7.423 4.553 1.00 0.00 H new ATOM 0 HB3 LYS A 13 10.159 7.783 3.057 1.00 0.00 H new ATOM 0 HG2 LYS A 13 7.995 7.593 4.135 1.00 0.00 H new ATOM 0 HG3 LYS A 13 8.717 6.966 5.603 1.00 0.00 H new ATOM 0 HD2 LYS A 13 10.038 9.111 5.814 1.00 0.00 H new ATOM 0 HD3 LYS A 13 9.192 9.733 4.411 1.00 0.00 H new ATOM 0 HE2 LYS A 13 7.041 9.563 5.588 1.00 0.00 H new ATOM 0 HE3 LYS A 13 7.828 8.837 6.975 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 7.456 11.192 7.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 9.123 10.869 7.269 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 8.359 11.572 5.925 1.00 0.00 H new ATOM 180 N LEU A 14 8.101 4.527 2.992 1.00 0.00 N ATOM 181 CA LEU A 14 6.980 4.193 2.139 1.00 0.00 C ATOM 182 C LEU A 14 5.694 4.726 2.750 1.00 0.00 C ATOM 183 O LEU A 14 5.542 4.770 3.965 1.00 0.00 O ATOM 184 CB LEU A 14 6.898 2.684 1.915 1.00 0.00 C ATOM 185 CG LEU A 14 8.064 2.076 1.123 1.00 0.00 C ATOM 186 CD1 LEU A 14 7.938 0.569 1.075 1.00 0.00 C ATOM 187 CD2 LEU A 14 8.108 2.635 -0.288 1.00 0.00 C ATOM 0 H LEU A 14 8.090 4.072 3.905 1.00 0.00 H new ATOM 0 HA LEU A 14 7.124 4.662 1.165 1.00 0.00 H new ATOM 0 HB2 LEU A 14 6.843 2.191 2.886 1.00 0.00 H new ATOM 0 HB3 LEU A 14 5.969 2.461 1.391 1.00 0.00 H new ATOM 0 HG LEU A 14 8.992 2.340 1.630 1.00 0.00 H new ATOM 0 HD11 LEU A 14 8.772 0.152 0.510 1.00 0.00 H new ATOM 0 HD12 LEU A 14 7.951 0.170 2.089 1.00 0.00 H new ATOM 0 HD13 LEU A 14 7.000 0.298 0.591 1.00 0.00 H new ATOM 0 HD21 LEU A 14 8.942 2.190 -0.830 1.00 0.00 H new ATOM 0 HD22 LEU A 14 7.175 2.401 -0.801 1.00 0.00 H new ATOM 0 HD23 LEU A 14 8.238 3.716 -0.247 1.00 0.00 H new ATOM 199 N GLU A 15 4.786 5.130 1.900 1.00 0.00 N ATOM 200 CA GLU A 15 3.595 5.844 2.313 1.00 0.00 C ATOM 201 C GLU A 15 2.340 5.051 1.967 1.00 0.00 C ATOM 202 O GLU A 15 2.173 4.598 0.831 1.00 0.00 O ATOM 203 CB GLU A 15 3.581 7.217 1.626 1.00 0.00 C ATOM 204 CG GLU A 15 2.420 8.115 2.016 1.00 0.00 C ATOM 205 CD GLU A 15 2.525 9.500 1.397 1.00 0.00 C ATOM 206 OE1 GLU A 15 2.151 9.666 0.216 1.00 0.00 O ATOM 207 OE2 GLU A 15 2.977 10.436 2.094 1.00 0.00 O ATOM 0 H GLU A 15 4.848 4.974 0.894 1.00 0.00 H new ATOM 0 HA GLU A 15 3.607 5.978 3.395 1.00 0.00 H new ATOM 0 HB2 GLU A 15 4.513 7.732 1.857 1.00 0.00 H new ATOM 0 HB3 GLU A 15 3.559 7.067 0.547 1.00 0.00 H new ATOM 0 HG2 GLU A 15 1.484 7.651 1.704 1.00 0.00 H new ATOM 0 HG3 GLU A 15 2.384 8.207 3.102 1.00 0.00 H new ATOM 214 N LEU A 16 1.487 4.858 2.967 1.00 0.00 N ATOM 215 CA LEU A 16 0.180 4.246 2.763 1.00 0.00 C ATOM 216 C LEU A 16 -0.870 5.332 2.702 1.00 0.00 C ATOM 217 O LEU A 16 -0.908 6.218 3.558 1.00 0.00 O ATOM 218 CB LEU A 16 -0.223 3.299 3.896 1.00 0.00 C ATOM 219 CG LEU A 16 0.522 1.967 4.019 1.00 0.00 C ATOM 220 CD1 LEU A 16 0.570 1.243 2.690 1.00 0.00 C ATOM 221 CD2 LEU A 16 1.916 2.170 4.578 1.00 0.00 C ATOM 0 H LEU A 16 1.680 5.119 3.934 1.00 0.00 H new ATOM 0 HA LEU A 16 0.247 3.674 1.838 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -0.105 3.836 4.837 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -1.285 3.079 3.785 1.00 0.00 H new ATOM 0 HG LEU A 16 -0.031 1.342 4.720 1.00 0.00 H new ATOM 0 HD11 LEU A 16 1.105 0.301 2.808 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -0.445 1.043 2.348 1.00 0.00 H new ATOM 0 HD13 LEU A 16 1.085 1.863 1.956 1.00 0.00 H new ATOM 0 HD21 LEU A 16 2.421 1.207 4.654 1.00 0.00 H new ATOM 0 HD22 LEU A 16 2.482 2.825 3.916 1.00 0.00 H new ATOM 0 HD23 LEU A 16 1.849 2.624 5.567 1.00 0.00 H new ATOM 233 N GLY A 17 -1.730 5.250 1.722 1.00 0.00 N ATOM 234 CA GLY A 17 -2.810 6.204 1.612 1.00 0.00 C ATOM 235 C GLY A 17 -4.026 5.602 0.958 1.00 0.00 C ATOM 236 O GLY A 17 -3.906 4.710 0.122 1.00 0.00 O ATOM 0 H GLY A 17 -1.708 4.539 0.991 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -3.075 6.569 2.604 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -2.476 7.066 1.034 1.00 0.00 H new ATOM 240 N HIS A 18 -5.199 6.068 1.352 1.00 0.00 N ATOM 241 CA HIS A 18 -6.436 5.589 0.764 1.00 0.00 C ATOM 242 C HIS A 18 -7.527 6.636 0.924 1.00 0.00 C ATOM 243 O HIS A 18 -7.537 7.399 1.893 1.00 0.00 O ATOM 244 CB HIS A 18 -6.858 4.243 1.400 1.00 0.00 C ATOM 245 CG HIS A 18 -8.111 4.291 2.233 1.00 0.00 C ATOM 246 ND1 HIS A 18 -8.152 4.834 3.501 1.00 0.00 N ATOM 247 CD2 HIS A 18 -9.377 3.893 1.956 1.00 0.00 C ATOM 248 CE1 HIS A 18 -9.386 4.776 3.961 1.00 0.00 C ATOM 249 NE2 HIS A 18 -10.145 4.206 3.046 1.00 0.00 N ATOM 0 H HIS A 18 -5.320 6.777 2.076 1.00 0.00 H new ATOM 0 HA HIS A 18 -6.277 5.417 -0.301 1.00 0.00 H new ATOM 0 HB2 HIS A 18 -6.998 3.512 0.604 1.00 0.00 H new ATOM 0 HB3 HIS A 18 -6.040 3.882 2.024 1.00 0.00 H new ATOM 0 HD2 HIS A 18 -9.716 3.418 1.047 1.00 0.00 H new ATOM 0 HE1 HIS A 18 -9.719 5.135 4.924 1.00 0.00 H new ATOM 0 HE2 HIS A 18 -11.145 4.027 3.136 1.00 0.00 H new ATOM 258 N ARG A 19 -8.435 6.659 -0.028 1.00 0.00 N ATOM 259 CA ARG A 19 -9.583 7.541 0.022 1.00 0.00 C ATOM 260 C ARG A 19 -10.851 6.715 -0.102 1.00 0.00 C ATOM 261 O ARG A 19 -10.802 5.589 -0.594 1.00 0.00 O ATOM 262 CB ARG A 19 -9.530 8.556 -1.114 1.00 0.00 C ATOM 263 CG ARG A 19 -8.281 9.411 -1.146 1.00 0.00 C ATOM 264 CD ARG A 19 -8.314 10.330 -2.350 1.00 0.00 C ATOM 265 NE ARG A 19 -9.452 11.247 -2.301 1.00 0.00 N ATOM 266 CZ ARG A 19 -9.718 12.162 -3.229 1.00 0.00 C ATOM 267 NH1 ARG A 19 -8.905 12.330 -4.266 1.00 0.00 N ATOM 268 NH2 ARG A 19 -10.802 12.917 -3.111 1.00 0.00 N ATOM 0 H ARG A 19 -8.399 6.068 -0.858 1.00 0.00 H new ATOM 0 HA ARG A 19 -9.574 8.077 0.971 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -9.613 8.024 -2.062 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -10.399 9.210 -1.039 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -8.209 9.999 -0.231 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -7.396 8.776 -1.187 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -7.388 10.902 -2.396 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -8.366 9.734 -3.261 1.00 0.00 H new ATOM 0 HE ARG A 19 -10.083 11.181 -1.503 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -8.068 11.754 -4.356 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -9.118 13.034 -4.972 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -11.425 12.794 -2.313 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -11.013 13.621 -3.819 1.00 0.00 H new ATOM 282 N ALA A 20 -11.967 7.256 0.357 1.00 0.00 N ATOM 283 CA ALA A 20 -13.254 6.593 0.200 1.00 0.00 C ATOM 284 C ALA A 20 -14.362 7.608 -0.027 1.00 0.00 C ATOM 285 O ALA A 20 -14.404 8.660 0.629 1.00 0.00 O ATOM 286 CB ALA A 20 -13.586 5.741 1.413 1.00 0.00 C ATOM 0 H ALA A 20 -12.010 8.153 0.842 1.00 0.00 H new ATOM 0 HA ALA A 20 -13.180 5.944 -0.673 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -14.553 5.259 1.266 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -12.817 4.980 1.544 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -13.627 6.372 2.301 1.00 0.00 H new ATOM 292 N GLN A 21 -15.250 7.279 -0.958 1.00 0.00 N ATOM 293 CA GLN A 21 -16.436 8.070 -1.222 1.00 0.00 C ATOM 294 C GLN A 21 -17.592 7.125 -1.521 1.00 0.00 C ATOM 295 O GLN A 21 -17.371 5.985 -1.937 1.00 0.00 O ATOM 296 CB GLN A 21 -16.213 9.010 -2.410 1.00 0.00 C ATOM 297 CG GLN A 21 -16.190 8.308 -3.753 1.00 0.00 C ATOM 298 CD GLN A 21 -16.917 9.085 -4.831 1.00 0.00 C ATOM 299 OE1 GLN A 21 -16.324 9.898 -5.540 1.00 0.00 O ATOM 300 NE2 GLN A 21 -18.214 8.844 -4.959 1.00 0.00 N ATOM 0 H GLN A 21 -15.163 6.453 -1.550 1.00 0.00 H new ATOM 0 HA GLN A 21 -16.662 8.681 -0.348 1.00 0.00 H new ATOM 0 HB2 GLN A 21 -17.001 9.763 -2.418 1.00 0.00 H new ATOM 0 HB3 GLN A 21 -15.270 9.538 -2.271 1.00 0.00 H new ATOM 0 HG2 GLN A 21 -15.156 8.151 -4.059 1.00 0.00 H new ATOM 0 HG3 GLN A 21 -16.645 7.323 -3.651 1.00 0.00 H new ATOM 0 HE21 GLN A 21 -18.668 8.162 -4.352 1.00 0.00 H new ATOM 0 HE22 GLN A 21 -18.758 9.340 -5.665 1.00 0.00 H new ATOM 309 N VAL A 22 -18.810 7.563 -1.289 1.00 0.00 N ATOM 310 CA VAL A 22 -19.958 6.730 -1.590 1.00 0.00 C ATOM 311 C VAL A 22 -20.649 7.210 -2.857 1.00 0.00 C ATOM 312 O VAL A 22 -20.739 8.409 -3.114 1.00 0.00 O ATOM 313 CB VAL A 22 -20.967 6.665 -0.416 1.00 0.00 C ATOM 314 CG1 VAL A 22 -21.712 7.980 -0.231 1.00 0.00 C ATOM 315 CG2 VAL A 22 -21.942 5.518 -0.620 1.00 0.00 C ATOM 0 H VAL A 22 -19.032 8.479 -0.898 1.00 0.00 H new ATOM 0 HA VAL A 22 -19.584 5.718 -1.748 1.00 0.00 H new ATOM 0 HB VAL A 22 -20.399 6.487 0.497 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -22.409 7.889 0.602 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -20.998 8.776 -0.022 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -22.264 8.217 -1.141 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -22.645 5.485 0.213 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -22.489 5.667 -1.551 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -21.393 4.578 -0.669 1.00 0.00 H new ATOM 325 N ARG A 23 -21.094 6.269 -3.664 1.00 0.00 N ATOM 326 CA ARG A 23 -21.943 6.585 -4.799 1.00 0.00 C ATOM 327 C ARG A 23 -23.387 6.434 -4.361 1.00 0.00 C ATOM 328 O ARG A 23 -23.741 5.456 -3.699 1.00 0.00 O ATOM 329 CB ARG A 23 -21.630 5.680 -6.001 1.00 0.00 C ATOM 330 CG ARG A 23 -21.046 4.334 -5.606 1.00 0.00 C ATOM 331 CD ARG A 23 -21.576 3.189 -6.456 1.00 0.00 C ATOM 332 NE ARG A 23 -21.270 3.329 -7.879 1.00 0.00 N ATOM 333 CZ ARG A 23 -20.458 2.506 -8.547 1.00 0.00 C ATOM 334 NH1 ARG A 23 -19.730 1.610 -7.890 1.00 0.00 N ATOM 335 NH2 ARG A 23 -20.350 2.602 -9.867 1.00 0.00 N ATOM 0 H ARG A 23 -20.883 5.277 -3.557 1.00 0.00 H new ATOM 0 HA ARG A 23 -21.758 7.609 -5.125 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -22.544 5.518 -6.572 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -20.929 6.193 -6.660 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -19.960 4.374 -5.695 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -21.273 4.138 -4.558 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -21.155 2.252 -6.092 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -22.657 3.123 -6.330 1.00 0.00 H new ATOM 0 HE ARG A 23 -21.701 4.099 -8.390 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -19.791 1.550 -6.874 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -19.110 0.982 -8.402 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -20.888 3.306 -10.373 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -19.729 1.972 -10.375 1.00 0.00 H new ATOM 349 N LYS A 24 -24.209 7.419 -4.708 1.00 0.00 N ATOM 350 CA LYS A 24 -25.591 7.484 -4.237 1.00 0.00 C ATOM 351 C LYS A 24 -26.400 6.287 -4.727 1.00 0.00 C ATOM 352 O LYS A 24 -27.479 5.994 -4.211 1.00 0.00 O ATOM 353 CB LYS A 24 -26.244 8.787 -4.701 1.00 0.00 C ATOM 354 CG LYS A 24 -27.558 9.080 -4.001 1.00 0.00 C ATOM 355 CD LYS A 24 -27.346 9.421 -2.535 1.00 0.00 C ATOM 356 CE LYS A 24 -28.668 9.649 -1.822 1.00 0.00 C ATOM 357 NZ LYS A 24 -28.476 10.059 -0.408 1.00 0.00 N ATOM 0 H LYS A 24 -23.940 8.190 -5.319 1.00 0.00 H new ATOM 0 HA LYS A 24 -25.578 7.458 -3.147 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -25.555 9.613 -4.527 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -26.416 8.737 -5.776 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -28.060 9.910 -4.499 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -28.216 8.214 -4.083 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -26.802 8.612 -2.047 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -26.728 10.315 -2.454 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -29.235 10.417 -2.348 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -29.261 8.735 -1.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -29.403 10.204 0.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -27.957 9.316 0.102 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -27.933 10.945 -0.374 1.00 0.00 H new ATOM 371 N LYS A 25 -25.865 5.591 -5.712 1.00 0.00 N ATOM 372 CA LYS A 25 -26.507 4.408 -6.244 1.00 0.00 C ATOM 373 C LYS A 25 -25.485 3.285 -6.361 1.00 0.00 C ATOM 374 O LYS A 25 -24.530 3.394 -7.133 1.00 0.00 O ATOM 375 CB LYS A 25 -27.127 4.698 -7.615 1.00 0.00 C ATOM 376 CG LYS A 25 -27.901 3.538 -8.186 1.00 0.00 C ATOM 377 CD LYS A 25 -29.208 3.312 -7.453 1.00 0.00 C ATOM 378 CE LYS A 25 -29.898 2.064 -7.965 1.00 0.00 C ATOM 379 NZ LYS A 25 -31.091 1.708 -7.153 1.00 0.00 N ATOM 0 H LYS A 25 -24.981 5.828 -6.162 1.00 0.00 H new ATOM 0 HA LYS A 25 -27.305 4.106 -5.566 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -27.790 5.559 -7.530 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -26.335 4.973 -8.311 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -28.104 3.722 -9.241 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -27.294 2.635 -8.131 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -29.020 3.217 -6.384 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -29.860 4.175 -7.586 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -30.199 2.217 -9.002 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -29.194 1.232 -7.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -31.530 0.849 -7.540 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -30.802 1.536 -6.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -31.776 2.490 -7.181 1.00 0.00 H new ATOM 393 N PRO A 26 -25.656 2.209 -5.573 1.00 0.00 N ATOM 394 CA PRO A 26 -24.765 1.045 -5.613 1.00 0.00 C ATOM 395 C PRO A 26 -24.717 0.417 -6.999 1.00 0.00 C ATOM 396 O PRO A 26 -25.626 0.603 -7.808 1.00 0.00 O ATOM 397 CB PRO A 26 -25.385 0.067 -4.608 1.00 0.00 C ATOM 398 CG PRO A 26 -26.259 0.895 -3.735 1.00 0.00 C ATOM 399 CD PRO A 26 -26.728 2.046 -4.578 1.00 0.00 C ATOM 0 HA PRO A 26 -23.736 1.314 -5.374 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -25.959 -0.707 -5.117 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -24.614 -0.438 -4.026 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -27.104 0.313 -3.367 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -25.712 1.250 -2.862 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -27.685 1.831 -5.052 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -26.863 2.949 -3.983 1.00 0.00 H new ATOM 407 N THR A 27 -23.658 -0.333 -7.266 1.00 0.00 N ATOM 408 CA THR A 27 -23.484 -0.965 -8.565 1.00 0.00 C ATOM 409 C THR A 27 -24.422 -2.165 -8.691 1.00 0.00 C ATOM 410 O THR A 27 -25.179 -2.457 -7.766 1.00 0.00 O ATOM 411 CB THR A 27 -22.009 -1.396 -8.791 1.00 0.00 C ATOM 412 OG1 THR A 27 -21.843 -2.023 -10.071 1.00 0.00 O ATOM 413 CG2 THR A 27 -21.537 -2.346 -7.701 1.00 0.00 C ATOM 0 H THR A 27 -22.907 -0.519 -6.601 1.00 0.00 H new ATOM 0 HA THR A 27 -23.735 -0.236 -9.336 1.00 0.00 H new ATOM 0 HB THR A 27 -21.404 -0.490 -8.756 1.00 0.00 H new ATOM 0 HG1 THR A 27 -20.905 -2.283 -10.189 1.00 0.00 H new ATOM 0 HG21 THR A 27 -20.501 -2.629 -7.888 1.00 0.00 H new ATOM 0 HG22 THR A 27 -21.609 -1.852 -6.732 1.00 0.00 H new ATOM 0 HG23 THR A 27 -22.162 -3.239 -7.701 1.00 0.00 H new ATOM 421 N VAL A 28 -24.373 -2.841 -9.829 1.00 0.00 N ATOM 422 CA VAL A 28 -25.216 -4.003 -10.099 1.00 0.00 C ATOM 423 C VAL A 28 -25.224 -5.002 -8.934 1.00 0.00 C ATOM 424 O VAL A 28 -26.279 -5.511 -8.545 1.00 0.00 O ATOM 425 CB VAL A 28 -24.766 -4.703 -11.396 1.00 0.00 C ATOM 426 CG1 VAL A 28 -23.256 -4.902 -11.413 1.00 0.00 C ATOM 427 CG2 VAL A 28 -25.489 -6.028 -11.579 1.00 0.00 C ATOM 0 H VAL A 28 -23.746 -2.600 -10.596 1.00 0.00 H new ATOM 0 HA VAL A 28 -26.236 -3.637 -10.220 1.00 0.00 H new ATOM 0 HB VAL A 28 -25.030 -4.057 -12.233 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -22.965 -5.398 -12.339 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -22.761 -3.933 -11.349 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -22.961 -5.517 -10.563 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -25.153 -6.501 -12.502 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -25.270 -6.682 -10.735 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -26.563 -5.852 -11.632 1.00 0.00 H new ATOM 437 N GLU A 29 -24.055 -5.251 -8.359 1.00 0.00 N ATOM 438 CA GLU A 29 -23.931 -6.230 -7.286 1.00 0.00 C ATOM 439 C GLU A 29 -24.174 -5.598 -5.911 1.00 0.00 C ATOM 440 O GLU A 29 -24.058 -6.265 -4.882 1.00 0.00 O ATOM 441 CB GLU A 29 -22.560 -6.900 -7.345 1.00 0.00 C ATOM 442 CG GLU A 29 -22.308 -7.633 -8.658 1.00 0.00 C ATOM 443 CD GLU A 29 -21.031 -8.444 -8.640 1.00 0.00 C ATOM 444 OE1 GLU A 29 -21.015 -9.524 -8.016 1.00 0.00 O ATOM 445 OE2 GLU A 29 -20.031 -8.008 -9.249 1.00 0.00 O ATOM 0 H GLU A 29 -23.182 -4.791 -8.616 1.00 0.00 H new ATOM 0 HA GLU A 29 -24.700 -6.989 -7.430 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -21.787 -6.145 -7.203 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -22.471 -7.606 -6.519 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -23.150 -8.293 -8.868 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -22.261 -6.908 -9.471 1.00 0.00 H new ATOM 452 N GLY A 30 -24.508 -4.313 -5.900 1.00 0.00 N ATOM 453 CA GLY A 30 -24.929 -3.657 -4.672 1.00 0.00 C ATOM 454 C GLY A 30 -23.779 -3.141 -3.832 1.00 0.00 C ATOM 455 O GLY A 30 -23.864 -3.106 -2.605 1.00 0.00 O ATOM 0 H GLY A 30 -24.495 -3.710 -6.722 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -25.587 -2.825 -4.922 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -25.515 -4.359 -4.078 1.00 0.00 H new ATOM 459 N PHE A 31 -22.707 -2.728 -4.486 1.00 0.00 N ATOM 460 CA PHE A 31 -21.572 -2.154 -3.787 1.00 0.00 C ATOM 461 C PHE A 31 -21.752 -0.638 -3.722 1.00 0.00 C ATOM 462 O PHE A 31 -21.946 0.015 -4.750 1.00 0.00 O ATOM 463 CB PHE A 31 -20.260 -2.523 -4.492 1.00 0.00 C ATOM 464 CG PHE A 31 -20.104 -3.999 -4.797 1.00 0.00 C ATOM 465 CD1 PHE A 31 -20.720 -4.968 -4.017 1.00 0.00 C ATOM 466 CD2 PHE A 31 -19.338 -4.412 -5.875 1.00 0.00 C ATOM 467 CE1 PHE A 31 -20.573 -6.311 -4.308 1.00 0.00 C ATOM 468 CE2 PHE A 31 -19.188 -5.752 -6.169 1.00 0.00 C ATOM 469 CZ PHE A 31 -19.807 -6.704 -5.387 1.00 0.00 C ATOM 0 H PHE A 31 -22.599 -2.780 -5.499 1.00 0.00 H new ATOM 0 HA PHE A 31 -21.522 -2.555 -2.775 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -20.194 -1.963 -5.425 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -19.425 -2.204 -3.869 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -21.322 -4.669 -3.172 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -18.851 -3.674 -6.495 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -21.058 -7.053 -3.691 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -18.585 -6.055 -7.012 1.00 0.00 H new ATOM 0 HZ PHE A 31 -19.693 -7.753 -5.618 1.00 0.00 H new ATOM 479 N THR A 32 -21.716 -0.094 -2.514 1.00 0.00 N ATOM 480 CA THR A 32 -22.080 1.302 -2.279 1.00 0.00 C ATOM 481 C THR A 32 -20.866 2.227 -2.203 1.00 0.00 C ATOM 482 O THR A 32 -20.915 3.375 -2.644 1.00 0.00 O ATOM 483 CB THR A 32 -22.880 1.436 -0.967 1.00 0.00 C ATOM 484 OG1 THR A 32 -22.108 0.957 0.146 1.00 0.00 O ATOM 485 CG2 THR A 32 -24.168 0.664 -1.050 1.00 0.00 C ATOM 0 H THR A 32 -21.437 -0.600 -1.674 1.00 0.00 H new ATOM 0 HA THR A 32 -22.686 1.605 -3.133 1.00 0.00 H new ATOM 0 HB THR A 32 -23.106 2.492 -0.819 1.00 0.00 H new ATOM 0 HG1 THR A 32 -21.560 1.687 0.503 1.00 0.00 H new ATOM 0 HG21 THR A 32 -24.717 0.771 -0.115 1.00 0.00 H new ATOM 0 HG22 THR A 32 -24.771 1.050 -1.872 1.00 0.00 H new ATOM 0 HG23 THR A 32 -23.950 -0.390 -1.224 1.00 0.00 H new ATOM 493 N HIS A 33 -19.782 1.725 -1.644 1.00 0.00 N ATOM 494 CA HIS A 33 -18.639 2.558 -1.305 1.00 0.00 C ATOM 495 C HIS A 33 -17.449 2.281 -2.209 1.00 0.00 C ATOM 496 O HIS A 33 -16.989 1.151 -2.305 1.00 0.00 O ATOM 497 CB HIS A 33 -18.253 2.320 0.153 1.00 0.00 C ATOM 498 CG HIS A 33 -19.059 3.111 1.134 1.00 0.00 C ATOM 499 ND1 HIS A 33 -20.288 2.708 1.612 1.00 0.00 N ATOM 500 CD2 HIS A 33 -18.785 4.282 1.748 1.00 0.00 C ATOM 501 CE1 HIS A 33 -20.729 3.599 2.482 1.00 0.00 C ATOM 502 NE2 HIS A 33 -19.836 4.564 2.582 1.00 0.00 N ATOM 0 H HIS A 33 -19.666 0.738 -1.413 1.00 0.00 H new ATOM 0 HA HIS A 33 -18.925 3.600 -1.450 1.00 0.00 H new ATOM 0 HB2 HIS A 33 -18.364 1.259 0.379 1.00 0.00 H new ATOM 0 HB3 HIS A 33 -17.199 2.565 0.283 1.00 0.00 H new ATOM 0 HD2 HIS A 33 -17.900 4.886 1.608 1.00 0.00 H new ATOM 0 HE1 HIS A 33 -21.664 3.546 3.021 1.00 0.00 H new ATOM 0 HE2 HIS A 33 -19.914 5.386 3.181 1.00 0.00 H new ATOM 511 N ASP A 34 -16.938 3.325 -2.843 1.00 0.00 N ATOM 512 CA ASP A 34 -15.783 3.203 -3.723 1.00 0.00 C ATOM 513 C ASP A 34 -14.566 3.786 -3.046 1.00 0.00 C ATOM 514 O ASP A 34 -14.617 4.895 -2.507 1.00 0.00 O ATOM 515 CB ASP A 34 -16.011 3.926 -5.054 1.00 0.00 C ATOM 516 CG ASP A 34 -16.872 3.142 -6.021 1.00 0.00 C ATOM 517 OD1 ASP A 34 -18.109 3.137 -5.858 1.00 0.00 O ATOM 518 OD2 ASP A 34 -16.313 2.539 -6.960 1.00 0.00 O ATOM 0 H ASP A 34 -17.307 4.273 -2.764 1.00 0.00 H new ATOM 0 HA ASP A 34 -15.631 2.144 -3.929 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -16.480 4.890 -4.860 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -15.046 4.129 -5.519 1.00 0.00 H new ATOM 523 N TRP A 35 -13.475 3.054 -3.074 1.00 0.00 N ATOM 524 CA TRP A 35 -12.261 3.514 -2.440 1.00 0.00 C ATOM 525 C TRP A 35 -11.050 3.309 -3.332 1.00 0.00 C ATOM 526 O TRP A 35 -11.077 2.521 -4.281 1.00 0.00 O ATOM 527 CB TRP A 35 -12.055 2.838 -1.077 1.00 0.00 C ATOM 528 CG TRP A 35 -12.086 1.332 -1.088 1.00 0.00 C ATOM 529 CD1 TRP A 35 -13.121 0.521 -0.702 1.00 0.00 C ATOM 530 CD2 TRP A 35 -11.016 0.455 -1.469 1.00 0.00 C ATOM 531 NE1 TRP A 35 -12.756 -0.801 -0.826 1.00 0.00 N ATOM 532 CE2 TRP A 35 -11.471 -0.866 -1.296 1.00 0.00 C ATOM 533 CE3 TRP A 35 -9.717 0.663 -1.945 1.00 0.00 C ATOM 534 CZ2 TRP A 35 -10.669 -1.972 -1.575 1.00 0.00 C ATOM 535 CZ3 TRP A 35 -8.922 -0.435 -2.218 1.00 0.00 C ATOM 536 CH2 TRP A 35 -9.400 -1.736 -2.033 1.00 0.00 C ATOM 0 H TRP A 35 -13.404 2.143 -3.526 1.00 0.00 H new ATOM 0 HA TRP A 35 -12.371 4.586 -2.274 1.00 0.00 H new ATOM 0 HB2 TRP A 35 -11.096 3.161 -0.672 1.00 0.00 H new ATOM 0 HB3 TRP A 35 -12.826 3.195 -0.394 1.00 0.00 H new ATOM 0 HD1 TRP A 35 -14.082 0.868 -0.352 1.00 0.00 H new ATOM 0 HE1 TRP A 35 -13.347 -1.602 -0.604 1.00 0.00 H new ATOM 0 HE3 TRP A 35 -9.341 1.664 -2.097 1.00 0.00 H new ATOM 0 HZ2 TRP A 35 -11.035 -2.978 -1.435 1.00 0.00 H new ATOM 0 HZ3 TRP A 35 -7.916 -0.285 -2.580 1.00 0.00 H new ATOM 0 HH2 TRP A 35 -8.755 -2.573 -2.256 1.00 0.00 H new ATOM 547 N MET A 36 -9.998 4.036 -3.010 1.00 0.00 N ATOM 548 CA MET A 36 -8.744 3.959 -3.732 1.00 0.00 C ATOM 549 C MET A 36 -7.579 3.969 -2.755 1.00 0.00 C ATOM 550 O MET A 36 -7.542 4.783 -1.835 1.00 0.00 O ATOM 551 CB MET A 36 -8.603 5.139 -4.693 1.00 0.00 C ATOM 552 CG MET A 36 -7.217 5.252 -5.303 1.00 0.00 C ATOM 553 SD MET A 36 -6.915 6.861 -6.037 1.00 0.00 S ATOM 554 CE MET A 36 -6.961 7.852 -4.551 1.00 0.00 C ATOM 0 H MET A 36 -9.990 4.700 -2.236 1.00 0.00 H new ATOM 0 HA MET A 36 -8.736 3.031 -4.303 1.00 0.00 H new ATOM 0 HB2 MET A 36 -9.337 5.038 -5.492 1.00 0.00 H new ATOM 0 HB3 MET A 36 -8.835 6.062 -4.161 1.00 0.00 H new ATOM 0 HG2 MET A 36 -6.469 5.062 -4.533 1.00 0.00 H new ATOM 0 HG3 MET A 36 -7.095 4.481 -6.064 1.00 0.00 H new ATOM 0 HE1 MET A 36 -6.552 8.840 -4.760 1.00 0.00 H new ATOM 0 HE2 MET A 36 -7.992 7.950 -4.211 1.00 0.00 H new ATOM 0 HE3 MET A 36 -6.367 7.371 -3.774 1.00 0.00 H new ATOM 564 N VAL A 37 -6.646 3.061 -2.956 1.00 0.00 N ATOM 565 CA VAL A 37 -5.421 3.010 -2.166 1.00 0.00 C ATOM 566 C VAL A 37 -4.236 3.412 -3.020 1.00 0.00 C ATOM 567 O VAL A 37 -4.258 3.194 -4.225 1.00 0.00 O ATOM 568 CB VAL A 37 -5.163 1.600 -1.615 1.00 0.00 C ATOM 569 CG1 VAL A 37 -5.893 1.391 -0.318 1.00 0.00 C ATOM 570 CG2 VAL A 37 -5.589 0.554 -2.630 1.00 0.00 C ATOM 0 H VAL A 37 -6.710 2.335 -3.670 1.00 0.00 H new ATOM 0 HA VAL A 37 -5.544 3.701 -1.332 1.00 0.00 H new ATOM 0 HB VAL A 37 -4.094 1.497 -1.427 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -5.695 0.385 0.053 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -5.550 2.122 0.414 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -6.964 1.514 -0.479 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -5.401 -0.441 -2.227 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -6.652 0.665 -2.842 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -5.020 0.687 -3.550 1.00 0.00 H new ATOM 580 N PHE A 38 -3.220 4.011 -2.410 1.00 0.00 N ATOM 581 CA PHE A 38 -1.996 4.325 -3.118 1.00 0.00 C ATOM 582 C PHE A 38 -0.783 4.160 -2.197 1.00 0.00 C ATOM 583 O PHE A 38 -0.731 4.709 -1.095 1.00 0.00 O ATOM 584 CB PHE A 38 -2.093 5.743 -3.753 1.00 0.00 C ATOM 585 CG PHE A 38 -2.032 6.912 -2.809 1.00 0.00 C ATOM 586 CD1 PHE A 38 -0.813 7.415 -2.400 1.00 0.00 C ATOM 587 CD2 PHE A 38 -3.191 7.535 -2.374 1.00 0.00 C ATOM 588 CE1 PHE A 38 -0.741 8.511 -1.570 1.00 0.00 C ATOM 589 CE2 PHE A 38 -3.131 8.631 -1.538 1.00 0.00 C ATOM 590 CZ PHE A 38 -1.906 9.123 -1.135 1.00 0.00 C ATOM 0 H PHE A 38 -3.224 4.287 -1.428 1.00 0.00 H new ATOM 0 HA PHE A 38 -1.857 3.620 -3.938 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -1.285 5.848 -4.477 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -3.028 5.803 -4.309 1.00 0.00 H new ATOM 0 HD1 PHE A 38 0.098 6.942 -2.736 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -4.152 7.158 -2.693 1.00 0.00 H new ATOM 0 HE1 PHE A 38 0.220 8.893 -1.259 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -4.041 9.103 -1.199 1.00 0.00 H new ATOM 0 HZ PHE A 38 -1.855 9.982 -0.483 1.00 0.00 H new ATOM 600 N VAL A 39 0.146 3.321 -2.644 1.00 0.00 N ATOM 601 CA VAL A 39 1.399 3.068 -1.953 1.00 0.00 C ATOM 602 C VAL A 39 2.547 3.688 -2.745 1.00 0.00 C ATOM 603 O VAL A 39 2.545 3.641 -3.977 1.00 0.00 O ATOM 604 CB VAL A 39 1.627 1.554 -1.801 1.00 0.00 C ATOM 605 CG1 VAL A 39 0.764 1.016 -0.681 1.00 0.00 C ATOM 606 CG2 VAL A 39 1.294 0.847 -3.091 1.00 0.00 C ATOM 0 H VAL A 39 0.045 2.791 -3.510 1.00 0.00 H new ATOM 0 HA VAL A 39 1.357 3.516 -0.960 1.00 0.00 H new ATOM 0 HB VAL A 39 2.676 1.376 -1.562 1.00 0.00 H new ATOM 0 HG11 VAL A 39 0.929 -0.056 -0.577 1.00 0.00 H new ATOM 0 HG12 VAL A 39 1.026 1.515 0.252 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -0.286 1.201 -0.909 1.00 0.00 H new ATOM 0 HG21 VAL A 39 1.459 -0.224 -2.972 1.00 0.00 H new ATOM 0 HG22 VAL A 39 0.250 1.027 -3.346 1.00 0.00 H new ATOM 0 HG23 VAL A 39 1.933 1.226 -3.889 1.00 0.00 H new ATOM 616 N ARG A 40 3.511 4.280 -2.054 1.00 0.00 N ATOM 617 CA ARG A 40 4.595 5.002 -2.716 1.00 0.00 C ATOM 618 C ARG A 40 5.624 5.465 -1.692 1.00 0.00 C ATOM 619 O ARG A 40 5.557 5.076 -0.537 1.00 0.00 O ATOM 620 CB ARG A 40 4.059 6.223 -3.470 1.00 0.00 C ATOM 621 CG ARG A 40 3.519 7.303 -2.545 1.00 0.00 C ATOM 622 CD ARG A 40 3.442 8.651 -3.238 1.00 0.00 C ATOM 623 NE ARG A 40 3.257 9.733 -2.278 1.00 0.00 N ATOM 624 CZ ARG A 40 3.662 10.982 -2.485 1.00 0.00 C ATOM 625 NH1 ARG A 40 4.185 11.328 -3.657 1.00 0.00 N ATOM 626 NH2 ARG A 40 3.531 11.884 -1.520 1.00 0.00 N ATOM 0 H ARG A 40 3.567 4.276 -1.036 1.00 0.00 H new ATOM 0 HA ARG A 40 5.063 4.321 -3.427 1.00 0.00 H new ATOM 0 HB2 ARG A 40 4.856 6.643 -4.083 1.00 0.00 H new ATOM 0 HB3 ARG A 40 3.268 5.905 -4.149 1.00 0.00 H new ATOM 0 HG2 ARG A 40 2.528 7.018 -2.193 1.00 0.00 H new ATOM 0 HG3 ARG A 40 4.159 7.382 -1.666 1.00 0.00 H new ATOM 0 HD2 ARG A 40 4.355 8.821 -3.809 1.00 0.00 H new ATOM 0 HD3 ARG A 40 2.617 8.649 -3.950 1.00 0.00 H new ATOM 0 HE ARG A 40 2.790 9.519 -1.397 1.00 0.00 H new ATOM 0 HH11 ARG A 40 4.276 10.635 -4.399 1.00 0.00 H new ATOM 0 HH12 ARG A 40 4.495 12.287 -3.814 1.00 0.00 H new ATOM 0 HH21 ARG A 40 3.121 11.617 -0.625 1.00 0.00 H new ATOM 0 HH22 ARG A 40 3.840 12.844 -1.674 1.00 0.00 H new ATOM 640 N GLY A 41 6.593 6.259 -2.132 1.00 0.00 N ATOM 641 CA GLY A 41 7.519 6.895 -1.206 1.00 0.00 C ATOM 642 C GLY A 41 7.088 8.316 -0.892 1.00 0.00 C ATOM 643 O GLY A 41 6.144 8.809 -1.504 1.00 0.00 O ATOM 0 H GLY A 41 6.756 6.476 -3.115 1.00 0.00 H new ATOM 0 HA2 GLY A 41 7.572 6.316 -0.284 1.00 0.00 H new ATOM 0 HA3 GLY A 41 8.521 6.902 -1.636 1.00 0.00 H new ATOM 647 N PRO A 42 7.761 9.024 0.027 1.00 0.00 N ATOM 648 CA PRO A 42 7.363 10.363 0.411 1.00 0.00 C ATOM 649 C PRO A 42 7.942 11.422 -0.520 1.00 0.00 C ATOM 650 O PRO A 42 8.718 11.104 -1.428 1.00 0.00 O ATOM 651 CB PRO A 42 7.909 10.497 1.835 1.00 0.00 C ATOM 652 CG PRO A 42 9.085 9.573 1.894 1.00 0.00 C ATOM 653 CD PRO A 42 8.974 8.605 0.745 1.00 0.00 C ATOM 0 HA PRO A 42 6.285 10.514 0.353 1.00 0.00 H new ATOM 0 HB2 PRO A 42 8.205 11.524 2.048 1.00 0.00 H new ATOM 0 HB3 PRO A 42 7.155 10.222 2.573 1.00 0.00 H new ATOM 0 HG2 PRO A 42 10.016 10.136 1.829 1.00 0.00 H new ATOM 0 HG3 PRO A 42 9.102 9.038 2.843 1.00 0.00 H new ATOM 0 HD2 PRO A 42 9.852 8.651 0.101 1.00 0.00 H new ATOM 0 HD3 PRO A 42 8.891 7.577 1.098 1.00 0.00 H new ATOM 661 N GLU A 43 7.536 12.664 -0.290 1.00 0.00 N ATOM 662 CA GLU A 43 7.881 13.800 -1.144 1.00 0.00 C ATOM 663 C GLU A 43 9.328 13.776 -1.651 1.00 0.00 C ATOM 664 O GLU A 43 10.280 13.710 -0.871 1.00 0.00 O ATOM 665 CB GLU A 43 7.623 15.098 -0.387 1.00 0.00 C ATOM 666 CG GLU A 43 6.162 15.310 -0.046 1.00 0.00 C ATOM 667 CD GLU A 43 5.295 15.382 -1.284 1.00 0.00 C ATOM 668 OE1 GLU A 43 5.362 16.403 -1.998 1.00 0.00 O ATOM 669 OE2 GLU A 43 4.547 14.420 -1.553 1.00 0.00 O ATOM 0 H GLU A 43 6.950 12.917 0.505 1.00 0.00 H new ATOM 0 HA GLU A 43 7.246 13.731 -2.028 1.00 0.00 H new ATOM 0 HB2 GLU A 43 8.208 15.097 0.533 1.00 0.00 H new ATOM 0 HB3 GLU A 43 7.975 15.937 -0.987 1.00 0.00 H new ATOM 0 HG2 GLU A 43 5.817 14.496 0.591 1.00 0.00 H new ATOM 0 HG3 GLU A 43 6.053 16.231 0.527 1.00 0.00 H new ATOM 676 N HIS A 44 9.451 13.790 -2.982 1.00 0.00 N ATOM 677 CA HIS A 44 10.726 13.958 -3.698 1.00 0.00 C ATOM 678 C HIS A 44 11.533 12.665 -3.796 1.00 0.00 C ATOM 679 O HIS A 44 12.379 12.529 -4.680 1.00 0.00 O ATOM 680 CB HIS A 44 11.588 15.073 -3.088 1.00 0.00 C ATOM 681 CG HIS A 44 11.020 16.446 -3.289 1.00 0.00 C ATOM 682 ND1 HIS A 44 10.701 16.951 -4.529 1.00 0.00 N ATOM 683 CD2 HIS A 44 10.695 17.414 -2.401 1.00 0.00 C ATOM 684 CE1 HIS A 44 10.201 18.162 -4.395 1.00 0.00 C ATOM 685 NE2 HIS A 44 10.183 18.470 -3.113 1.00 0.00 N ATOM 0 H HIS A 44 8.652 13.683 -3.607 1.00 0.00 H new ATOM 0 HA HIS A 44 10.450 14.248 -4.712 1.00 0.00 H new ATOM 0 HB2 HIS A 44 11.703 14.889 -2.020 1.00 0.00 H new ATOM 0 HB3 HIS A 44 12.585 15.033 -3.528 1.00 0.00 H new ATOM 0 HD2 HIS A 44 10.816 17.365 -1.329 1.00 0.00 H new ATOM 0 HE1 HIS A 44 9.862 18.797 -5.200 1.00 0.00 H new ATOM 0 HE2 HIS A 44 9.845 19.347 -2.716 1.00 0.00 H new ATOM 694 N SER A 45 11.281 11.716 -2.914 1.00 0.00 N ATOM 695 CA SER A 45 12.014 10.460 -2.943 1.00 0.00 C ATOM 696 C SER A 45 11.279 9.398 -3.749 1.00 0.00 C ATOM 697 O SER A 45 10.175 8.973 -3.399 1.00 0.00 O ATOM 698 CB SER A 45 12.298 9.972 -1.526 1.00 0.00 C ATOM 699 OG SER A 45 11.300 10.416 -0.621 1.00 0.00 O ATOM 0 H SER A 45 10.582 11.787 -2.175 1.00 0.00 H new ATOM 0 HA SER A 45 12.966 10.643 -3.442 1.00 0.00 H new ATOM 0 HB2 SER A 45 12.343 8.883 -1.516 1.00 0.00 H new ATOM 0 HB3 SER A 45 13.274 10.335 -1.202 1.00 0.00 H new ATOM 0 HG SER A 45 10.417 10.317 -1.034 1.00 0.00 H new ATOM 705 N ASN A 46 11.903 9.013 -4.850 1.00 0.00 N ATOM 706 CA ASN A 46 11.438 7.910 -5.678 1.00 0.00 C ATOM 707 C ASN A 46 11.523 6.607 -4.895 1.00 0.00 C ATOM 708 O ASN A 46 12.422 6.429 -4.080 1.00 0.00 O ATOM 709 CB ASN A 46 12.341 7.791 -6.926 1.00 0.00 C ATOM 710 CG ASN A 46 13.802 7.599 -6.559 1.00 0.00 C ATOM 711 OD1 ASN A 46 14.595 8.522 -6.702 1.00 0.00 O ATOM 712 ND2 ASN A 46 14.177 6.432 -6.047 1.00 0.00 N ATOM 0 H ASN A 46 12.752 9.459 -5.197 1.00 0.00 H new ATOM 0 HA ASN A 46 10.406 8.098 -5.974 1.00 0.00 H new ATOM 0 HB2 ASN A 46 12.007 6.951 -7.535 1.00 0.00 H new ATOM 0 HB3 ASN A 46 12.236 8.688 -7.536 1.00 0.00 H new ATOM 0 HD21 ASN A 46 15.146 6.288 -5.762 1.00 0.00 H new ATOM 0 HD22 ASN A 46 13.496 5.680 -5.939 1.00 0.00 H new ATOM 719 N ILE A 47 10.576 5.711 -5.089 1.00 0.00 N ATOM 720 CA ILE A 47 10.772 4.352 -4.628 1.00 0.00 C ATOM 721 C ILE A 47 11.198 3.419 -5.748 1.00 0.00 C ATOM 722 O ILE A 47 11.901 2.462 -5.495 1.00 0.00 O ATOM 723 CB ILE A 47 9.561 3.758 -3.919 1.00 0.00 C ATOM 724 CG1 ILE A 47 8.370 3.615 -4.846 1.00 0.00 C ATOM 725 CG2 ILE A 47 9.216 4.601 -2.722 1.00 0.00 C ATOM 726 CD1 ILE A 47 7.235 2.863 -4.199 1.00 0.00 C ATOM 0 H ILE A 47 9.685 5.892 -5.551 1.00 0.00 H new ATOM 0 HA ILE A 47 11.576 4.434 -3.897 1.00 0.00 H new ATOM 0 HB ILE A 47 9.820 2.752 -3.589 1.00 0.00 H new ATOM 0 HG12 ILE A 47 8.024 4.604 -5.147 1.00 0.00 H new ATOM 0 HG13 ILE A 47 8.678 3.096 -5.753 1.00 0.00 H new ATOM 0 HG21 ILE A 47 8.350 4.176 -2.215 1.00 0.00 H new ATOM 0 HG22 ILE A 47 10.063 4.623 -2.036 1.00 0.00 H new ATOM 0 HG23 ILE A 47 8.985 5.616 -3.046 1.00 0.00 H new ATOM 0 HD11 ILE A 47 6.404 2.785 -4.900 1.00 0.00 H new ATOM 0 HD12 ILE A 47 7.571 1.864 -3.922 1.00 0.00 H new ATOM 0 HD13 ILE A 47 6.908 3.396 -3.306 1.00 0.00 H new ATOM 738 N GLN A 48 10.791 3.719 -6.985 1.00 0.00 N ATOM 739 CA GLN A 48 11.024 2.840 -8.141 1.00 0.00 C ATOM 740 C GLN A 48 12.506 2.481 -8.314 1.00 0.00 C ATOM 741 O GLN A 48 12.855 1.551 -9.040 1.00 0.00 O ATOM 742 CB GLN A 48 10.474 3.521 -9.407 1.00 0.00 C ATOM 743 CG GLN A 48 10.703 2.759 -10.708 1.00 0.00 C ATOM 744 CD GLN A 48 9.964 1.436 -10.778 1.00 0.00 C ATOM 745 OE1 GLN A 48 10.432 0.489 -11.408 1.00 0.00 O ATOM 746 NE2 GLN A 48 8.797 1.364 -10.161 1.00 0.00 N ATOM 0 H GLN A 48 10.291 4.577 -7.216 1.00 0.00 H new ATOM 0 HA GLN A 48 10.500 1.900 -7.967 1.00 0.00 H new ATOM 0 HB2 GLN A 48 9.403 3.676 -9.280 1.00 0.00 H new ATOM 0 HB3 GLN A 48 10.931 4.507 -9.497 1.00 0.00 H new ATOM 0 HG2 GLN A 48 10.391 3.384 -11.545 1.00 0.00 H new ATOM 0 HG3 GLN A 48 11.771 2.575 -10.828 1.00 0.00 H new ATOM 0 HE21 GLN A 48 8.441 2.170 -9.648 1.00 0.00 H new ATOM 0 HE22 GLN A 48 8.253 0.502 -10.198 1.00 0.00 H new ATOM 755 N HIS A 49 13.375 3.197 -7.624 1.00 0.00 N ATOM 756 CA HIS A 49 14.798 2.899 -7.667 1.00 0.00 C ATOM 757 C HIS A 49 15.126 1.724 -6.749 1.00 0.00 C ATOM 758 O HIS A 49 15.962 0.891 -7.085 1.00 0.00 O ATOM 759 CB HIS A 49 15.637 4.126 -7.292 1.00 0.00 C ATOM 760 CG HIS A 49 15.928 5.044 -8.449 1.00 0.00 C ATOM 761 ND1 HIS A 49 16.502 4.620 -9.625 1.00 0.00 N ATOM 762 CD2 HIS A 49 15.702 6.371 -8.605 1.00 0.00 C ATOM 763 CE1 HIS A 49 16.612 5.644 -10.454 1.00 0.00 C ATOM 764 NE2 HIS A 49 16.135 6.715 -9.856 1.00 0.00 N ATOM 0 H HIS A 49 13.123 3.986 -7.029 1.00 0.00 H new ATOM 0 HA HIS A 49 15.051 2.623 -8.691 1.00 0.00 H new ATOM 0 HB2 HIS A 49 15.115 4.688 -6.518 1.00 0.00 H new ATOM 0 HB3 HIS A 49 16.580 3.791 -6.861 1.00 0.00 H new ATOM 0 HD2 HIS A 49 15.261 7.035 -7.876 1.00 0.00 H new ATOM 0 HE1 HIS A 49 17.023 5.608 -11.452 1.00 0.00 H new ATOM 0 HE2 HIS A 49 16.095 7.651 -10.260 1.00 0.00 H new ATOM 773 N PHE A 50 14.445 1.634 -5.607 1.00 0.00 N ATOM 774 CA PHE A 50 14.704 0.555 -4.662 1.00 0.00 C ATOM 775 C PHE A 50 13.497 -0.379 -4.543 1.00 0.00 C ATOM 776 O PHE A 50 13.545 -1.397 -3.850 1.00 0.00 O ATOM 777 CB PHE A 50 15.125 1.111 -3.293 1.00 0.00 C ATOM 778 CG PHE A 50 14.143 2.037 -2.629 1.00 0.00 C ATOM 779 CD1 PHE A 50 13.087 1.548 -1.874 1.00 0.00 C ATOM 780 CD2 PHE A 50 14.302 3.408 -2.735 1.00 0.00 C ATOM 781 CE1 PHE A 50 12.211 2.407 -1.249 1.00 0.00 C ATOM 782 CE2 PHE A 50 13.423 4.272 -2.112 1.00 0.00 C ATOM 783 CZ PHE A 50 12.375 3.771 -1.369 1.00 0.00 C ATOM 0 H PHE A 50 13.718 2.289 -5.318 1.00 0.00 H new ATOM 0 HA PHE A 50 15.535 -0.036 -5.047 1.00 0.00 H new ATOM 0 HB2 PHE A 50 15.313 0.271 -2.624 1.00 0.00 H new ATOM 0 HB3 PHE A 50 16.070 1.641 -3.413 1.00 0.00 H new ATOM 0 HD1 PHE A 50 12.950 0.481 -1.775 1.00 0.00 H new ATOM 0 HD2 PHE A 50 15.123 3.807 -3.312 1.00 0.00 H new ATOM 0 HE1 PHE A 50 11.394 2.012 -0.664 1.00 0.00 H new ATOM 0 HE2 PHE A 50 13.556 5.340 -2.207 1.00 0.00 H new ATOM 0 HZ PHE A 50 11.685 4.445 -0.883 1.00 0.00 H new ATOM 793 N VAL A 51 12.437 -0.038 -5.260 1.00 0.00 N ATOM 794 CA VAL A 51 11.193 -0.789 -5.250 1.00 0.00 C ATOM 795 C VAL A 51 10.857 -1.226 -6.670 1.00 0.00 C ATOM 796 O VAL A 51 11.008 -0.453 -7.615 1.00 0.00 O ATOM 797 CB VAL A 51 10.049 0.065 -4.650 1.00 0.00 C ATOM 798 CG1 VAL A 51 8.685 -0.565 -4.890 1.00 0.00 C ATOM 799 CG2 VAL A 51 10.273 0.256 -3.158 1.00 0.00 C ATOM 0 H VAL A 51 12.417 0.778 -5.872 1.00 0.00 H new ATOM 0 HA VAL A 51 11.310 -1.674 -4.625 1.00 0.00 H new ATOM 0 HB VAL A 51 10.061 1.032 -5.152 1.00 0.00 H new ATOM 0 HG11 VAL A 51 7.911 0.066 -4.453 1.00 0.00 H new ATOM 0 HG12 VAL A 51 8.512 -0.662 -5.962 1.00 0.00 H new ATOM 0 HG13 VAL A 51 8.653 -1.551 -4.427 1.00 0.00 H new ATOM 0 HG21 VAL A 51 9.464 0.858 -2.743 1.00 0.00 H new ATOM 0 HG22 VAL A 51 10.292 -0.716 -2.665 1.00 0.00 H new ATOM 0 HG23 VAL A 51 11.224 0.764 -2.995 1.00 0.00 H new ATOM 809 N GLU A 52 10.441 -2.475 -6.819 1.00 0.00 N ATOM 810 CA GLU A 52 10.210 -3.046 -8.138 1.00 0.00 C ATOM 811 C GLU A 52 8.722 -3.121 -8.457 1.00 0.00 C ATOM 812 O GLU A 52 8.237 -2.459 -9.373 1.00 0.00 O ATOM 813 CB GLU A 52 10.832 -4.440 -8.226 1.00 0.00 C ATOM 814 CG GLU A 52 10.664 -5.093 -9.586 1.00 0.00 C ATOM 815 CD GLU A 52 11.379 -6.420 -9.686 1.00 0.00 C ATOM 816 OE1 GLU A 52 12.588 -6.422 -9.992 1.00 0.00 O ATOM 817 OE2 GLU A 52 10.739 -7.469 -9.464 1.00 0.00 O ATOM 0 H GLU A 52 10.257 -3.112 -6.044 1.00 0.00 H new ATOM 0 HA GLU A 52 10.682 -2.393 -8.872 1.00 0.00 H new ATOM 0 HB2 GLU A 52 11.895 -4.370 -7.994 1.00 0.00 H new ATOM 0 HB3 GLU A 52 10.381 -5.079 -7.467 1.00 0.00 H new ATOM 0 HG2 GLU A 52 9.603 -5.241 -9.785 1.00 0.00 H new ATOM 0 HG3 GLU A 52 11.043 -4.422 -10.357 1.00 0.00 H new ATOM 824 N LYS A 53 8.003 -3.936 -7.702 1.00 0.00 N ATOM 825 CA LYS A 53 6.586 -4.142 -7.938 1.00 0.00 C ATOM 826 C LYS A 53 5.817 -4.030 -6.632 1.00 0.00 C ATOM 827 O LYS A 53 6.409 -3.908 -5.566 1.00 0.00 O ATOM 828 CB LYS A 53 6.351 -5.508 -8.593 1.00 0.00 C ATOM 829 CG LYS A 53 6.921 -6.682 -7.808 1.00 0.00 C ATOM 830 CD LYS A 53 6.621 -8.019 -8.474 1.00 0.00 C ATOM 831 CE LYS A 53 5.131 -8.292 -8.557 1.00 0.00 C ATOM 832 NZ LYS A 53 4.847 -9.519 -9.345 1.00 0.00 N ATOM 0 H LYS A 53 8.381 -4.467 -6.917 1.00 0.00 H new ATOM 0 HA LYS A 53 6.224 -3.370 -8.617 1.00 0.00 H new ATOM 0 HB2 LYS A 53 5.279 -5.657 -8.722 1.00 0.00 H new ATOM 0 HB3 LYS A 53 6.794 -5.502 -9.589 1.00 0.00 H new ATOM 0 HG2 LYS A 53 8.000 -6.561 -7.709 1.00 0.00 H new ATOM 0 HG3 LYS A 53 6.506 -6.679 -6.800 1.00 0.00 H new ATOM 0 HD2 LYS A 53 7.047 -8.028 -9.477 1.00 0.00 H new ATOM 0 HD3 LYS A 53 7.105 -8.819 -7.915 1.00 0.00 H new ATOM 0 HE2 LYS A 53 4.723 -8.401 -7.552 1.00 0.00 H new ATOM 0 HE3 LYS A 53 4.628 -7.440 -9.014 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 3.820 -9.677 -9.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 5.215 -9.404 -10.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 5.307 -10.335 -8.894 1.00 0.00 H new ATOM 846 N VAL A 54 4.504 -4.077 -6.724 1.00 0.00 N ATOM 847 CA VAL A 54 3.639 -3.881 -5.573 1.00 0.00 C ATOM 848 C VAL A 54 2.386 -4.734 -5.716 1.00 0.00 C ATOM 849 O VAL A 54 1.968 -5.038 -6.834 1.00 0.00 O ATOM 850 CB VAL A 54 3.275 -2.386 -5.430 1.00 0.00 C ATOM 851 CG1 VAL A 54 1.960 -2.166 -4.699 1.00 0.00 C ATOM 852 CG2 VAL A 54 4.389 -1.669 -4.696 1.00 0.00 C ATOM 0 H VAL A 54 4.005 -4.252 -7.596 1.00 0.00 H new ATOM 0 HA VAL A 54 4.166 -4.191 -4.670 1.00 0.00 H new ATOM 0 HB VAL A 54 3.153 -1.984 -6.436 1.00 0.00 H new ATOM 0 HG11 VAL A 54 1.757 -1.097 -4.629 1.00 0.00 H new ATOM 0 HG12 VAL A 54 1.153 -2.653 -5.247 1.00 0.00 H new ATOM 0 HG13 VAL A 54 2.026 -2.589 -3.697 1.00 0.00 H new ATOM 0 HG21 VAL A 54 4.136 -0.614 -4.593 1.00 0.00 H new ATOM 0 HG22 VAL A 54 4.516 -2.110 -3.707 1.00 0.00 H new ATOM 0 HG23 VAL A 54 5.317 -1.767 -5.259 1.00 0.00 H new ATOM 862 N VAL A 55 1.799 -5.130 -4.594 1.00 0.00 N ATOM 863 CA VAL A 55 0.635 -5.997 -4.616 1.00 0.00 C ATOM 864 C VAL A 55 -0.340 -5.623 -3.500 1.00 0.00 C ATOM 865 O VAL A 55 0.064 -5.161 -2.429 1.00 0.00 O ATOM 866 CB VAL A 55 1.056 -7.485 -4.509 1.00 0.00 C ATOM 867 CG1 VAL A 55 0.491 -8.151 -3.268 1.00 0.00 C ATOM 868 CG2 VAL A 55 0.639 -8.245 -5.754 1.00 0.00 C ATOM 0 H VAL A 55 2.111 -4.864 -3.660 1.00 0.00 H new ATOM 0 HA VAL A 55 0.125 -5.859 -5.569 1.00 0.00 H new ATOM 0 HB VAL A 55 2.142 -7.509 -4.424 1.00 0.00 H new ATOM 0 HG11 VAL A 55 0.812 -9.192 -3.236 1.00 0.00 H new ATOM 0 HG12 VAL A 55 0.852 -7.632 -2.380 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -0.598 -8.108 -3.296 1.00 0.00 H new ATOM 0 HG21 VAL A 55 0.942 -9.288 -5.662 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -0.444 -8.191 -5.868 1.00 0.00 H new ATOM 0 HG23 VAL A 55 1.118 -7.803 -6.628 1.00 0.00 H new ATOM 878 N PHE A 56 -1.622 -5.802 -3.774 1.00 0.00 N ATOM 879 CA PHE A 56 -2.671 -5.533 -2.806 1.00 0.00 C ATOM 880 C PHE A 56 -3.488 -6.786 -2.584 1.00 0.00 C ATOM 881 O PHE A 56 -3.816 -7.478 -3.534 1.00 0.00 O ATOM 882 CB PHE A 56 -3.582 -4.399 -3.293 1.00 0.00 C ATOM 883 CG PHE A 56 -3.013 -3.036 -3.069 1.00 0.00 C ATOM 884 CD1 PHE A 56 -1.987 -2.559 -3.868 1.00 0.00 C ATOM 885 CD2 PHE A 56 -3.505 -2.231 -2.059 1.00 0.00 C ATOM 886 CE1 PHE A 56 -1.461 -1.305 -3.662 1.00 0.00 C ATOM 887 CE2 PHE A 56 -2.981 -0.973 -1.850 1.00 0.00 C ATOM 888 CZ PHE A 56 -1.958 -0.512 -2.653 1.00 0.00 C ATOM 0 H PHE A 56 -1.964 -6.138 -4.674 1.00 0.00 H new ATOM 0 HA PHE A 56 -2.209 -5.225 -1.868 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -3.776 -4.532 -4.357 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -4.542 -4.471 -2.782 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -1.596 -3.179 -4.661 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -4.306 -2.590 -1.429 1.00 0.00 H new ATOM 0 HE1 PHE A 56 -0.660 -0.944 -4.290 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -3.371 -0.349 -1.059 1.00 0.00 H new ATOM 0 HZ PHE A 56 -1.547 0.473 -2.489 1.00 0.00 H new ATOM 898 N HIS A 57 -3.790 -7.096 -1.337 1.00 0.00 N ATOM 899 CA HIS A 57 -4.641 -8.238 -1.028 1.00 0.00 C ATOM 900 C HIS A 57 -5.954 -7.744 -0.451 1.00 0.00 C ATOM 901 O HIS A 57 -6.107 -7.651 0.768 1.00 0.00 O ATOM 902 CB HIS A 57 -3.973 -9.178 -0.018 1.00 0.00 C ATOM 903 CG HIS A 57 -2.657 -9.742 -0.459 1.00 0.00 C ATOM 904 ND1 HIS A 57 -2.472 -11.073 -0.749 1.00 0.00 N ATOM 905 CD2 HIS A 57 -1.446 -9.155 -0.621 1.00 0.00 C ATOM 906 CE1 HIS A 57 -1.210 -11.280 -1.066 1.00 0.00 C ATOM 907 NE2 HIS A 57 -0.562 -10.135 -0.995 1.00 0.00 N ATOM 0 H HIS A 57 -3.462 -6.578 -0.522 1.00 0.00 H new ATOM 0 HA HIS A 57 -4.813 -8.792 -1.951 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -3.826 -8.638 0.917 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -4.653 -10.003 0.194 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -1.219 -8.108 -0.481 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -0.778 -12.231 -1.339 1.00 0.00 H new ATOM 0 HE2 HIS A 57 0.431 -10.000 -1.186 1.00 0.00 H new ATOM 916 N LEU A 58 -6.891 -7.407 -1.322 1.00 0.00 N ATOM 917 CA LEU A 58 -8.197 -6.932 -0.875 1.00 0.00 C ATOM 918 C LEU A 58 -8.974 -8.093 -0.250 1.00 0.00 C ATOM 919 O LEU A 58 -8.460 -9.209 -0.155 1.00 0.00 O ATOM 920 CB LEU A 58 -9.010 -6.325 -2.030 1.00 0.00 C ATOM 921 CG LEU A 58 -8.216 -5.618 -3.127 1.00 0.00 C ATOM 922 CD1 LEU A 58 -9.164 -4.973 -4.099 1.00 0.00 C ATOM 923 CD2 LEU A 58 -7.240 -4.596 -2.557 1.00 0.00 C ATOM 0 H LEU A 58 -6.777 -7.452 -2.335 1.00 0.00 H new ATOM 0 HA LEU A 58 -8.035 -6.147 -0.136 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -9.594 -7.122 -2.491 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -9.720 -5.612 -1.610 1.00 0.00 H new ATOM 0 HG LEU A 58 -7.618 -6.365 -3.649 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -8.596 -4.469 -4.881 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -9.801 -5.736 -4.547 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -9.784 -4.246 -3.575 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -6.697 -4.118 -3.372 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -7.790 -3.841 -1.995 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -6.534 -5.097 -1.895 1.00 0.00 H new ATOM 935 N HIS A 59 -10.203 -7.842 0.167 1.00 0.00 N ATOM 936 CA HIS A 59 -11.009 -8.882 0.798 1.00 0.00 C ATOM 937 C HIS A 59 -11.496 -9.874 -0.249 1.00 0.00 C ATOM 938 O HIS A 59 -11.719 -9.522 -1.401 1.00 0.00 O ATOM 939 CB HIS A 59 -12.184 -8.263 1.552 1.00 0.00 C ATOM 940 CG HIS A 59 -12.270 -8.695 2.984 1.00 0.00 C ATOM 941 ND1 HIS A 59 -13.445 -9.084 3.582 1.00 0.00 N ATOM 942 CD2 HIS A 59 -11.318 -8.779 3.944 1.00 0.00 C ATOM 943 CE1 HIS A 59 -13.217 -9.386 4.845 1.00 0.00 C ATOM 944 NE2 HIS A 59 -11.933 -9.211 5.091 1.00 0.00 N ATOM 0 H HIS A 59 -10.665 -6.936 0.083 1.00 0.00 H new ATOM 0 HA HIS A 59 -10.391 -9.418 1.518 1.00 0.00 H new ATOM 0 HB2 HIS A 59 -12.099 -7.177 1.513 1.00 0.00 H new ATOM 0 HB3 HIS A 59 -13.111 -8.528 1.044 1.00 0.00 H new ATOM 0 HD2 HIS A 59 -10.269 -8.549 3.828 1.00 0.00 H new ATOM 0 HE1 HIS A 59 -13.957 -9.720 5.558 1.00 0.00 H new ATOM 0 HE2 HIS A 59 -11.473 -9.371 5.987 1.00 0.00 H new ATOM 953 N GLU A 60 -11.641 -11.118 0.185 1.00 0.00 N ATOM 954 CA GLU A 60 -11.880 -12.259 -0.706 1.00 0.00 C ATOM 955 C GLU A 60 -13.133 -12.102 -1.563 1.00 0.00 C ATOM 956 O GLU A 60 -13.201 -12.660 -2.660 1.00 0.00 O ATOM 957 CB GLU A 60 -11.982 -13.549 0.105 1.00 0.00 C ATOM 958 CG GLU A 60 -10.707 -13.910 0.847 1.00 0.00 C ATOM 959 CD GLU A 60 -9.522 -14.081 -0.078 1.00 0.00 C ATOM 960 OE1 GLU A 60 -9.543 -15.009 -0.912 1.00 0.00 O ATOM 961 OE2 GLU A 60 -8.561 -13.288 0.025 1.00 0.00 O ATOM 0 H GLU A 60 -11.597 -11.372 1.172 1.00 0.00 H new ATOM 0 HA GLU A 60 -11.028 -12.301 -1.384 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -12.795 -13.451 0.825 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -12.246 -14.368 -0.564 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -10.484 -13.132 1.577 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -10.865 -14.834 1.404 1.00 0.00 H new ATOM 968 N SER A 61 -14.124 -11.373 -1.060 1.00 0.00 N ATOM 969 CA SER A 61 -15.354 -11.137 -1.810 1.00 0.00 C ATOM 970 C SER A 61 -15.071 -10.277 -3.040 1.00 0.00 C ATOM 971 O SER A 61 -15.764 -10.378 -4.055 1.00 0.00 O ATOM 972 CB SER A 61 -16.403 -10.463 -0.919 1.00 0.00 C ATOM 973 OG SER A 61 -17.635 -10.287 -1.602 1.00 0.00 O ATOM 0 H SER A 61 -14.100 -10.936 -0.139 1.00 0.00 H new ATOM 0 HA SER A 61 -15.746 -12.098 -2.141 1.00 0.00 H new ATOM 0 HB2 SER A 61 -16.565 -11.067 -0.026 1.00 0.00 H new ATOM 0 HB3 SER A 61 -16.030 -9.495 -0.586 1.00 0.00 H new ATOM 0 HG SER A 61 -18.282 -9.856 -1.005 1.00 0.00 H new ATOM 979 N PHE A 62 -14.034 -9.452 -2.951 1.00 0.00 N ATOM 980 CA PHE A 62 -13.642 -8.593 -4.056 1.00 0.00 C ATOM 981 C PHE A 62 -13.065 -9.445 -5.180 1.00 0.00 C ATOM 982 O PHE A 62 -12.230 -10.316 -4.934 1.00 0.00 O ATOM 983 CB PHE A 62 -12.608 -7.559 -3.592 1.00 0.00 C ATOM 984 CG PHE A 62 -13.141 -6.545 -2.611 1.00 0.00 C ATOM 985 CD1 PHE A 62 -13.458 -6.908 -1.313 1.00 0.00 C ATOM 986 CD2 PHE A 62 -13.316 -5.225 -2.989 1.00 0.00 C ATOM 987 CE1 PHE A 62 -13.941 -5.976 -0.414 1.00 0.00 C ATOM 988 CE2 PHE A 62 -13.799 -4.287 -2.095 1.00 0.00 C ATOM 989 CZ PHE A 62 -14.112 -4.663 -0.806 1.00 0.00 C ATOM 0 H PHE A 62 -13.449 -9.362 -2.120 1.00 0.00 H new ATOM 0 HA PHE A 62 -14.520 -8.059 -4.420 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -11.768 -8.082 -3.135 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -12.220 -7.034 -4.465 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -13.326 -7.933 -0.999 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -13.072 -4.923 -3.997 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -14.185 -6.275 0.595 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -13.931 -3.261 -2.406 1.00 0.00 H new ATOM 0 HZ PHE A 62 -14.490 -3.933 -0.105 1.00 0.00 H new ATOM 999 N PRO A 63 -13.524 -9.225 -6.423 1.00 0.00 N ATOM 1000 CA PRO A 63 -13.072 -10.005 -7.577 1.00 0.00 C ATOM 1001 C PRO A 63 -11.567 -9.893 -7.780 1.00 0.00 C ATOM 1002 O PRO A 63 -11.055 -8.797 -8.042 1.00 0.00 O ATOM 1003 CB PRO A 63 -13.817 -9.373 -8.760 1.00 0.00 C ATOM 1004 CG PRO A 63 -14.973 -8.655 -8.155 1.00 0.00 C ATOM 1005 CD PRO A 63 -14.513 -8.201 -6.800 1.00 0.00 C ATOM 0 HA PRO A 63 -13.275 -11.069 -7.455 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -13.172 -8.688 -9.311 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -14.151 -10.133 -9.466 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -15.271 -7.806 -8.771 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -15.840 -9.310 -8.074 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -14.069 -7.206 -6.837 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -15.338 -8.156 -6.089 1.00 0.00 H new ATOM 1013 N ARG A 64 -10.869 -11.027 -7.667 1.00 0.00 N ATOM 1014 CA ARG A 64 -9.410 -11.068 -7.763 1.00 0.00 C ATOM 1015 C ARG A 64 -8.789 -10.029 -6.834 1.00 0.00 C ATOM 1016 O ARG A 64 -8.290 -9.012 -7.291 1.00 0.00 O ATOM 1017 CB ARG A 64 -8.955 -10.811 -9.200 1.00 0.00 C ATOM 1018 CG ARG A 64 -9.322 -11.914 -10.177 1.00 0.00 C ATOM 1019 CD ARG A 64 -8.843 -11.581 -11.571 1.00 0.00 C ATOM 1020 NE ARG A 64 -7.402 -11.344 -11.601 1.00 0.00 N ATOM 1021 CZ ARG A 64 -6.844 -10.199 -11.989 1.00 0.00 C ATOM 1022 NH1 ARG A 64 -7.599 -9.205 -12.444 1.00 0.00 N ATOM 1023 NH2 ARG A 64 -5.528 -10.053 -11.919 1.00 0.00 N ATOM 0 H ARG A 64 -11.299 -11.938 -7.507 1.00 0.00 H new ATOM 0 HA ARG A 64 -9.078 -12.062 -7.462 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -9.393 -9.875 -9.546 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -7.873 -10.679 -9.208 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -8.880 -12.856 -9.851 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -10.403 -12.055 -10.183 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -9.092 -12.399 -12.247 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -9.366 -10.696 -11.935 1.00 0.00 H new ATOM 0 HE ARG A 64 -6.786 -12.102 -11.307 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -8.611 -9.317 -12.497 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -7.166 -8.330 -12.740 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -4.948 -10.816 -11.569 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -5.096 -9.178 -12.215 1.00 0.00 H new ATOM 1037 N PRO A 65 -8.799 -10.275 -5.519 1.00 0.00 N ATOM 1038 CA PRO A 65 -8.435 -9.260 -4.529 1.00 0.00 C ATOM 1039 C PRO A 65 -6.971 -8.842 -4.596 1.00 0.00 C ATOM 1040 O PRO A 65 -6.596 -7.777 -4.113 1.00 0.00 O ATOM 1041 CB PRO A 65 -8.738 -9.933 -3.190 1.00 0.00 C ATOM 1042 CG PRO A 65 -8.693 -11.392 -3.470 1.00 0.00 C ATOM 1043 CD PRO A 65 -9.152 -11.556 -4.890 1.00 0.00 C ATOM 0 HA PRO A 65 -8.988 -8.336 -4.696 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -8.004 -9.654 -2.434 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -9.715 -9.634 -2.811 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -7.684 -11.783 -3.339 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -9.340 -11.941 -2.785 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -8.653 -12.393 -5.378 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -10.224 -11.748 -4.945 1.00 0.00 H new ATOM 1051 N LYS A 66 -6.145 -9.679 -5.184 1.00 0.00 N ATOM 1052 CA LYS A 66 -4.742 -9.372 -5.332 1.00 0.00 C ATOM 1053 C LYS A 66 -4.491 -8.564 -6.594 1.00 0.00 C ATOM 1054 O LYS A 66 -4.529 -9.089 -7.706 1.00 0.00 O ATOM 1055 CB LYS A 66 -3.892 -10.638 -5.330 1.00 0.00 C ATOM 1056 CG LYS A 66 -2.402 -10.358 -5.454 1.00 0.00 C ATOM 1057 CD LYS A 66 -1.570 -11.602 -5.195 1.00 0.00 C ATOM 1058 CE LYS A 66 -0.371 -11.681 -6.124 1.00 0.00 C ATOM 1059 NZ LYS A 66 -0.769 -12.015 -7.516 1.00 0.00 N ATOM 0 H LYS A 66 -6.424 -10.582 -5.569 1.00 0.00 H new ATOM 0 HA LYS A 66 -4.448 -8.768 -4.473 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -4.076 -11.190 -4.409 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -4.205 -11.279 -6.154 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -2.186 -9.978 -6.452 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -2.119 -9.578 -4.747 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -1.229 -11.602 -4.160 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -2.191 -12.488 -5.326 1.00 0.00 H new ATOM 0 HE2 LYS A 66 0.157 -10.728 -6.116 1.00 0.00 H new ATOM 0 HE3 LYS A 66 0.325 -12.434 -5.755 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 0.070 -12.308 -8.056 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -1.460 -12.792 -7.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -1.196 -11.180 -7.965 1.00 0.00 H new ATOM 1073 N ARG A 67 -4.248 -7.279 -6.408 1.00 0.00 N ATOM 1074 CA ARG A 67 -3.953 -6.388 -7.516 1.00 0.00 C ATOM 1075 C ARG A 67 -2.471 -6.065 -7.517 1.00 0.00 C ATOM 1076 O ARG A 67 -1.890 -5.839 -6.459 1.00 0.00 O ATOM 1077 CB ARG A 67 -4.779 -5.105 -7.397 1.00 0.00 C ATOM 1078 CG ARG A 67 -6.242 -5.366 -7.079 1.00 0.00 C ATOM 1079 CD ARG A 67 -6.866 -6.321 -8.085 1.00 0.00 C ATOM 1080 NE ARG A 67 -8.296 -6.508 -7.859 1.00 0.00 N ATOM 1081 CZ ARG A 67 -9.238 -5.623 -8.171 1.00 0.00 C ATOM 1082 NH1 ARG A 67 -8.915 -4.452 -8.709 1.00 0.00 N ATOM 1083 NH2 ARG A 67 -10.512 -5.919 -7.949 1.00 0.00 N ATOM 0 H ARG A 67 -4.249 -6.827 -5.494 1.00 0.00 H new ATOM 0 HA ARG A 67 -4.215 -6.877 -8.454 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -4.351 -4.475 -6.617 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -4.710 -4.548 -8.331 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -6.329 -5.784 -6.076 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -6.790 -4.424 -7.081 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -6.707 -5.938 -9.093 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -6.362 -7.286 -8.027 1.00 0.00 H new ATOM 0 HE ARG A 67 -8.595 -7.383 -7.429 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -7.937 -4.225 -8.886 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -9.645 -3.780 -8.945 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -10.763 -6.820 -7.542 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -11.241 -5.246 -8.185 1.00 0.00 H new ATOM 1097 N VAL A 68 -1.855 -6.061 -8.686 1.00 0.00 N ATOM 1098 CA VAL A 68 -0.421 -5.850 -8.767 1.00 0.00 C ATOM 1099 C VAL A 68 -0.108 -4.566 -9.537 1.00 0.00 C ATOM 1100 O VAL A 68 -0.786 -4.228 -10.511 1.00 0.00 O ATOM 1101 CB VAL A 68 0.315 -7.060 -9.413 1.00 0.00 C ATOM 1102 CG1 VAL A 68 -0.368 -8.380 -9.058 1.00 0.00 C ATOM 1103 CG2 VAL A 68 0.435 -6.904 -10.919 1.00 0.00 C ATOM 0 H VAL A 68 -2.320 -6.200 -9.583 1.00 0.00 H new ATOM 0 HA VAL A 68 -0.054 -5.751 -7.746 1.00 0.00 H new ATOM 0 HB VAL A 68 1.324 -7.079 -9.000 1.00 0.00 H new ATOM 0 HG11 VAL A 68 0.170 -9.205 -9.524 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -0.366 -8.511 -7.976 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -1.396 -8.367 -9.420 1.00 0.00 H new ATOM 0 HG21 VAL A 68 0.954 -7.768 -11.334 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -0.560 -6.833 -11.358 1.00 0.00 H new ATOM 0 HG23 VAL A 68 0.997 -5.999 -11.147 1.00 0.00 H new ATOM 1113 N CYS A 69 0.893 -3.840 -9.075 1.00 0.00 N ATOM 1114 CA CYS A 69 1.359 -2.652 -9.766 1.00 0.00 C ATOM 1115 C CYS A 69 2.852 -2.774 -10.059 1.00 0.00 C ATOM 1116 O CYS A 69 3.664 -2.895 -9.145 1.00 0.00 O ATOM 1117 CB CYS A 69 1.069 -1.400 -8.936 1.00 0.00 C ATOM 1118 SG CYS A 69 -0.690 -1.020 -8.768 1.00 0.00 S ATOM 0 H CYS A 69 1.402 -4.054 -8.218 1.00 0.00 H new ATOM 0 HA CYS A 69 0.824 -2.560 -10.711 1.00 0.00 H new ATOM 0 HB2 CYS A 69 1.499 -1.528 -7.943 1.00 0.00 H new ATOM 0 HB3 CYS A 69 1.572 -0.548 -9.394 1.00 0.00 H new ATOM 0 HG CYS A 69 -1.018 -1.032 -7.510 1.00 0.00 H new ATOM 1124 N LYS A 70 3.206 -2.779 -11.339 1.00 0.00 N ATOM 1125 CA LYS A 70 4.599 -2.939 -11.754 1.00 0.00 C ATOM 1126 C LYS A 70 5.181 -1.598 -12.185 1.00 0.00 C ATOM 1127 O LYS A 70 6.305 -1.523 -12.683 1.00 0.00 O ATOM 1128 CB LYS A 70 4.690 -3.921 -12.930 1.00 0.00 C ATOM 1129 CG LYS A 70 3.932 -5.226 -12.729 1.00 0.00 C ATOM 1130 CD LYS A 70 3.649 -5.899 -14.064 1.00 0.00 C ATOM 1131 CE LYS A 70 2.875 -7.197 -13.899 1.00 0.00 C ATOM 1132 NZ LYS A 70 3.730 -8.310 -13.412 1.00 0.00 N ATOM 0 H LYS A 70 2.547 -2.674 -12.111 1.00 0.00 H new ATOM 0 HA LYS A 70 5.165 -3.326 -10.907 1.00 0.00 H new ATOM 0 HB2 LYS A 70 4.310 -3.430 -13.826 1.00 0.00 H new ATOM 0 HB3 LYS A 70 5.740 -4.151 -13.113 1.00 0.00 H new ATOM 0 HG2 LYS A 70 4.514 -5.896 -12.095 1.00 0.00 H new ATOM 0 HG3 LYS A 70 2.994 -5.030 -12.209 1.00 0.00 H new ATOM 0 HD2 LYS A 70 3.083 -5.218 -14.699 1.00 0.00 H new ATOM 0 HD3 LYS A 70 4.591 -6.102 -14.574 1.00 0.00 H new ATOM 0 HE2 LYS A 70 2.054 -7.041 -13.199 1.00 0.00 H new ATOM 0 HE3 LYS A 70 2.431 -7.476 -14.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 3.156 -9.172 -13.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 4.499 -8.480 -14.091 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 4.134 -8.058 -12.487 1.00 0.00 H new ATOM 1146 N ASP A 71 4.407 -0.546 -11.991 1.00 0.00 N ATOM 1147 CA ASP A 71 4.755 0.776 -12.496 1.00 0.00 C ATOM 1148 C ASP A 71 4.636 1.827 -11.397 1.00 0.00 C ATOM 1149 O ASP A 71 4.303 1.479 -10.269 1.00 0.00 O ATOM 1150 CB ASP A 71 3.831 1.121 -13.670 1.00 0.00 C ATOM 1151 CG ASP A 71 4.334 0.559 -14.983 1.00 0.00 C ATOM 1152 OD1 ASP A 71 5.208 1.192 -15.613 1.00 0.00 O ATOM 1153 OD2 ASP A 71 3.856 -0.516 -15.399 1.00 0.00 O ATOM 0 H ASP A 71 3.524 -0.580 -11.482 1.00 0.00 H new ATOM 0 HA ASP A 71 5.791 0.768 -12.836 1.00 0.00 H new ATOM 0 HB2 ASP A 71 2.833 0.732 -13.470 1.00 0.00 H new ATOM 0 HB3 ASP A 71 3.741 2.204 -13.752 1.00 0.00 H new ATOM 1158 N PRO A 72 4.989 3.106 -11.695 1.00 0.00 N ATOM 1159 CA PRO A 72 4.651 4.291 -10.863 1.00 0.00 C ATOM 1160 C PRO A 72 3.255 4.224 -10.179 1.00 0.00 C ATOM 1161 O PRO A 72 2.545 3.239 -10.349 1.00 0.00 O ATOM 1162 CB PRO A 72 4.733 5.397 -11.909 1.00 0.00 C ATOM 1163 CG PRO A 72 5.901 5.006 -12.742 1.00 0.00 C ATOM 1164 CD PRO A 72 5.850 3.505 -12.837 1.00 0.00 C ATOM 0 HA PRO A 72 5.309 4.413 -10.002 1.00 0.00 H new ATOM 0 HB2 PRO A 72 3.820 5.457 -12.502 1.00 0.00 H new ATOM 0 HB3 PRO A 72 4.878 6.374 -11.448 1.00 0.00 H new ATOM 0 HG2 PRO A 72 5.847 5.463 -13.730 1.00 0.00 H new ATOM 0 HG3 PRO A 72 6.835 5.338 -12.288 1.00 0.00 H new ATOM 0 HD2 PRO A 72 5.429 3.179 -13.788 1.00 0.00 H new ATOM 0 HD3 PRO A 72 6.845 3.065 -12.761 1.00 0.00 H new ATOM 1172 N PRO A 73 2.783 5.320 -9.502 1.00 0.00 N ATOM 1173 CA PRO A 73 1.798 5.265 -8.417 1.00 0.00 C ATOM 1174 C PRO A 73 0.999 3.968 -8.333 1.00 0.00 C ATOM 1175 O PRO A 73 0.145 3.665 -9.170 1.00 0.00 O ATOM 1176 CB PRO A 73 0.901 6.435 -8.778 1.00 0.00 C ATOM 1177 CG PRO A 73 1.839 7.460 -9.349 1.00 0.00 C ATOM 1178 CD PRO A 73 3.102 6.732 -9.765 1.00 0.00 C ATOM 0 HA PRO A 73 2.269 5.309 -7.435 1.00 0.00 H new ATOM 0 HB2 PRO A 73 0.141 6.144 -9.503 1.00 0.00 H new ATOM 0 HB3 PRO A 73 0.377 6.819 -7.903 1.00 0.00 H new ATOM 0 HG2 PRO A 73 1.386 7.962 -10.204 1.00 0.00 H new ATOM 0 HG3 PRO A 73 2.064 8.229 -8.610 1.00 0.00 H new ATOM 0 HD2 PRO A 73 3.336 6.902 -10.816 1.00 0.00 H new ATOM 0 HD3 PRO A 73 3.965 7.063 -9.188 1.00 0.00 H new ATOM 1186 N TYR A 74 1.294 3.230 -7.278 1.00 0.00 N ATOM 1187 CA TYR A 74 0.764 1.898 -7.063 1.00 0.00 C ATOM 1188 C TYR A 74 -0.565 2.005 -6.343 1.00 0.00 C ATOM 1189 O TYR A 74 -0.628 2.546 -5.240 1.00 0.00 O ATOM 1190 CB TYR A 74 1.746 1.105 -6.207 1.00 0.00 C ATOM 1191 CG TYR A 74 3.194 1.212 -6.651 1.00 0.00 C ATOM 1192 CD1 TYR A 74 3.937 2.352 -6.377 1.00 0.00 C ATOM 1193 CD2 TYR A 74 3.819 0.176 -7.327 1.00 0.00 C ATOM 1194 CE1 TYR A 74 5.253 2.458 -6.762 1.00 0.00 C ATOM 1195 CE2 TYR A 74 5.143 0.270 -7.713 1.00 0.00 C ATOM 1196 CZ TYR A 74 5.854 1.414 -7.428 1.00 0.00 C ATOM 1197 OH TYR A 74 7.171 1.512 -7.808 1.00 0.00 O ATOM 0 H TYR A 74 1.918 3.545 -6.536 1.00 0.00 H new ATOM 0 HA TYR A 74 0.622 1.393 -8.018 1.00 0.00 H new ATOM 0 HB2 TYR A 74 1.669 1.448 -5.175 1.00 0.00 H new ATOM 0 HB3 TYR A 74 1.452 0.055 -6.217 1.00 0.00 H new ATOM 0 HD1 TYR A 74 3.472 3.173 -5.851 1.00 0.00 H new ATOM 0 HD2 TYR A 74 3.262 -0.720 -7.556 1.00 0.00 H new ATOM 0 HE1 TYR A 74 5.812 3.356 -6.543 1.00 0.00 H new ATOM 0 HE2 TYR A 74 5.617 -0.549 -8.235 1.00 0.00 H new ATOM 0 HH TYR A 74 7.510 0.624 -8.045 1.00 0.00 H new ATOM 1207 N LYS A 75 -1.620 1.502 -6.952 1.00 0.00 N ATOM 1208 CA LYS A 75 -2.946 1.753 -6.440 1.00 0.00 C ATOM 1209 C LYS A 75 -3.947 0.689 -6.842 1.00 0.00 C ATOM 1210 O LYS A 75 -3.694 -0.162 -7.695 1.00 0.00 O ATOM 1211 CB LYS A 75 -3.413 3.106 -6.956 1.00 0.00 C ATOM 1212 CG LYS A 75 -3.278 3.226 -8.455 1.00 0.00 C ATOM 1213 CD LYS A 75 -3.910 4.500 -8.981 1.00 0.00 C ATOM 1214 CE LYS A 75 -5.094 4.947 -8.160 1.00 0.00 C ATOM 1215 NZ LYS A 75 -5.756 6.135 -8.760 1.00 0.00 N ATOM 0 H LYS A 75 -1.584 0.924 -7.792 1.00 0.00 H new ATOM 0 HA LYS A 75 -2.890 1.738 -5.352 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -4.455 3.260 -6.674 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -2.833 3.895 -6.477 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -2.223 3.206 -8.727 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -3.747 2.365 -8.932 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -3.162 5.293 -8.994 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -4.227 4.344 -10.012 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -5.812 4.131 -8.080 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -4.767 5.184 -7.147 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -6.200 6.701 -8.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -5.048 6.713 -9.257 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -6.484 5.823 -9.435 1.00 0.00 H new ATOM 1229 N VAL A 76 -5.094 0.787 -6.207 1.00 0.00 N ATOM 1230 CA VAL A 76 -6.227 -0.089 -6.432 1.00 0.00 C ATOM 1231 C VAL A 76 -7.508 0.738 -6.371 1.00 0.00 C ATOM 1232 O VAL A 76 -7.691 1.526 -5.440 1.00 0.00 O ATOM 1233 CB VAL A 76 -6.295 -1.216 -5.379 1.00 0.00 C ATOM 1234 CG1 VAL A 76 -7.666 -1.860 -5.383 1.00 0.00 C ATOM 1235 CG2 VAL A 76 -5.231 -2.269 -5.637 1.00 0.00 C ATOM 0 H VAL A 76 -5.271 1.499 -5.498 1.00 0.00 H new ATOM 0 HA VAL A 76 -6.113 -0.554 -7.411 1.00 0.00 H new ATOM 0 HB VAL A 76 -6.111 -0.771 -4.401 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -7.698 -2.653 -4.635 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -8.421 -1.110 -5.149 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -7.867 -2.282 -6.368 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -5.302 -3.051 -4.881 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -5.382 -2.705 -6.625 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -4.244 -1.808 -5.591 1.00 0.00 H new ATOM 1245 N GLU A 77 -8.371 0.589 -7.367 1.00 0.00 N ATOM 1246 CA GLU A 77 -9.656 1.281 -7.375 1.00 0.00 C ATOM 1247 C GLU A 77 -10.768 0.264 -7.245 1.00 0.00 C ATOM 1248 O GLU A 77 -10.995 -0.525 -8.161 1.00 0.00 O ATOM 1249 CB GLU A 77 -9.871 2.074 -8.667 1.00 0.00 C ATOM 1250 CG GLU A 77 -8.694 2.918 -9.091 1.00 0.00 C ATOM 1251 CD GLU A 77 -7.691 2.147 -9.923 1.00 0.00 C ATOM 1252 OE1 GLU A 77 -8.112 1.285 -10.728 1.00 0.00 O ATOM 1253 OE2 GLU A 77 -6.482 2.418 -9.797 1.00 0.00 O ATOM 0 H GLU A 77 -8.206 -0.004 -8.180 1.00 0.00 H new ATOM 0 HA GLU A 77 -9.661 1.980 -6.539 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -10.109 1.377 -9.470 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -10.738 2.722 -8.540 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -9.053 3.774 -9.663 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -8.197 3.313 -8.205 1.00 0.00 H new ATOM 1260 N GLU A 78 -11.465 0.271 -6.128 1.00 0.00 N ATOM 1261 CA GLU A 78 -12.491 -0.735 -5.904 1.00 0.00 C ATOM 1262 C GLU A 78 -13.746 -0.158 -5.280 1.00 0.00 C ATOM 1263 O GLU A 78 -13.805 1.021 -4.933 1.00 0.00 O ATOM 1264 CB GLU A 78 -11.964 -1.876 -5.031 1.00 0.00 C ATOM 1265 CG GLU A 78 -11.572 -3.114 -5.820 1.00 0.00 C ATOM 1266 CD GLU A 78 -12.606 -3.484 -6.865 1.00 0.00 C ATOM 1267 OE1 GLU A 78 -13.815 -3.370 -6.579 1.00 0.00 O ATOM 1268 OE2 GLU A 78 -12.218 -3.897 -7.980 1.00 0.00 O ATOM 0 H GLU A 78 -11.347 0.946 -5.373 1.00 0.00 H new ATOM 0 HA GLU A 78 -12.755 -1.123 -6.888 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -11.098 -1.523 -4.470 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -12.727 -2.147 -4.302 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -10.612 -2.942 -6.307 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -11.436 -3.951 -5.135 1.00 0.00 H new ATOM 1275 N SER A 79 -14.740 -1.021 -5.151 1.00 0.00 N ATOM 1276 CA SER A 79 -16.024 -0.651 -4.595 1.00 0.00 C ATOM 1277 C SER A 79 -16.569 -1.808 -3.759 1.00 0.00 C ATOM 1278 O SER A 79 -16.377 -2.980 -4.095 1.00 0.00 O ATOM 1279 CB SER A 79 -16.998 -0.274 -5.717 1.00 0.00 C ATOM 1280 OG SER A 79 -18.191 0.303 -5.206 1.00 0.00 O ATOM 0 H SER A 79 -14.676 -2.000 -5.431 1.00 0.00 H new ATOM 0 HA SER A 79 -15.905 0.219 -3.949 1.00 0.00 H new ATOM 0 HB2 SER A 79 -16.516 0.429 -6.396 1.00 0.00 H new ATOM 0 HB3 SER A 79 -17.244 -1.162 -6.299 1.00 0.00 H new ATOM 0 HG SER A 79 -18.036 0.618 -4.291 1.00 0.00 H new ATOM 1286 N GLY A 80 -17.230 -1.469 -2.669 1.00 0.00 N ATOM 1287 CA GLY A 80 -17.739 -2.459 -1.746 1.00 0.00 C ATOM 1288 C GLY A 80 -18.752 -1.842 -0.811 1.00 0.00 C ATOM 1289 O GLY A 80 -19.419 -0.880 -1.183 1.00 0.00 O ATOM 0 H GLY A 80 -17.427 -0.505 -2.401 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -18.198 -3.278 -2.299 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -16.917 -2.885 -1.171 1.00 0.00 H new ATOM 1293 N TYR A 81 -18.887 -2.365 0.397 1.00 0.00 N ATOM 1294 CA TYR A 81 -19.842 -1.793 1.342 1.00 0.00 C ATOM 1295 C TYR A 81 -19.375 -1.928 2.791 1.00 0.00 C ATOM 1296 O TYR A 81 -20.170 -1.770 3.719 1.00 0.00 O ATOM 1297 CB TYR A 81 -21.231 -2.427 1.155 1.00 0.00 C ATOM 1298 CG TYR A 81 -21.237 -3.943 1.207 1.00 0.00 C ATOM 1299 CD1 TYR A 81 -21.344 -4.622 2.413 1.00 0.00 C ATOM 1300 CD2 TYR A 81 -21.134 -4.694 0.042 1.00 0.00 C ATOM 1301 CE1 TYR A 81 -21.348 -6.002 2.459 1.00 0.00 C ATOM 1302 CE2 TYR A 81 -21.137 -6.075 0.081 1.00 0.00 C ATOM 1303 CZ TYR A 81 -21.244 -6.724 1.290 1.00 0.00 C ATOM 1304 OH TYR A 81 -21.240 -8.101 1.333 1.00 0.00 O ATOM 0 H TYR A 81 -18.362 -3.167 0.745 1.00 0.00 H new ATOM 0 HA TYR A 81 -19.910 -0.726 1.128 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -21.899 -2.046 1.928 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -21.638 -2.106 0.196 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -21.426 -4.061 3.332 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -21.050 -4.190 -0.909 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -21.432 -6.513 3.407 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -21.056 -6.643 -0.834 1.00 0.00 H new ATOM 0 HH TYR A 81 -21.161 -8.456 0.423 1.00 0.00 H new ATOM 1314 N ALA A 82 -18.086 -2.191 2.988 1.00 0.00 N ATOM 1315 CA ALA A 82 -17.535 -2.329 4.331 1.00 0.00 C ATOM 1316 C ALA A 82 -16.028 -2.115 4.329 1.00 0.00 C ATOM 1317 O ALA A 82 -15.395 -2.098 3.274 1.00 0.00 O ATOM 1318 CB ALA A 82 -17.863 -3.700 4.901 1.00 0.00 C ATOM 0 H ALA A 82 -17.406 -2.312 2.237 1.00 0.00 H new ATOM 0 HA ALA A 82 -17.990 -1.564 4.960 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -17.445 -3.787 5.904 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -18.945 -3.826 4.947 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -17.435 -4.472 4.261 1.00 0.00 H new ATOM 1324 N GLY A 83 -15.469 -1.949 5.524 1.00 0.00 N ATOM 1325 CA GLY A 83 -14.038 -1.757 5.668 1.00 0.00 C ATOM 1326 C GLY A 83 -13.349 -3.001 6.194 1.00 0.00 C ATOM 1327 O GLY A 83 -14.017 -3.960 6.595 1.00 0.00 O ATOM 0 H GLY A 83 -15.988 -1.944 6.402 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -13.610 -1.486 4.703 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -13.850 -0.924 6.346 1.00 0.00 H new ATOM 1331 N PHE A 84 -12.018 -2.984 6.199 1.00 0.00 N ATOM 1332 CA PHE A 84 -11.221 -4.147 6.586 1.00 0.00 C ATOM 1333 C PHE A 84 -9.729 -3.824 6.521 1.00 0.00 C ATOM 1334 O PHE A 84 -9.317 -2.912 5.806 1.00 0.00 O ATOM 1335 CB PHE A 84 -11.534 -5.343 5.662 1.00 0.00 C ATOM 1336 CG PHE A 84 -11.328 -5.067 4.189 1.00 0.00 C ATOM 1337 CD1 PHE A 84 -12.272 -4.352 3.464 1.00 0.00 C ATOM 1338 CD2 PHE A 84 -10.198 -5.526 3.532 1.00 0.00 C ATOM 1339 CE1 PHE A 84 -12.090 -4.098 2.119 1.00 0.00 C ATOM 1340 CE2 PHE A 84 -10.008 -5.275 2.188 1.00 0.00 C ATOM 1341 CZ PHE A 84 -10.955 -4.560 1.478 1.00 0.00 C ATOM 0 H PHE A 84 -11.464 -2.169 5.937 1.00 0.00 H new ATOM 0 HA PHE A 84 -11.480 -4.410 7.612 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -10.906 -6.185 5.953 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -12.568 -5.648 5.821 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -13.161 -3.990 3.959 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -9.455 -6.088 4.079 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -12.833 -3.540 1.569 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -9.120 -5.637 1.691 1.00 0.00 H new ATOM 0 HZ PHE A 84 -10.809 -4.363 0.426 1.00 0.00 H new ATOM 1351 N ILE A 85 -8.928 -4.550 7.294 1.00 0.00 N ATOM 1352 CA ILE A 85 -7.477 -4.468 7.179 1.00 0.00 C ATOM 1353 C ILE A 85 -7.041 -4.995 5.820 1.00 0.00 C ATOM 1354 O ILE A 85 -7.382 -6.120 5.446 1.00 0.00 O ATOM 1355 CB ILE A 85 -6.762 -5.275 8.292 1.00 0.00 C ATOM 1356 CG1 ILE A 85 -6.852 -4.549 9.634 1.00 0.00 C ATOM 1357 CG2 ILE A 85 -5.304 -5.535 7.934 1.00 0.00 C ATOM 1358 CD1 ILE A 85 -6.124 -3.221 9.660 1.00 0.00 C ATOM 0 H ILE A 85 -9.259 -5.201 8.006 1.00 0.00 H new ATOM 0 HA ILE A 85 -7.196 -3.420 7.288 1.00 0.00 H new ATOM 0 HB ILE A 85 -7.270 -6.235 8.380 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -7.901 -4.382 9.877 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -6.443 -5.192 10.413 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -4.829 -6.103 8.734 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -5.253 -6.104 7.005 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -4.786 -4.585 7.806 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -6.233 -2.766 10.644 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -5.067 -3.382 9.449 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -6.548 -2.559 8.905 1.00 0.00 H new ATOM 1370 N LEU A 86 -6.302 -4.183 5.084 1.00 0.00 N ATOM 1371 CA LEU A 86 -5.835 -4.577 3.771 1.00 0.00 C ATOM 1372 C LEU A 86 -4.322 -4.729 3.783 1.00 0.00 C ATOM 1373 O LEU A 86 -3.588 -3.744 3.881 1.00 0.00 O ATOM 1374 CB LEU A 86 -6.269 -3.555 2.719 1.00 0.00 C ATOM 1375 CG LEU A 86 -6.435 -4.128 1.313 1.00 0.00 C ATOM 1376 CD1 LEU A 86 -7.528 -3.400 0.556 1.00 0.00 C ATOM 1377 CD2 LEU A 86 -5.144 -4.031 0.541 1.00 0.00 C ATOM 0 H LEU A 86 -6.014 -3.249 5.375 1.00 0.00 H new ATOM 0 HA LEU A 86 -6.280 -5.538 3.512 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -7.214 -3.110 3.031 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -5.534 -2.751 2.686 1.00 0.00 H new ATOM 0 HG LEU A 86 -6.713 -5.177 1.417 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -7.626 -3.827 -0.442 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -8.472 -3.505 1.090 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -7.273 -2.343 0.475 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -5.285 -4.445 -0.457 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -4.845 -2.986 0.462 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -4.367 -4.592 1.060 1.00 0.00 H new ATOM 1389 N PRO A 87 -3.839 -5.975 3.722 1.00 0.00 N ATOM 1390 CA PRO A 87 -2.413 -6.265 3.685 1.00 0.00 C ATOM 1391 C PRO A 87 -1.799 -5.871 2.347 1.00 0.00 C ATOM 1392 O PRO A 87 -1.985 -6.553 1.334 1.00 0.00 O ATOM 1393 CB PRO A 87 -2.328 -7.784 3.894 1.00 0.00 C ATOM 1394 CG PRO A 87 -3.707 -8.215 4.277 1.00 0.00 C ATOM 1395 CD PRO A 87 -4.641 -7.200 3.692 1.00 0.00 C ATOM 0 HA PRO A 87 -1.863 -5.704 4.441 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -1.999 -8.287 2.985 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -1.609 -8.033 4.674 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -3.924 -9.211 3.892 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -3.813 -8.262 5.361 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -4.942 -7.463 2.678 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -5.553 -7.102 4.280 1.00 0.00 H new ATOM 1403 N ILE A 88 -1.101 -4.749 2.343 1.00 0.00 N ATOM 1404 CA ILE A 88 -0.456 -4.254 1.147 1.00 0.00 C ATOM 1405 C ILE A 88 1.010 -4.652 1.143 1.00 0.00 C ATOM 1406 O ILE A 88 1.651 -4.682 2.191 1.00 0.00 O ATOM 1407 CB ILE A 88 -0.574 -2.720 1.048 1.00 0.00 C ATOM 1408 CG1 ILE A 88 -2.032 -2.304 1.271 1.00 0.00 C ATOM 1409 CG2 ILE A 88 -0.083 -2.249 -0.312 1.00 0.00 C ATOM 1410 CD1 ILE A 88 -2.198 -0.888 1.769 1.00 0.00 C ATOM 0 H ILE A 88 -0.968 -4.161 3.165 1.00 0.00 H new ATOM 0 HA ILE A 88 -0.957 -4.696 0.286 1.00 0.00 H new ATOM 0 HB ILE A 88 0.045 -2.256 1.816 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -2.578 -2.415 0.334 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -2.488 -2.986 1.988 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -0.169 -1.164 -0.374 1.00 0.00 H new ATOM 0 HG22 ILE A 88 0.960 -2.538 -0.442 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -0.687 -2.707 -1.095 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -3.258 -0.671 1.902 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -1.682 -0.775 2.723 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -1.774 -0.195 1.043 1.00 0.00 H new ATOM 1422 N GLU A 89 1.533 -4.959 -0.028 1.00 0.00 N ATOM 1423 CA GLU A 89 2.918 -5.372 -0.154 1.00 0.00 C ATOM 1424 C GLU A 89 3.665 -4.503 -1.146 1.00 0.00 C ATOM 1425 O GLU A 89 3.170 -4.222 -2.240 1.00 0.00 O ATOM 1426 CB GLU A 89 3.017 -6.825 -0.605 1.00 0.00 C ATOM 1427 CG GLU A 89 2.594 -7.833 0.445 1.00 0.00 C ATOM 1428 CD GLU A 89 2.885 -9.257 0.018 1.00 0.00 C ATOM 1429 OE1 GLU A 89 4.069 -9.659 0.041 1.00 0.00 O ATOM 1430 OE2 GLU A 89 1.937 -9.985 -0.334 1.00 0.00 O ATOM 0 H GLU A 89 1.019 -4.930 -0.908 1.00 0.00 H new ATOM 0 HA GLU A 89 3.371 -5.264 0.831 1.00 0.00 H new ATOM 0 HB2 GLU A 89 2.399 -6.961 -1.492 1.00 0.00 H new ATOM 0 HB3 GLU A 89 4.046 -7.033 -0.898 1.00 0.00 H new ATOM 0 HG2 GLU A 89 3.114 -7.622 1.380 1.00 0.00 H new ATOM 0 HG3 GLU A 89 1.527 -7.725 0.642 1.00 0.00 H new ATOM 1437 N VAL A 90 4.854 -4.083 -0.759 1.00 0.00 N ATOM 1438 CA VAL A 90 5.754 -3.408 -1.671 1.00 0.00 C ATOM 1439 C VAL A 90 6.991 -4.265 -1.880 1.00 0.00 C ATOM 1440 O VAL A 90 7.667 -4.636 -0.920 1.00 0.00 O ATOM 1441 CB VAL A 90 6.180 -2.017 -1.189 1.00 0.00 C ATOM 1442 CG1 VAL A 90 6.970 -1.346 -2.286 1.00 0.00 C ATOM 1443 CG2 VAL A 90 4.966 -1.188 -0.812 1.00 0.00 C ATOM 0 H VAL A 90 5.220 -4.199 0.186 1.00 0.00 H new ATOM 0 HA VAL A 90 5.209 -3.266 -2.604 1.00 0.00 H new ATOM 0 HB VAL A 90 6.802 -2.110 -0.299 1.00 0.00 H new ATOM 0 HG11 VAL A 90 7.280 -0.354 -1.957 1.00 0.00 H new ATOM 0 HG12 VAL A 90 7.852 -1.944 -2.517 1.00 0.00 H new ATOM 0 HG13 VAL A 90 6.350 -1.255 -3.178 1.00 0.00 H new ATOM 0 HG21 VAL A 90 5.289 -0.204 -0.472 1.00 0.00 H new ATOM 0 HG22 VAL A 90 4.317 -1.077 -1.681 1.00 0.00 H new ATOM 0 HG23 VAL A 90 4.419 -1.687 -0.012 1.00 0.00 H new ATOM 1453 N TYR A 91 7.264 -4.607 -3.125 1.00 0.00 N ATOM 1454 CA TYR A 91 8.425 -5.433 -3.446 1.00 0.00 C ATOM 1455 C TYR A 91 9.675 -4.586 -3.596 1.00 0.00 C ATOM 1456 O TYR A 91 9.675 -3.565 -4.282 1.00 0.00 O ATOM 1457 CB TYR A 91 8.206 -6.223 -4.726 1.00 0.00 C ATOM 1458 CG TYR A 91 7.400 -7.487 -4.544 1.00 0.00 C ATOM 1459 CD1 TYR A 91 6.228 -7.492 -3.807 1.00 0.00 C ATOM 1460 CD2 TYR A 91 7.816 -8.679 -5.123 1.00 0.00 C ATOM 1461 CE1 TYR A 91 5.490 -8.647 -3.652 1.00 0.00 C ATOM 1462 CE2 TYR A 91 7.082 -9.839 -4.972 1.00 0.00 C ATOM 1463 CZ TYR A 91 5.920 -9.815 -4.236 1.00 0.00 C ATOM 1464 OH TYR A 91 5.176 -10.963 -4.087 1.00 0.00 O ATOM 0 H TYR A 91 6.704 -4.330 -3.931 1.00 0.00 H new ATOM 0 HA TYR A 91 8.557 -6.128 -2.617 1.00 0.00 H new ATOM 0 HB2 TYR A 91 7.701 -5.585 -5.451 1.00 0.00 H new ATOM 0 HB3 TYR A 91 9.176 -6.482 -5.150 1.00 0.00 H new ATOM 0 HD1 TYR A 91 5.886 -6.577 -3.346 1.00 0.00 H new ATOM 0 HD2 TYR A 91 8.728 -8.699 -5.701 1.00 0.00 H new ATOM 0 HE1 TYR A 91 4.578 -8.634 -3.074 1.00 0.00 H new ATOM 0 HE2 TYR A 91 7.418 -10.758 -5.428 1.00 0.00 H new ATOM 0 HH TYR A 91 5.614 -11.701 -4.561 1.00 0.00 H new ATOM 1474 N PHE A 92 10.739 -5.048 -2.982 1.00 0.00 N ATOM 1475 CA PHE A 92 12.005 -4.336 -2.981 1.00 0.00 C ATOM 1476 C PHE A 92 12.982 -4.989 -3.961 1.00 0.00 C ATOM 1477 O PHE A 92 12.838 -6.169 -4.285 1.00 0.00 O ATOM 1478 CB PHE A 92 12.595 -4.367 -1.572 1.00 0.00 C ATOM 1479 CG PHE A 92 11.805 -3.590 -0.555 1.00 0.00 C ATOM 1480 CD1 PHE A 92 11.242 -2.367 -0.879 1.00 0.00 C ATOM 1481 CD2 PHE A 92 11.658 -4.068 0.735 1.00 0.00 C ATOM 1482 CE1 PHE A 92 10.551 -1.637 0.060 1.00 0.00 C ATOM 1483 CE2 PHE A 92 10.957 -3.339 1.678 1.00 0.00 C ATOM 1484 CZ PHE A 92 10.408 -2.124 1.336 1.00 0.00 C ATOM 0 H PHE A 92 10.756 -5.928 -2.467 1.00 0.00 H new ATOM 0 HA PHE A 92 11.837 -3.304 -3.290 1.00 0.00 H new ATOM 0 HB2 PHE A 92 12.668 -5.404 -1.244 1.00 0.00 H new ATOM 0 HB3 PHE A 92 13.610 -3.971 -1.607 1.00 0.00 H new ATOM 0 HD1 PHE A 92 11.347 -1.981 -1.882 1.00 0.00 H new ATOM 0 HD2 PHE A 92 12.094 -5.018 1.008 1.00 0.00 H new ATOM 0 HE1 PHE A 92 10.122 -0.682 -0.206 1.00 0.00 H new ATOM 0 HE2 PHE A 92 10.840 -3.722 2.681 1.00 0.00 H new ATOM 0 HZ PHE A 92 9.863 -1.552 2.073 1.00 0.00 H new ATOM 1494 N LYS A 93 13.971 -4.233 -4.435 1.00 0.00 N ATOM 1495 CA LYS A 93 14.979 -4.779 -5.339 1.00 0.00 C ATOM 1496 C LYS A 93 16.266 -5.086 -4.589 1.00 0.00 C ATOM 1497 O LYS A 93 17.112 -4.204 -4.438 1.00 0.00 O ATOM 1498 CB LYS A 93 15.330 -3.783 -6.446 1.00 0.00 C ATOM 1499 CG LYS A 93 14.187 -3.376 -7.347 1.00 0.00 C ATOM 1500 CD LYS A 93 14.666 -2.302 -8.341 1.00 0.00 C ATOM 1501 CE LYS A 93 13.684 -2.085 -9.540 1.00 0.00 C ATOM 1502 NZ LYS A 93 13.814 -0.723 -10.122 1.00 0.00 N ATOM 0 H LYS A 93 14.095 -3.246 -4.209 1.00 0.00 H new ATOM 0 HA LYS A 93 14.554 -5.687 -5.768 1.00 0.00 H new ATOM 0 HB2 LYS A 93 15.742 -2.886 -5.985 1.00 0.00 H new ATOM 0 HB3 LYS A 93 16.118 -4.216 -7.062 1.00 0.00 H new ATOM 0 HG2 LYS A 93 13.811 -4.244 -7.888 1.00 0.00 H new ATOM 0 HG3 LYS A 93 13.361 -2.990 -6.750 1.00 0.00 H new ATOM 0 HD2 LYS A 93 14.795 -1.358 -7.811 1.00 0.00 H new ATOM 0 HD3 LYS A 93 15.644 -2.586 -8.729 1.00 0.00 H new ATOM 0 HE2 LYS A 93 13.882 -2.830 -10.311 1.00 0.00 H new ATOM 0 HE3 LYS A 93 12.659 -2.240 -9.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 13.439 -0.723 -11.092 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 13.278 -0.045 -9.543 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 14.817 -0.447 -10.139 1.00 0.00 H new ATOM 1516 N ASN A 94 16.421 -6.308 -4.115 1.00 0.00 N ATOM 1517 CA ASN A 94 17.677 -6.719 -3.504 1.00 0.00 C ATOM 1518 C ASN A 94 17.835 -8.237 -3.529 1.00 0.00 C ATOM 1519 O ASN A 94 16.894 -8.969 -3.833 1.00 0.00 O ATOM 1520 CB ASN A 94 17.795 -6.174 -2.075 1.00 0.00 C ATOM 1521 CG ASN A 94 16.725 -6.683 -1.132 1.00 0.00 C ATOM 1522 OD1 ASN A 94 15.610 -7.008 -1.539 1.00 0.00 O ATOM 1523 ND2 ASN A 94 17.054 -6.727 0.145 1.00 0.00 N ATOM 0 H ASN A 94 15.701 -7.030 -4.139 1.00 0.00 H new ATOM 0 HA ASN A 94 18.489 -6.294 -4.094 1.00 0.00 H new ATOM 0 HB2 ASN A 94 18.774 -6.440 -1.675 1.00 0.00 H new ATOM 0 HB3 ASN A 94 17.749 -5.085 -2.107 1.00 0.00 H new ATOM 0 HD21 ASN A 94 16.373 -7.039 0.837 1.00 0.00 H new ATOM 0 HD22 ASN A 94 17.990 -6.449 0.440 1.00 0.00 H new ATOM 1530 N LYS A 95 19.044 -8.695 -3.229 1.00 0.00 N ATOM 1531 CA LYS A 95 19.350 -10.123 -3.141 1.00 0.00 C ATOM 1532 C LYS A 95 19.504 -10.507 -1.677 1.00 0.00 C ATOM 1533 O LYS A 95 19.713 -11.669 -1.321 1.00 0.00 O ATOM 1534 CB LYS A 95 20.640 -10.422 -3.890 1.00 0.00 C ATOM 1535 CG LYS A 95 20.601 -10.008 -5.345 1.00 0.00 C ATOM 1536 CD LYS A 95 21.956 -10.204 -6.003 1.00 0.00 C ATOM 1537 CE LYS A 95 21.920 -9.873 -7.485 1.00 0.00 C ATOM 1538 NZ LYS A 95 23.273 -9.944 -8.095 1.00 0.00 N ATOM 0 H LYS A 95 19.842 -8.089 -3.039 1.00 0.00 H new ATOM 0 HA LYS A 95 18.541 -10.699 -3.589 1.00 0.00 H new ATOM 0 HB2 LYS A 95 21.465 -9.909 -3.396 1.00 0.00 H new ATOM 0 HB3 LYS A 95 20.847 -11.490 -3.830 1.00 0.00 H new ATOM 0 HG2 LYS A 95 19.848 -10.593 -5.873 1.00 0.00 H new ATOM 0 HG3 LYS A 95 20.303 -8.962 -5.421 1.00 0.00 H new ATOM 0 HD2 LYS A 95 22.694 -9.573 -5.508 1.00 0.00 H new ATOM 0 HD3 LYS A 95 22.278 -11.237 -5.870 1.00 0.00 H new ATOM 0 HE2 LYS A 95 21.253 -10.566 -7.997 1.00 0.00 H new ATOM 0 HE3 LYS A 95 21.509 -8.873 -7.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 23.210 -9.712 -9.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 23.903 -9.265 -7.623 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 23.654 -10.905 -7.983 1.00 0.00 H new ATOM 1552 N GLU A 96 19.379 -9.491 -0.850 1.00 0.00 N ATOM 1553 CA GLU A 96 19.592 -9.574 0.582 1.00 0.00 C ATOM 1554 C GLU A 96 18.245 -9.635 1.302 1.00 0.00 C ATOM 1555 O GLU A 96 17.301 -10.217 0.766 1.00 0.00 O ATOM 1556 CB GLU A 96 20.455 -8.382 1.071 1.00 0.00 C ATOM 1557 CG GLU A 96 20.492 -7.191 0.118 1.00 0.00 C ATOM 1558 CD GLU A 96 21.300 -7.460 -1.138 1.00 0.00 C ATOM 1559 OE1 GLU A 96 22.348 -8.128 -1.045 1.00 0.00 O ATOM 1560 OE2 GLU A 96 20.882 -7.020 -2.229 1.00 0.00 O ATOM 0 H GLU A 96 19.119 -8.556 -1.163 1.00 0.00 H new ATOM 0 HA GLU A 96 20.140 -10.487 0.816 1.00 0.00 H new ATOM 0 HB2 GLU A 96 20.074 -8.047 2.036 1.00 0.00 H new ATOM 0 HB3 GLU A 96 21.474 -8.732 1.234 1.00 0.00 H new ATOM 0 HG2 GLU A 96 19.473 -6.926 -0.163 1.00 0.00 H new ATOM 0 HG3 GLU A 96 20.914 -6.330 0.637 1.00 0.00 H new ATOM 1567 N GLU A 97 18.196 -9.107 2.535 1.00 0.00 N ATOM 1568 CA GLU A 97 17.003 -9.164 3.405 1.00 0.00 C ATOM 1569 C GLU A 97 15.668 -8.961 2.657 1.00 0.00 C ATOM 1570 O GLU A 97 15.650 -8.441 1.547 1.00 0.00 O ATOM 1571 CB GLU A 97 17.114 -8.137 4.541 1.00 0.00 C ATOM 1572 CG GLU A 97 17.492 -6.731 4.100 1.00 0.00 C ATOM 1573 CD GLU A 97 18.963 -6.435 4.308 1.00 0.00 C ATOM 1574 OE1 GLU A 97 19.778 -6.802 3.444 1.00 0.00 O ATOM 1575 OE2 GLU A 97 19.315 -5.845 5.352 1.00 0.00 O ATOM 0 H GLU A 97 18.987 -8.625 2.962 1.00 0.00 H new ATOM 0 HA GLU A 97 16.985 -10.177 3.808 1.00 0.00 H new ATOM 0 HB2 GLU A 97 16.160 -8.093 5.066 1.00 0.00 H new ATOM 0 HB3 GLU A 97 17.856 -8.489 5.258 1.00 0.00 H new ATOM 0 HG2 GLU A 97 17.245 -6.605 3.046 1.00 0.00 H new ATOM 0 HG3 GLU A 97 16.897 -6.007 4.656 1.00 0.00 H new ATOM 1582 N PRO A 98 14.528 -9.304 3.304 1.00 0.00 N ATOM 1583 CA PRO A 98 13.205 -9.443 2.670 1.00 0.00 C ATOM 1584 C PRO A 98 12.950 -8.521 1.470 1.00 0.00 C ATOM 1585 O PRO A 98 13.026 -7.294 1.576 1.00 0.00 O ATOM 1586 CB PRO A 98 12.230 -9.108 3.822 1.00 0.00 C ATOM 1587 CG PRO A 98 13.092 -8.849 5.020 1.00 0.00 C ATOM 1588 CD PRO A 98 14.391 -9.541 4.741 1.00 0.00 C ATOM 0 HA PRO A 98 13.095 -10.439 2.240 1.00 0.00 H new ATOM 0 HB2 PRO A 98 11.623 -8.235 3.580 1.00 0.00 H new ATOM 0 HB3 PRO A 98 11.542 -9.934 4.006 1.00 0.00 H new ATOM 0 HG2 PRO A 98 13.242 -7.780 5.171 1.00 0.00 H new ATOM 0 HG3 PRO A 98 12.629 -9.237 5.927 1.00 0.00 H new ATOM 0 HD2 PRO A 98 15.217 -9.114 5.310 1.00 0.00 H new ATOM 0 HD3 PRO A 98 14.353 -10.603 4.982 1.00 0.00 H new ATOM 1596 N ARG A 99 12.614 -9.139 0.335 1.00 0.00 N ATOM 1597 CA ARG A 99 12.324 -8.417 -0.907 1.00 0.00 C ATOM 1598 C ARG A 99 10.900 -7.898 -0.933 1.00 0.00 C ATOM 1599 O ARG A 99 10.346 -7.619 -1.999 1.00 0.00 O ATOM 1600 CB ARG A 99 12.539 -9.323 -2.109 1.00 0.00 C ATOM 1601 CG ARG A 99 13.983 -9.458 -2.478 1.00 0.00 C ATOM 1602 CD ARG A 99 14.184 -10.517 -3.555 1.00 0.00 C ATOM 1603 NE ARG A 99 13.242 -10.373 -4.666 1.00 0.00 N ATOM 1604 CZ ARG A 99 13.198 -11.200 -5.710 1.00 0.00 C ATOM 1605 NH1 ARG A 99 14.037 -12.224 -5.782 1.00 0.00 N ATOM 1606 NH2 ARG A 99 12.321 -10.997 -6.684 1.00 0.00 N ATOM 0 H ARG A 99 12.535 -10.152 0.251 1.00 0.00 H new ATOM 0 HA ARG A 99 13.007 -7.568 -0.952 1.00 0.00 H new ATOM 0 HB2 ARG A 99 12.129 -10.310 -1.893 1.00 0.00 H new ATOM 0 HB3 ARG A 99 11.986 -8.927 -2.961 1.00 0.00 H new ATOM 0 HG2 ARG A 99 14.361 -8.499 -2.833 1.00 0.00 H new ATOM 0 HG3 ARG A 99 14.563 -9.721 -1.594 1.00 0.00 H new ATOM 0 HD2 ARG A 99 15.203 -10.454 -3.937 1.00 0.00 H new ATOM 0 HD3 ARG A 99 14.070 -11.507 -3.113 1.00 0.00 H new ATOM 0 HE ARG A 99 12.582 -9.596 -4.640 1.00 0.00 H new ATOM 0 HH11 ARG A 99 14.717 -12.379 -5.038 1.00 0.00 H new ATOM 0 HH12 ARG A 99 14.002 -12.856 -6.582 1.00 0.00 H new ATOM 0 HH21 ARG A 99 11.678 -10.206 -6.635 1.00 0.00 H new ATOM 0 HH22 ARG A 99 12.289 -11.631 -7.482 1.00 0.00 H new ATOM 1620 N LYS A 100 10.302 -7.802 0.228 1.00 0.00 N ATOM 1621 CA LYS A 100 8.935 -7.336 0.343 1.00 0.00 C ATOM 1622 C LYS A 100 8.705 -6.708 1.698 1.00 0.00 C ATOM 1623 O LYS A 100 9.334 -7.087 2.686 1.00 0.00 O ATOM 1624 CB LYS A 100 7.947 -8.488 0.152 1.00 0.00 C ATOM 1625 CG LYS A 100 8.153 -9.623 1.145 1.00 0.00 C ATOM 1626 CD LYS A 100 6.937 -10.534 1.259 1.00 0.00 C ATOM 1627 CE LYS A 100 6.777 -11.468 0.066 1.00 0.00 C ATOM 1628 NZ LYS A 100 6.206 -10.776 -1.115 1.00 0.00 N ATOM 0 H LYS A 100 10.742 -8.042 1.117 1.00 0.00 H new ATOM 0 HA LYS A 100 8.771 -6.593 -0.438 1.00 0.00 H new ATOM 0 HB2 LYS A 100 6.931 -8.107 0.251 1.00 0.00 H new ATOM 0 HB3 LYS A 100 8.044 -8.878 -0.861 1.00 0.00 H new ATOM 0 HG2 LYS A 100 9.017 -10.214 0.841 1.00 0.00 H new ATOM 0 HG3 LYS A 100 8.382 -9.205 2.125 1.00 0.00 H new ATOM 0 HD2 LYS A 100 7.019 -11.128 2.169 1.00 0.00 H new ATOM 0 HD3 LYS A 100 6.040 -9.922 1.357 1.00 0.00 H new ATOM 0 HE2 LYS A 100 7.748 -11.889 -0.196 1.00 0.00 H new ATOM 0 HE3 LYS A 100 6.132 -12.302 0.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 5.616 -11.441 -1.655 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 5.624 -9.974 -0.800 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 6.977 -10.428 -1.720 1.00 0.00 H new ATOM 1642 N VAL A 101 7.817 -5.743 1.731 1.00 0.00 N ATOM 1643 CA VAL A 101 7.369 -5.166 2.970 1.00 0.00 C ATOM 1644 C VAL A 101 5.846 -5.189 3.010 1.00 0.00 C ATOM 1645 O VAL A 101 5.193 -4.934 1.995 1.00 0.00 O ATOM 1646 CB VAL A 101 7.892 -3.728 3.125 1.00 0.00 C ATOM 1647 CG1 VAL A 101 7.353 -2.820 2.027 1.00 0.00 C ATOM 1648 CG2 VAL A 101 7.566 -3.184 4.502 1.00 0.00 C ATOM 0 H VAL A 101 7.387 -5.338 0.899 1.00 0.00 H new ATOM 0 HA VAL A 101 7.762 -5.752 3.800 1.00 0.00 H new ATOM 0 HB VAL A 101 8.977 -3.752 3.021 1.00 0.00 H new ATOM 0 HG11 VAL A 101 7.742 -1.811 2.166 1.00 0.00 H new ATOM 0 HG12 VAL A 101 7.667 -3.199 1.055 1.00 0.00 H new ATOM 0 HG13 VAL A 101 6.264 -2.799 2.074 1.00 0.00 H new ATOM 0 HG21 VAL A 101 7.945 -2.166 4.590 1.00 0.00 H new ATOM 0 HG22 VAL A 101 6.486 -3.183 4.646 1.00 0.00 H new ATOM 0 HG23 VAL A 101 8.033 -3.812 5.261 1.00 0.00 H new ATOM 1658 N ARG A 102 5.280 -5.522 4.157 1.00 0.00 N ATOM 1659 CA ARG A 102 3.841 -5.605 4.273 1.00 0.00 C ATOM 1660 C ARG A 102 3.316 -4.471 5.120 1.00 0.00 C ATOM 1661 O ARG A 102 3.756 -4.271 6.253 1.00 0.00 O ATOM 1662 CB ARG A 102 3.395 -6.924 4.891 1.00 0.00 C ATOM 1663 CG ARG A 102 1.887 -7.144 4.748 1.00 0.00 C ATOM 1664 CD ARG A 102 1.399 -8.365 5.511 1.00 0.00 C ATOM 1665 NE ARG A 102 1.223 -8.070 6.933 1.00 0.00 N ATOM 1666 CZ ARG A 102 0.146 -8.416 7.640 1.00 0.00 C ATOM 1667 NH1 ARG A 102 -0.808 -9.157 7.088 1.00 0.00 N ATOM 1668 NH2 ARG A 102 0.037 -8.035 8.906 1.00 0.00 N ATOM 0 H ARG A 102 5.792 -5.737 5.012 1.00 0.00 H new ATOM 0 HA ARG A 102 3.437 -5.540 3.263 1.00 0.00 H new ATOM 0 HB2 ARG A 102 3.928 -7.746 4.414 1.00 0.00 H new ATOM 0 HB3 ARG A 102 3.665 -6.939 5.947 1.00 0.00 H new ATOM 0 HG2 ARG A 102 1.359 -6.261 5.107 1.00 0.00 H new ATOM 0 HG3 ARG A 102 1.638 -7.256 3.693 1.00 0.00 H new ATOM 0 HD2 ARG A 102 0.454 -8.706 5.089 1.00 0.00 H new ATOM 0 HD3 ARG A 102 2.113 -9.180 5.392 1.00 0.00 H new ATOM 0 HE ARG A 102 1.970 -7.569 7.414 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -0.719 -9.464 6.119 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -1.630 -9.419 7.633 1.00 0.00 H new ATOM 0 HH21 ARG A 102 0.776 -7.479 9.337 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -0.785 -8.298 9.449 1.00 0.00 H new ATOM 1682 N PHE A 103 2.384 -3.727 4.574 1.00 0.00 N ATOM 1683 CA PHE A 103 1.741 -2.678 5.317 1.00 0.00 C ATOM 1684 C PHE A 103 0.273 -3.012 5.499 1.00 0.00 C ATOM 1685 O PHE A 103 -0.534 -2.834 4.587 1.00 0.00 O ATOM 1686 CB PHE A 103 1.910 -1.339 4.604 1.00 0.00 C ATOM 1687 CG PHE A 103 3.342 -0.955 4.374 1.00 0.00 C ATOM 1688 CD1 PHE A 103 4.280 -1.069 5.387 1.00 0.00 C ATOM 1689 CD2 PHE A 103 3.748 -0.458 3.147 1.00 0.00 C ATOM 1690 CE1 PHE A 103 5.591 -0.695 5.182 1.00 0.00 C ATOM 1691 CE2 PHE A 103 5.057 -0.087 2.937 1.00 0.00 C ATOM 1692 CZ PHE A 103 5.979 -0.204 3.954 1.00 0.00 C ATOM 0 H PHE A 103 2.055 -3.832 3.614 1.00 0.00 H new ATOM 0 HA PHE A 103 2.207 -2.595 6.299 1.00 0.00 H new ATOM 0 HB2 PHE A 103 1.396 -1.381 3.644 1.00 0.00 H new ATOM 0 HB3 PHE A 103 1.424 -0.560 5.192 1.00 0.00 H new ATOM 0 HD1 PHE A 103 3.980 -1.456 6.350 1.00 0.00 H new ATOM 0 HD2 PHE A 103 3.030 -0.360 2.346 1.00 0.00 H new ATOM 0 HE1 PHE A 103 6.312 -0.786 5.981 1.00 0.00 H new ATOM 0 HE2 PHE A 103 5.361 0.296 1.974 1.00 0.00 H new ATOM 0 HZ PHE A 103 7.005 0.089 3.789 1.00 0.00 H new ATOM 1702 N ASP A 104 -0.054 -3.545 6.666 1.00 0.00 N ATOM 1703 CA ASP A 104 -1.436 -3.832 7.015 1.00 0.00 C ATOM 1704 C ASP A 104 -2.180 -2.531 7.264 1.00 0.00 C ATOM 1705 O ASP A 104 -2.291 -2.056 8.396 1.00 0.00 O ATOM 1706 CB ASP A 104 -1.509 -4.766 8.233 1.00 0.00 C ATOM 1707 CG ASP A 104 -0.617 -4.324 9.378 1.00 0.00 C ATOM 1708 OD1 ASP A 104 0.623 -4.405 9.235 1.00 0.00 O ATOM 1709 OD2 ASP A 104 -1.148 -3.895 10.423 1.00 0.00 O ATOM 0 H ASP A 104 0.622 -3.788 7.390 1.00 0.00 H new ATOM 0 HA ASP A 104 -1.915 -4.349 6.184 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -2.540 -4.817 8.583 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -1.226 -5.773 7.928 1.00 0.00 H new ATOM 1714 N TYR A 105 -2.677 -1.954 6.184 1.00 0.00 N ATOM 1715 CA TYR A 105 -3.309 -0.656 6.236 1.00 0.00 C ATOM 1716 C TYR A 105 -4.793 -0.812 6.513 1.00 0.00 C ATOM 1717 O TYR A 105 -5.469 -1.639 5.897 1.00 0.00 O ATOM 1718 CB TYR A 105 -3.066 0.096 4.922 1.00 0.00 C ATOM 1719 CG TYR A 105 -3.738 1.447 4.859 1.00 0.00 C ATOM 1720 CD1 TYR A 105 -3.352 2.485 5.696 1.00 0.00 C ATOM 1721 CD2 TYR A 105 -4.756 1.681 3.955 1.00 0.00 C ATOM 1722 CE1 TYR A 105 -3.967 3.720 5.628 1.00 0.00 C ATOM 1723 CE2 TYR A 105 -5.375 2.908 3.882 1.00 0.00 C ATOM 1724 CZ TYR A 105 -4.978 3.926 4.719 1.00 0.00 C ATOM 1725 OH TYR A 105 -5.595 5.160 4.643 1.00 0.00 O ATOM 0 H TYR A 105 -2.652 -2.372 5.254 1.00 0.00 H new ATOM 0 HA TYR A 105 -2.873 -0.073 7.047 1.00 0.00 H new ATOM 0 HB2 TYR A 105 -1.993 0.228 4.783 1.00 0.00 H new ATOM 0 HB3 TYR A 105 -3.422 -0.516 4.093 1.00 0.00 H new ATOM 0 HD1 TYR A 105 -2.559 2.325 6.411 1.00 0.00 H new ATOM 0 HD2 TYR A 105 -5.072 0.887 3.294 1.00 0.00 H new ATOM 0 HE1 TYR A 105 -3.656 4.519 6.285 1.00 0.00 H new ATOM 0 HE2 TYR A 105 -6.170 3.072 3.170 1.00 0.00 H new ATOM 0 HH TYR A 105 -6.437 5.075 4.148 1.00 0.00 H new ATOM 1735 N ASP A 106 -5.288 -0.032 7.455 1.00 0.00 N ATOM 1736 CA ASP A 106 -6.676 -0.118 7.864 1.00 0.00 C ATOM 1737 C ASP A 106 -7.575 0.601 6.865 1.00 0.00 C ATOM 1738 O ASP A 106 -7.637 1.832 6.836 1.00 0.00 O ATOM 1739 CB ASP A 106 -6.830 0.472 9.263 1.00 0.00 C ATOM 1740 CG ASP A 106 -8.234 0.346 9.804 1.00 0.00 C ATOM 1741 OD1 ASP A 106 -8.595 -0.752 10.267 1.00 0.00 O ATOM 1742 OD2 ASP A 106 -8.977 1.351 9.795 1.00 0.00 O ATOM 0 H ASP A 106 -4.745 0.673 7.954 1.00 0.00 H new ATOM 0 HA ASP A 106 -6.980 -1.164 7.888 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -6.139 -0.029 9.941 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -6.548 1.525 9.241 1.00 0.00 H new ATOM 1747 N LEU A 107 -8.247 -0.172 6.024 1.00 0.00 N ATOM 1748 CA LEU A 107 -9.139 0.384 5.026 1.00 0.00 C ATOM 1749 C LEU A 107 -10.492 0.705 5.648 1.00 0.00 C ATOM 1750 O LEU A 107 -11.317 -0.186 5.844 1.00 0.00 O ATOM 1751 CB LEU A 107 -9.340 -0.599 3.876 1.00 0.00 C ATOM 1752 CG LEU A 107 -8.871 -0.118 2.506 1.00 0.00 C ATOM 1753 CD1 LEU A 107 -7.357 -0.149 2.405 1.00 0.00 C ATOM 1754 CD2 LEU A 107 -9.501 -0.968 1.427 1.00 0.00 C ATOM 0 H LEU A 107 -8.188 -1.190 6.016 1.00 0.00 H new ATOM 0 HA LEU A 107 -8.686 1.298 4.642 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -8.814 -1.523 4.116 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -10.400 -0.843 3.812 1.00 0.00 H new ATOM 0 HG LEU A 107 -9.186 0.917 2.371 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -7.051 0.199 1.418 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -6.928 0.501 3.168 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -7.003 -1.169 2.556 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -9.165 -0.623 0.449 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -9.207 -2.008 1.565 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -10.586 -0.887 1.487 1.00 0.00 H new ATOM 1766 N PHE A 108 -10.722 1.968 5.967 1.00 0.00 N ATOM 1767 CA PHE A 108 -12.001 2.370 6.534 1.00 0.00 C ATOM 1768 C PHE A 108 -12.794 3.204 5.539 1.00 0.00 C ATOM 1769 O PHE A 108 -12.229 3.986 4.773 1.00 0.00 O ATOM 1770 CB PHE A 108 -11.820 3.145 7.853 1.00 0.00 C ATOM 1771 CG PHE A 108 -11.106 4.464 7.725 1.00 0.00 C ATOM 1772 CD1 PHE A 108 -11.809 5.625 7.435 1.00 0.00 C ATOM 1773 CD2 PHE A 108 -9.735 4.548 7.911 1.00 0.00 C ATOM 1774 CE1 PHE A 108 -11.159 6.837 7.327 1.00 0.00 C ATOM 1775 CE2 PHE A 108 -9.081 5.760 7.806 1.00 0.00 C ATOM 1776 CZ PHE A 108 -9.794 6.905 7.513 1.00 0.00 C ATOM 0 H PHE A 108 -10.050 2.725 5.846 1.00 0.00 H new ATOM 0 HA PHE A 108 -12.559 1.460 6.754 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -12.803 3.322 8.290 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -11.268 2.517 8.553 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -12.879 5.579 7.292 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -9.172 3.656 8.141 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -11.718 7.732 7.097 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -8.012 5.812 7.953 1.00 0.00 H new ATOM 0 HZ PHE A 108 -9.284 7.853 7.429 1.00 0.00 H new ATOM 1786 N LEU A 109 -14.097 3.015 5.536 1.00 0.00 N ATOM 1787 CA LEU A 109 -14.984 3.828 4.725 1.00 0.00 C ATOM 1788 C LEU A 109 -15.890 4.609 5.667 1.00 0.00 C ATOM 1789 O LEU A 109 -16.151 4.153 6.775 1.00 0.00 O ATOM 1790 CB LEU A 109 -15.813 2.938 3.790 1.00 0.00 C ATOM 1791 CG LEU A 109 -15.018 1.865 3.034 1.00 0.00 C ATOM 1792 CD1 LEU A 109 -15.923 1.069 2.110 1.00 0.00 C ATOM 1793 CD2 LEU A 109 -13.881 2.495 2.247 1.00 0.00 C ATOM 0 H LEU A 109 -14.570 2.301 6.090 1.00 0.00 H new ATOM 0 HA LEU A 109 -14.410 4.515 4.103 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -16.589 2.446 4.376 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -16.318 3.574 3.062 1.00 0.00 H new ATOM 0 HG LEU A 109 -14.594 1.181 3.769 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -15.335 0.315 1.586 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -16.701 0.580 2.696 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -16.383 1.740 1.384 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -13.330 1.717 1.718 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -14.287 3.206 1.527 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -13.210 3.015 2.931 1.00 0.00 H new ATOM 1805 N HIS A 110 -16.345 5.785 5.262 1.00 0.00 N ATOM 1806 CA HIS A 110 -17.204 6.588 6.128 1.00 0.00 C ATOM 1807 C HIS A 110 -18.665 6.358 5.757 1.00 0.00 C ATOM 1808 O HIS A 110 -18.959 5.960 4.632 1.00 0.00 O ATOM 1809 CB HIS A 110 -16.843 8.074 6.025 1.00 0.00 C ATOM 1810 CG HIS A 110 -17.152 8.861 7.264 1.00 0.00 C ATOM 1811 ND1 HIS A 110 -18.201 9.753 7.362 1.00 0.00 N ATOM 1812 CD2 HIS A 110 -16.524 8.892 8.464 1.00 0.00 C ATOM 1813 CE1 HIS A 110 -18.202 10.294 8.568 1.00 0.00 C ATOM 1814 NE2 HIS A 110 -17.196 9.789 9.254 1.00 0.00 N ATOM 0 H HIS A 110 -16.140 6.202 4.354 1.00 0.00 H new ATOM 0 HA HIS A 110 -17.050 6.280 7.162 1.00 0.00 H new ATOM 0 HB2 HIS A 110 -15.780 8.165 5.804 1.00 0.00 H new ATOM 0 HB3 HIS A 110 -17.382 8.511 5.185 1.00 0.00 H new ATOM 0 HD2 HIS A 110 -15.655 8.317 8.746 1.00 0.00 H new ATOM 0 HE1 HIS A 110 -18.908 11.026 8.930 1.00 0.00 H new ATOM 0 HE2 HIS A 110 -16.956 10.027 10.216 1.00 0.00 H new ATOM 1823 N LEU A 111 -19.565 6.601 6.705 1.00 0.00 N ATOM 1824 CA LEU A 111 -20.992 6.302 6.537 1.00 0.00 C ATOM 1825 C LEU A 111 -21.587 6.853 5.242 1.00 0.00 C ATOM 1826 O LEU A 111 -21.251 7.955 4.791 1.00 0.00 O ATOM 1827 CB LEU A 111 -21.784 6.834 7.731 1.00 0.00 C ATOM 1828 CG LEU A 111 -22.412 5.752 8.609 1.00 0.00 C ATOM 1829 CD1 LEU A 111 -23.491 5.003 7.846 1.00 0.00 C ATOM 1830 CD2 LEU A 111 -21.348 4.787 9.091 1.00 0.00 C ATOM 0 H LEU A 111 -19.332 7.009 7.610 1.00 0.00 H new ATOM 0 HA LEU A 111 -21.069 5.216 6.480 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -21.123 7.445 8.346 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -22.574 7.490 7.364 1.00 0.00 H new ATOM 0 HG LEU A 111 -22.871 6.233 9.473 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -23.926 4.237 8.488 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -24.269 5.701 7.536 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -23.054 4.533 6.965 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -21.808 4.021 9.715 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -20.868 4.316 8.233 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -20.602 5.329 9.672 1.00 0.00 H new ATOM 1910 N VAL A 117 -13.276 10.584 3.079 1.00 0.00 N ATOM 1911 CA VAL A 117 -12.179 9.729 3.488 1.00 0.00 C ATOM 1912 C VAL A 117 -10.924 9.976 2.667 1.00 0.00 C ATOM 1913 O VAL A 117 -10.893 9.717 1.467 1.00 0.00 O ATOM 1914 CB VAL A 117 -12.562 8.241 3.415 1.00 0.00 C ATOM 1915 CG1 VAL A 117 -11.342 7.363 3.617 1.00 0.00 C ATOM 1916 CG2 VAL A 117 -13.624 7.911 4.450 1.00 0.00 C ATOM 0 HA VAL A 117 -11.964 9.986 4.525 1.00 0.00 H new ATOM 0 HB VAL A 117 -12.970 8.044 2.423 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -11.635 6.315 3.562 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -10.608 7.576 2.840 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -10.905 7.566 4.595 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -13.882 6.854 4.383 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -13.240 8.128 5.447 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -14.513 8.514 4.264 1.00 0.00 H new ATOM 1926 N ASN A 118 -9.909 10.509 3.325 1.00 0.00 N ATOM 1927 CA ASN A 118 -8.587 10.653 2.735 1.00 0.00 C ATOM 1928 C ASN A 118 -7.532 10.475 3.827 1.00 0.00 C ATOM 1929 O ASN A 118 -7.228 11.418 4.556 1.00 0.00 O ATOM 1930 CB ASN A 118 -8.440 12.030 2.078 1.00 0.00 C ATOM 1931 CG ASN A 118 -7.167 12.153 1.251 1.00 0.00 C ATOM 1932 OD1 ASN A 118 -7.201 12.046 0.030 1.00 0.00 O ATOM 1933 ND2 ASN A 118 -6.031 12.342 1.902 1.00 0.00 N ATOM 0 H ASN A 118 -9.977 10.854 4.282 1.00 0.00 H new ATOM 0 HA ASN A 118 -8.450 9.893 1.966 1.00 0.00 H new ATOM 0 HB2 ASN A 118 -9.303 12.217 1.439 1.00 0.00 H new ATOM 0 HB3 ASN A 118 -8.442 12.799 2.851 1.00 0.00 H new ATOM 0 HD21 ASN A 118 -5.152 12.402 1.388 1.00 0.00 H new ATOM 0 HD22 ASN A 118 -6.034 12.427 2.918 1.00 0.00 H new ATOM 1940 N HIS A 119 -6.971 9.280 3.946 1.00 0.00 N ATOM 1941 CA HIS A 119 -6.046 8.993 5.041 1.00 0.00 C ATOM 1942 C HIS A 119 -4.670 8.605 4.523 1.00 0.00 C ATOM 1943 O HIS A 119 -4.550 7.894 3.527 1.00 0.00 O ATOM 1944 CB HIS A 119 -6.582 7.868 5.923 1.00 0.00 C ATOM 1945 CG HIS A 119 -5.832 7.715 7.213 1.00 0.00 C ATOM 1946 ND1 HIS A 119 -5.382 6.501 7.688 1.00 0.00 N ATOM 1947 CD2 HIS A 119 -5.440 8.638 8.122 1.00 0.00 C ATOM 1948 CE1 HIS A 119 -4.740 6.688 8.827 1.00 0.00 C ATOM 1949 NE2 HIS A 119 -4.762 7.975 9.111 1.00 0.00 N ATOM 0 H HIS A 119 -7.135 8.501 3.309 1.00 0.00 H new ATOM 0 HA HIS A 119 -5.955 9.906 5.629 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -7.633 8.057 6.142 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -6.536 6.929 5.371 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -5.627 9.701 8.076 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -4.276 5.917 9.424 1.00 0.00 H new ATOM 0 HE2 HIS A 119 -4.342 8.407 9.934 1.00 0.00 H new ATOM 1958 N LEU A 120 -3.645 9.055 5.234 1.00 0.00 N ATOM 1959 CA LEU A 120 -2.261 8.782 4.879 1.00 0.00 C ATOM 1960 C LEU A 120 -1.419 8.490 6.115 1.00 0.00 C ATOM 1961 O LEU A 120 -1.642 9.067 7.178 1.00 0.00 O ATOM 1962 CB LEU A 120 -1.685 9.978 4.126 1.00 0.00 C ATOM 1963 CG LEU A 120 -1.930 9.960 2.633 1.00 0.00 C ATOM 1964 CD1 LEU A 120 -1.752 11.345 2.060 1.00 0.00 C ATOM 1965 CD2 LEU A 120 -0.957 9.003 1.976 1.00 0.00 C ATOM 0 H LEU A 120 -3.751 9.621 6.076 1.00 0.00 H new ATOM 0 HA LEU A 120 -2.237 7.898 4.242 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -2.112 10.891 4.540 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -0.610 10.020 4.304 1.00 0.00 H new ATOM 0 HG LEU A 120 -2.951 9.630 2.441 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -1.931 11.320 0.985 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -2.461 12.027 2.530 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -0.736 11.690 2.251 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -1.132 8.988 0.900 1.00 0.00 H new ATOM 0 HD22 LEU A 120 0.064 9.330 2.174 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -1.102 8.001 2.381 1.00 0.00 H new ATOM 1977 N ARG A 121 -0.466 7.578 5.966 1.00 0.00 N ATOM 1978 CA ARG A 121 0.484 7.254 7.025 1.00 0.00 C ATOM 1979 C ARG A 121 1.798 6.779 6.416 1.00 0.00 C ATOM 1980 O ARG A 121 1.806 6.139 5.364 1.00 0.00 O ATOM 1981 CB ARG A 121 -0.096 6.203 7.982 1.00 0.00 C ATOM 1982 CG ARG A 121 -0.658 4.961 7.301 1.00 0.00 C ATOM 1983 CD ARG A 121 0.370 3.837 7.189 1.00 0.00 C ATOM 1984 NE ARG A 121 0.841 3.387 8.498 1.00 0.00 N ATOM 1985 CZ ARG A 121 0.841 2.112 8.891 1.00 0.00 C ATOM 1986 NH1 ARG A 121 0.412 1.157 8.073 1.00 0.00 N ATOM 1987 NH2 ARG A 121 1.274 1.790 10.100 1.00 0.00 N ATOM 0 H ARG A 121 -0.329 7.042 5.109 1.00 0.00 H new ATOM 0 HA ARG A 121 0.678 8.154 7.609 1.00 0.00 H new ATOM 0 HB2 ARG A 121 0.684 5.897 8.679 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -0.887 6.666 8.572 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -1.522 4.604 7.861 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -1.011 5.226 6.304 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -0.071 2.996 6.654 1.00 0.00 H new ATOM 0 HD3 ARG A 121 1.219 4.181 6.598 1.00 0.00 H new ATOM 0 HE ARG A 121 1.190 4.090 9.150 1.00 0.00 H new ATOM 0 HH11 ARG A 121 0.080 1.397 7.139 1.00 0.00 H new ATOM 0 HH12 ARG A 121 0.414 0.184 8.379 1.00 0.00 H new ATOM 0 HH21 ARG A 121 1.608 2.517 10.732 1.00 0.00 H new ATOM 0 HH22 ARG A 121 1.273 0.815 10.399 1.00 0.00 H new ATOM 2001 N CYS A 122 2.900 7.086 7.074 1.00 0.00 N ATOM 2002 CA CYS A 122 4.215 6.838 6.509 1.00 0.00 C ATOM 2003 C CYS A 122 4.985 5.780 7.297 1.00 0.00 C ATOM 2004 O CYS A 122 5.044 5.824 8.525 1.00 0.00 O ATOM 2005 CB CYS A 122 4.996 8.145 6.468 1.00 0.00 C ATOM 2006 SG CYS A 122 5.124 8.970 8.070 1.00 0.00 S ATOM 0 H CYS A 122 2.912 7.508 8.002 1.00 0.00 H new ATOM 0 HA CYS A 122 4.087 6.451 5.498 1.00 0.00 H new ATOM 0 HB2 CYS A 122 5.999 7.946 6.091 1.00 0.00 H new ATOM 0 HB3 CYS A 122 4.518 8.821 5.759 1.00 0.00 H new ATOM 0 HG CYS A 122 5.150 8.079 9.016 1.00 0.00 H new ATOM 2012 N GLU A 123 5.563 4.833 6.576 1.00 0.00 N ATOM 2013 CA GLU A 123 6.348 3.761 7.166 1.00 0.00 C ATOM 2014 C GLU A 123 7.827 3.943 6.837 1.00 0.00 C ATOM 2015 O GLU A 123 8.174 4.490 5.792 1.00 0.00 O ATOM 2016 CB GLU A 123 5.845 2.423 6.632 1.00 0.00 C ATOM 2017 CG GLU A 123 4.417 2.124 7.055 1.00 0.00 C ATOM 2018 CD GLU A 123 4.354 1.339 8.351 1.00 0.00 C ATOM 2019 OE1 GLU A 123 4.503 1.951 9.432 1.00 0.00 O ATOM 2020 OE2 GLU A 123 4.169 0.104 8.304 1.00 0.00 O ATOM 0 H GLU A 123 5.500 4.786 5.559 1.00 0.00 H new ATOM 0 HA GLU A 123 6.237 3.784 8.250 1.00 0.00 H new ATOM 0 HB2 GLU A 123 5.905 2.425 5.544 1.00 0.00 H new ATOM 0 HB3 GLU A 123 6.499 1.626 6.986 1.00 0.00 H new ATOM 0 HG2 GLU A 123 3.872 3.060 7.173 1.00 0.00 H new ATOM 0 HG3 GLU A 123 3.917 1.561 6.267 1.00 0.00 H new ATOM 2027 N LYS A 124 8.691 3.480 7.725 1.00 0.00 N ATOM 2028 CA LYS A 124 10.129 3.665 7.568 1.00 0.00 C ATOM 2029 C LYS A 124 10.859 2.334 7.691 1.00 0.00 C ATOM 2030 O LYS A 124 10.565 1.534 8.580 1.00 0.00 O ATOM 2031 CB LYS A 124 10.639 4.638 8.629 1.00 0.00 C ATOM 2032 CG LYS A 124 12.144 4.861 8.603 1.00 0.00 C ATOM 2033 CD LYS A 124 12.642 5.481 9.887 1.00 0.00 C ATOM 2034 CE LYS A 124 12.594 4.478 11.027 1.00 0.00 C ATOM 2035 NZ LYS A 124 11.247 4.392 11.660 1.00 0.00 N ATOM 0 H LYS A 124 8.422 2.971 8.567 1.00 0.00 H new ATOM 0 HA LYS A 124 10.323 4.073 6.576 1.00 0.00 H new ATOM 0 HB2 LYS A 124 10.139 5.597 8.496 1.00 0.00 H new ATOM 0 HB3 LYS A 124 10.356 4.265 9.613 1.00 0.00 H new ATOM 0 HG2 LYS A 124 12.650 3.909 8.439 1.00 0.00 H new ATOM 0 HG3 LYS A 124 12.401 5.507 7.764 1.00 0.00 H new ATOM 0 HD2 LYS A 124 13.664 5.836 9.752 1.00 0.00 H new ATOM 0 HD3 LYS A 124 12.033 6.350 10.136 1.00 0.00 H new ATOM 0 HE2 LYS A 124 12.879 3.495 10.653 1.00 0.00 H new ATOM 0 HE3 LYS A 124 13.329 4.757 11.782 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 11.344 4.460 12.693 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 10.651 5.172 11.316 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 10.805 3.484 11.413 1.00 0.00 H new ATOM 2049 N LEU A 125 11.802 2.099 6.792 1.00 0.00 N ATOM 2050 CA LEU A 125 12.559 0.857 6.779 1.00 0.00 C ATOM 2051 C LEU A 125 14.058 1.148 6.845 1.00 0.00 C ATOM 2052 O LEU A 125 14.651 1.561 5.851 1.00 0.00 O ATOM 2053 CB LEU A 125 12.236 0.090 5.493 1.00 0.00 C ATOM 2054 CG LEU A 125 10.743 -0.030 5.168 1.00 0.00 C ATOM 2055 CD1 LEU A 125 10.495 0.084 3.669 1.00 0.00 C ATOM 2056 CD2 LEU A 125 10.201 -1.351 5.685 1.00 0.00 C ATOM 0 H LEU A 125 12.063 2.757 6.057 1.00 0.00 H new ATOM 0 HA LEU A 125 12.284 0.258 7.647 1.00 0.00 H new ATOM 0 HB2 LEU A 125 12.736 0.583 4.659 1.00 0.00 H new ATOM 0 HB3 LEU A 125 12.657 -0.912 5.570 1.00 0.00 H new ATOM 0 HG LEU A 125 10.223 0.791 5.662 1.00 0.00 H new ATOM 0 HD11 LEU A 125 9.427 -0.005 3.469 1.00 0.00 H new ATOM 0 HD12 LEU A 125 10.851 1.051 3.314 1.00 0.00 H new ATOM 0 HD13 LEU A 125 11.029 -0.712 3.150 1.00 0.00 H new ATOM 0 HD21 LEU A 125 9.140 -1.426 5.449 1.00 0.00 H new ATOM 0 HD22 LEU A 125 10.737 -2.174 5.212 1.00 0.00 H new ATOM 0 HD23 LEU A 125 10.337 -1.402 6.765 1.00 0.00 H new ATOM 2068 N THR A 126 14.665 0.950 8.012 1.00 0.00 N ATOM 2069 CA THR A 126 16.096 1.212 8.178 1.00 0.00 C ATOM 2070 C THR A 126 16.899 -0.074 8.012 1.00 0.00 C ATOM 2071 O THR A 126 16.742 -1.020 8.785 1.00 0.00 O ATOM 2072 CB THR A 126 16.411 1.808 9.564 1.00 0.00 C ATOM 2073 OG1 THR A 126 15.321 2.635 9.998 1.00 0.00 O ATOM 2074 CG2 THR A 126 17.677 2.649 9.515 1.00 0.00 C ATOM 0 H THR A 126 14.195 0.612 8.852 1.00 0.00 H new ATOM 0 HA THR A 126 16.376 1.933 7.410 1.00 0.00 H new ATOM 0 HB THR A 126 16.557 0.984 10.262 1.00 0.00 H new ATOM 0 HG1 THR A 126 15.526 3.010 10.880 1.00 0.00 H new ATOM 0 HG21 THR A 126 17.880 3.059 10.504 1.00 0.00 H new ATOM 0 HG22 THR A 126 18.515 2.027 9.202 1.00 0.00 H new ATOM 0 HG23 THR A 126 17.545 3.465 8.804 1.00 0.00 H new ATOM 2082 N PHE A 127 17.752 -0.110 7.002 1.00 0.00 N ATOM 2083 CA PHE A 127 18.572 -1.278 6.732 1.00 0.00 C ATOM 2084 C PHE A 127 19.997 -1.025 7.187 1.00 0.00 C ATOM 2085 O PHE A 127 20.720 -0.227 6.586 1.00 0.00 O ATOM 2086 CB PHE A 127 18.542 -1.600 5.238 1.00 0.00 C ATOM 2087 CG PHE A 127 17.152 -1.801 4.714 1.00 0.00 C ATOM 2088 CD1 PHE A 127 16.542 -3.044 4.768 1.00 0.00 C ATOM 2089 CD2 PHE A 127 16.451 -0.735 4.178 1.00 0.00 C ATOM 2090 CE1 PHE A 127 15.260 -3.215 4.299 1.00 0.00 C ATOM 2091 CE2 PHE A 127 15.171 -0.900 3.705 1.00 0.00 C ATOM 2092 CZ PHE A 127 14.572 -2.142 3.765 1.00 0.00 C ATOM 0 H PHE A 127 17.895 0.663 6.351 1.00 0.00 H new ATOM 0 HA PHE A 127 18.174 -2.130 7.283 1.00 0.00 H new ATOM 0 HB2 PHE A 127 19.019 -0.790 4.687 1.00 0.00 H new ATOM 0 HB3 PHE A 127 19.129 -2.500 5.053 1.00 0.00 H new ATOM 0 HD1 PHE A 127 17.077 -3.886 5.182 1.00 0.00 H new ATOM 0 HD2 PHE A 127 16.915 0.239 4.131 1.00 0.00 H new ATOM 0 HE1 PHE A 127 14.792 -4.187 4.348 1.00 0.00 H new ATOM 0 HE2 PHE A 127 14.635 -0.060 3.288 1.00 0.00 H new ATOM 0 HZ PHE A 127 13.566 -2.275 3.395 1.00 0.00 H new ATOM 2102 N ASN A 128 20.391 -1.689 8.261 1.00 0.00 N ATOM 2103 CA ASN A 128 21.721 -1.502 8.816 1.00 0.00 C ATOM 2104 C ASN A 128 22.773 -2.136 7.915 1.00 0.00 C ATOM 2105 O ASN A 128 22.756 -3.349 7.695 1.00 0.00 O ATOM 2106 CB ASN A 128 21.818 -2.102 10.218 1.00 0.00 C ATOM 2107 CG ASN A 128 20.959 -1.378 11.239 1.00 0.00 C ATOM 2108 OD1 ASN A 128 21.397 -0.411 11.861 1.00 0.00 O ATOM 2109 ND2 ASN A 128 19.735 -1.849 11.431 1.00 0.00 N ATOM 0 H ASN A 128 19.811 -2.360 8.764 1.00 0.00 H new ATOM 0 HA ASN A 128 21.905 -0.430 8.880 1.00 0.00 H new ATOM 0 HB2 ASN A 128 21.520 -3.150 10.179 1.00 0.00 H new ATOM 0 HB3 ASN A 128 22.857 -2.078 10.545 1.00 0.00 H new ATOM 0 HD21 ASN A 128 19.120 -1.407 12.114 1.00 0.00 H new ATOM 0 HD22 ASN A 128 19.408 -2.653 10.895 1.00 0.00 H new ATOM 2116 N ASN A 129 23.665 -1.299 7.391 1.00 0.00 N ATOM 2117 CA ASN A 129 24.815 -1.742 6.595 1.00 0.00 C ATOM 2118 C ASN A 129 24.421 -2.688 5.460 1.00 0.00 C ATOM 2119 O ASN A 129 24.666 -3.894 5.535 1.00 0.00 O ATOM 2120 CB ASN A 129 25.858 -2.415 7.491 1.00 0.00 C ATOM 2121 CG ASN A 129 26.438 -1.457 8.521 1.00 0.00 C ATOM 2122 OD1 ASN A 129 26.719 -0.299 8.209 1.00 0.00 O ATOM 2123 ND2 ASN A 129 26.564 -1.897 9.772 1.00 0.00 N ATOM 0 H ASN A 129 23.613 -0.287 7.505 1.00 0.00 H new ATOM 0 HA ASN A 129 25.241 -0.848 6.139 1.00 0.00 H new ATOM 0 HB2 ASN A 129 25.402 -3.263 8.003 1.00 0.00 H new ATOM 0 HB3 ASN A 129 26.663 -2.812 6.873 1.00 0.00 H new ATOM 0 HD21 ASN A 129 26.901 -1.269 10.502 1.00 0.00 H new ATOM 0 HD22 ASN A 129 26.323 -2.862 10.000 1.00 0.00 H new ATOM 2130 N PRO A 130 23.815 -2.157 4.389 1.00 0.00 N ATOM 2131 CA PRO A 130 23.467 -2.947 3.217 1.00 0.00 C ATOM 2132 C PRO A 130 24.633 -3.047 2.234 1.00 0.00 C ATOM 2133 O PRO A 130 25.563 -2.233 2.273 1.00 0.00 O ATOM 2134 CB PRO A 130 22.308 -2.157 2.613 1.00 0.00 C ATOM 2135 CG PRO A 130 22.578 -0.734 2.978 1.00 0.00 C ATOM 2136 CD PRO A 130 23.414 -0.747 4.236 1.00 0.00 C ATOM 0 HA PRO A 130 23.215 -3.979 3.459 1.00 0.00 H new ATOM 0 HB2 PRO A 130 22.264 -2.285 1.531 1.00 0.00 H new ATOM 0 HB3 PRO A 130 21.351 -2.492 3.013 1.00 0.00 H new ATOM 0 HG2 PRO A 130 23.104 -0.223 2.172 1.00 0.00 H new ATOM 0 HG3 PRO A 130 21.645 -0.195 3.142 1.00 0.00 H new ATOM 0 HD2 PRO A 130 24.282 -0.094 4.144 1.00 0.00 H new ATOM 0 HD3 PRO A 130 22.843 -0.400 5.097 1.00 0.00 H new ATOM 2144 N THR A 131 24.587 -4.056 1.369 1.00 0.00 N ATOM 2145 CA THR A 131 25.619 -4.243 0.350 1.00 0.00 C ATOM 2146 C THR A 131 25.608 -3.079 -0.639 1.00 0.00 C ATOM 2147 O THR A 131 24.636 -2.318 -0.684 1.00 0.00 O ATOM 2148 CB THR A 131 25.445 -5.575 -0.423 1.00 0.00 C ATOM 2149 OG1 THR A 131 26.485 -5.730 -1.400 1.00 0.00 O ATOM 2150 CG2 THR A 131 24.091 -5.625 -1.112 1.00 0.00 C ATOM 0 H THR A 131 23.847 -4.758 1.352 1.00 0.00 H new ATOM 0 HA THR A 131 26.576 -4.278 0.871 1.00 0.00 H new ATOM 0 HB THR A 131 25.506 -6.390 0.298 1.00 0.00 H new ATOM 0 HG1 THR A 131 26.361 -6.577 -1.878 1.00 0.00 H new ATOM 0 HG21 THR A 131 23.990 -6.568 -1.648 1.00 0.00 H new ATOM 0 HG22 THR A 131 23.300 -5.545 -0.366 1.00 0.00 H new ATOM 0 HG23 THR A 131 24.010 -4.797 -1.816 1.00 0.00 H new ATOM 2158 N GLU A 132 26.669 -2.948 -1.431 1.00 0.00 N ATOM 2159 CA GLU A 132 26.827 -1.793 -2.317 1.00 0.00 C ATOM 2160 C GLU A 132 25.613 -1.644 -3.234 1.00 0.00 C ATOM 2161 O GLU A 132 25.101 -0.542 -3.416 1.00 0.00 O ATOM 2162 CB GLU A 132 28.096 -1.897 -3.168 1.00 0.00 C ATOM 2163 CG GLU A 132 28.563 -0.555 -3.705 1.00 0.00 C ATOM 2164 CD GLU A 132 29.096 0.354 -2.614 1.00 0.00 C ATOM 2165 OE1 GLU A 132 28.281 0.987 -1.913 1.00 0.00 O ATOM 2166 OE2 GLU A 132 30.335 0.447 -2.459 1.00 0.00 O ATOM 0 H GLU A 132 27.431 -3.624 -1.479 1.00 0.00 H new ATOM 0 HA GLU A 132 26.912 -0.913 -1.679 1.00 0.00 H new ATOM 0 HB2 GLU A 132 28.892 -2.340 -2.570 1.00 0.00 H new ATOM 0 HB3 GLU A 132 27.912 -2.572 -4.004 1.00 0.00 H new ATOM 0 HG2 GLU A 132 29.341 -0.717 -4.451 1.00 0.00 H new ATOM 0 HG3 GLU A 132 27.734 -0.061 -4.212 1.00 0.00 H new ATOM 2173 N ASP A 133 25.149 -2.765 -3.787 1.00 0.00 N ATOM 2174 CA ASP A 133 24.000 -2.772 -4.703 1.00 0.00 C ATOM 2175 C ASP A 133 22.764 -2.154 -4.059 1.00 0.00 C ATOM 2176 O ASP A 133 22.154 -1.236 -4.617 1.00 0.00 O ATOM 2177 CB ASP A 133 23.657 -4.194 -5.159 1.00 0.00 C ATOM 2178 CG ASP A 133 24.663 -4.770 -6.132 1.00 0.00 C ATOM 2179 OD1 ASP A 133 25.883 -4.660 -5.884 1.00 0.00 O ATOM 2180 OD2 ASP A 133 24.237 -5.338 -7.160 1.00 0.00 O ATOM 0 H ASP A 133 25.552 -3.687 -3.617 1.00 0.00 H new ATOM 0 HA ASP A 133 24.292 -2.174 -5.567 1.00 0.00 H new ATOM 0 HB2 ASP A 133 23.594 -4.843 -4.285 1.00 0.00 H new ATOM 0 HB3 ASP A 133 22.672 -4.191 -5.625 1.00 0.00 H new ATOM 2185 N PHE A 134 22.395 -2.662 -2.887 1.00 0.00 N ATOM 2186 CA PHE A 134 21.208 -2.181 -2.195 1.00 0.00 C ATOM 2187 C PHE A 134 21.406 -0.730 -1.790 1.00 0.00 C ATOM 2188 O PHE A 134 20.558 0.123 -2.053 1.00 0.00 O ATOM 2189 CB PHE A 134 20.905 -3.035 -0.958 1.00 0.00 C ATOM 2190 CG PHE A 134 19.478 -2.892 -0.503 1.00 0.00 C ATOM 2191 CD1 PHE A 134 18.470 -2.715 -1.436 1.00 0.00 C ATOM 2192 CD2 PHE A 134 19.140 -2.927 0.841 1.00 0.00 C ATOM 2193 CE1 PHE A 134 17.161 -2.577 -1.046 1.00 0.00 C ATOM 2194 CE2 PHE A 134 17.823 -2.789 1.239 1.00 0.00 C ATOM 2195 CZ PHE A 134 16.832 -2.613 0.292 1.00 0.00 C ATOM 0 H PHE A 134 22.899 -3.403 -2.400 1.00 0.00 H new ATOM 0 HA PHE A 134 20.359 -2.258 -2.874 1.00 0.00 H new ATOM 0 HB2 PHE A 134 21.110 -4.082 -1.183 1.00 0.00 H new ATOM 0 HB3 PHE A 134 21.574 -2.746 -0.147 1.00 0.00 H new ATOM 0 HD1 PHE A 134 18.718 -2.685 -2.487 1.00 0.00 H new ATOM 0 HD2 PHE A 134 19.912 -3.063 1.584 1.00 0.00 H new ATOM 0 HE1 PHE A 134 16.388 -2.440 -1.788 1.00 0.00 H new ATOM 0 HE2 PHE A 134 17.569 -2.819 2.288 1.00 0.00 H new ATOM 0 HZ PHE A 134 15.802 -2.504 0.600 1.00 0.00 H new ATOM 2205 N ARG A 135 22.550 -0.470 -1.170 1.00 0.00 N ATOM 2206 CA ARG A 135 22.968 0.874 -0.799 1.00 0.00 C ATOM 2207 C ARG A 135 22.802 1.842 -1.966 1.00 0.00 C ATOM 2208 O ARG A 135 22.156 2.874 -1.837 1.00 0.00 O ATOM 2209 CB ARG A 135 24.410 0.811 -0.334 1.00 0.00 C ATOM 2210 CG ARG A 135 25.110 2.177 -0.302 1.00 0.00 C ATOM 2211 CD ARG A 135 25.257 2.760 1.100 1.00 0.00 C ATOM 2212 NE ARG A 135 25.817 4.109 1.069 1.00 0.00 N ATOM 2213 CZ ARG A 135 25.672 5.006 2.043 1.00 0.00 C ATOM 2214 NH1 ARG A 135 24.958 4.711 3.123 1.00 0.00 N ATOM 2215 NH2 ARG A 135 26.241 6.199 1.933 1.00 0.00 N ATOM 0 H ARG A 135 23.219 -1.194 -0.908 1.00 0.00 H new ATOM 0 HA ARG A 135 22.339 1.248 0.009 1.00 0.00 H new ATOM 0 HB2 ARG A 135 24.442 0.373 0.664 1.00 0.00 H new ATOM 0 HB3 ARG A 135 24.966 0.144 -0.993 1.00 0.00 H new ATOM 0 HG2 ARG A 135 26.099 2.079 -0.750 1.00 0.00 H new ATOM 0 HG3 ARG A 135 24.548 2.878 -0.920 1.00 0.00 H new ATOM 0 HD2 ARG A 135 24.283 2.782 1.589 1.00 0.00 H new ATOM 0 HD3 ARG A 135 25.899 2.113 1.697 1.00 0.00 H new ATOM 0 HE ARG A 135 26.355 4.382 0.247 1.00 0.00 H new ATOM 0 HH11 ARG A 135 24.518 3.795 3.209 1.00 0.00 H new ATOM 0 HH12 ARG A 135 24.849 5.401 3.867 1.00 0.00 H new ATOM 0 HH21 ARG A 135 26.789 6.428 1.104 1.00 0.00 H new ATOM 0 HH22 ARG A 135 26.131 6.887 2.678 1.00 0.00 H new ATOM 2229 N ARG A 136 23.349 1.455 -3.105 1.00 0.00 N ATOM 2230 CA ARG A 136 23.324 2.242 -4.323 1.00 0.00 C ATOM 2231 C ARG A 136 21.928 2.758 -4.652 1.00 0.00 C ATOM 2232 O ARG A 136 21.711 3.961 -4.802 1.00 0.00 O ATOM 2233 CB ARG A 136 23.780 1.349 -5.442 1.00 0.00 C ATOM 2234 CG ARG A 136 24.980 1.833 -6.221 1.00 0.00 C ATOM 2235 CD ARG A 136 25.445 0.751 -7.182 1.00 0.00 C ATOM 2236 NE ARG A 136 24.421 0.412 -8.173 1.00 0.00 N ATOM 2237 CZ ARG A 136 24.192 -0.823 -8.621 1.00 0.00 C ATOM 2238 NH1 ARG A 136 24.915 -1.842 -8.174 1.00 0.00 N ATOM 2239 NH2 ARG A 136 23.235 -1.039 -9.518 1.00 0.00 N ATOM 0 H ARG A 136 23.834 0.564 -3.210 1.00 0.00 H new ATOM 0 HA ARG A 136 23.971 3.110 -4.192 1.00 0.00 H new ATOM 0 HB2 ARG A 136 24.011 0.368 -5.027 1.00 0.00 H new ATOM 0 HB3 ARG A 136 22.950 1.215 -6.136 1.00 0.00 H new ATOM 0 HG2 ARG A 136 24.725 2.737 -6.774 1.00 0.00 H new ATOM 0 HG3 ARG A 136 25.787 2.095 -5.537 1.00 0.00 H new ATOM 0 HD2 ARG A 136 26.347 1.086 -7.694 1.00 0.00 H new ATOM 0 HD3 ARG A 136 25.712 -0.143 -6.618 1.00 0.00 H new ATOM 0 HE ARG A 136 23.847 1.169 -8.544 1.00 0.00 H new ATOM 0 HH11 ARG A 136 25.650 -1.682 -7.485 1.00 0.00 H new ATOM 0 HH12 ARG A 136 24.736 -2.785 -8.520 1.00 0.00 H new ATOM 0 HH21 ARG A 136 22.675 -0.260 -9.864 1.00 0.00 H new ATOM 0 HH22 ARG A 136 23.061 -1.984 -9.860 1.00 0.00 H new ATOM 2253 N LYS A 137 20.988 1.831 -4.772 1.00 0.00 N ATOM 2254 CA LYS A 137 19.627 2.167 -5.173 1.00 0.00 C ATOM 2255 C LYS A 137 18.921 2.994 -4.101 1.00 0.00 C ATOM 2256 O LYS A 137 18.245 3.988 -4.408 1.00 0.00 O ATOM 2257 CB LYS A 137 18.831 0.892 -5.488 1.00 0.00 C ATOM 2258 CG LYS A 137 19.240 0.224 -6.804 1.00 0.00 C ATOM 2259 CD LYS A 137 18.484 -1.074 -7.053 1.00 0.00 C ATOM 2260 CE LYS A 137 19.291 -2.272 -6.572 1.00 0.00 C ATOM 2261 NZ LYS A 137 18.519 -3.538 -6.588 1.00 0.00 N ATOM 0 H LYS A 137 21.142 0.838 -4.597 1.00 0.00 H new ATOM 0 HA LYS A 137 19.682 2.774 -6.076 1.00 0.00 H new ATOM 0 HB2 LYS A 137 18.963 0.181 -4.673 1.00 0.00 H new ATOM 0 HB3 LYS A 137 17.770 1.137 -5.529 1.00 0.00 H new ATOM 0 HG2 LYS A 137 19.058 0.912 -7.630 1.00 0.00 H new ATOM 0 HG3 LYS A 137 20.311 0.021 -6.788 1.00 0.00 H new ATOM 0 HD2 LYS A 137 17.524 -1.046 -6.537 1.00 0.00 H new ATOM 0 HD3 LYS A 137 18.271 -1.177 -8.117 1.00 0.00 H new ATOM 0 HE2 LYS A 137 20.174 -2.384 -7.201 1.00 0.00 H new ATOM 0 HE3 LYS A 137 19.644 -2.081 -5.558 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 19.172 -4.344 -6.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 17.861 -3.554 -5.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 17.981 -3.605 -7.476 1.00 0.00 H new ATOM 2275 N LEU A 138 19.098 2.590 -2.847 1.00 0.00 N ATOM 2276 CA LEU A 138 18.531 3.318 -1.709 1.00 0.00 C ATOM 2277 C LEU A 138 18.983 4.784 -1.711 1.00 0.00 C ATOM 2278 O LEU A 138 18.232 5.671 -1.309 1.00 0.00 O ATOM 2279 CB LEU A 138 18.930 2.659 -0.385 1.00 0.00 C ATOM 2280 CG LEU A 138 18.535 1.188 -0.214 1.00 0.00 C ATOM 2281 CD1 LEU A 138 18.732 0.747 1.226 1.00 0.00 C ATOM 2282 CD2 LEU A 138 17.101 0.951 -0.645 1.00 0.00 C ATOM 0 H LEU A 138 19.631 1.760 -2.589 1.00 0.00 H new ATOM 0 HA LEU A 138 17.446 3.285 -1.808 1.00 0.00 H new ATOM 0 HB2 LEU A 138 20.012 2.738 -0.276 1.00 0.00 H new ATOM 0 HB3 LEU A 138 18.485 3.230 0.430 1.00 0.00 H new ATOM 0 HG LEU A 138 19.184 0.592 -0.856 1.00 0.00 H new ATOM 0 HD11 LEU A 138 18.446 -0.300 1.328 1.00 0.00 H new ATOM 0 HD12 LEU A 138 19.779 0.866 1.503 1.00 0.00 H new ATOM 0 HD13 LEU A 138 18.112 1.358 1.882 1.00 0.00 H new ATOM 0 HD21 LEU A 138 16.850 -0.101 -0.512 1.00 0.00 H new ATOM 0 HD22 LEU A 138 16.433 1.563 -0.039 1.00 0.00 H new ATOM 0 HD23 LEU A 138 16.987 1.221 -1.695 1.00 0.00 H new ATOM 2294 N LEU A 139 20.209 5.027 -2.173 1.00 0.00 N ATOM 2295 CA LEU A 139 20.776 6.377 -2.214 1.00 0.00 C ATOM 2296 C LEU A 139 20.207 7.189 -3.370 1.00 0.00 C ATOM 2297 O LEU A 139 20.016 8.400 -3.255 1.00 0.00 O ATOM 2298 CB LEU A 139 22.295 6.306 -2.358 1.00 0.00 C ATOM 2299 CG LEU A 139 23.004 5.486 -1.292 1.00 0.00 C ATOM 2300 CD1 LEU A 139 24.463 5.285 -1.660 1.00 0.00 C ATOM 2301 CD2 LEU A 139 22.869 6.158 0.059 1.00 0.00 C ATOM 0 H LEU A 139 20.833 4.302 -2.527 1.00 0.00 H new ATOM 0 HA LEU A 139 20.511 6.870 -1.279 1.00 0.00 H new ATOM 0 HB2 LEU A 139 22.533 5.887 -3.336 1.00 0.00 H new ATOM 0 HB3 LEU A 139 22.694 7.320 -2.340 1.00 0.00 H new ATOM 0 HG LEU A 139 22.535 4.504 -1.232 1.00 0.00 H new ATOM 0 HD11 LEU A 139 24.956 4.696 -0.886 1.00 0.00 H new ATOM 0 HD12 LEU A 139 24.529 4.760 -2.613 1.00 0.00 H new ATOM 0 HD13 LEU A 139 24.954 6.255 -1.745 1.00 0.00 H new ATOM 0 HD21 LEU A 139 23.381 5.562 0.815 1.00 0.00 H new ATOM 0 HD22 LEU A 139 23.315 7.152 0.017 1.00 0.00 H new ATOM 0 HD23 LEU A 139 21.814 6.245 0.318 1.00 0.00 H new ATOM 2313 N LYS A 140 19.961 6.518 -4.489 1.00 0.00 N ATOM 2314 CA LYS A 140 19.451 7.178 -5.686 1.00 0.00 C ATOM 2315 C LYS A 140 18.064 7.749 -5.456 1.00 0.00 C ATOM 2316 O LYS A 140 17.644 8.674 -6.150 1.00 0.00 O ATOM 2317 CB LYS A 140 19.422 6.216 -6.861 1.00 0.00 C ATOM 2318 CG LYS A 140 20.413 6.580 -7.952 1.00 0.00 C ATOM 2319 CD LYS A 140 20.704 5.401 -8.859 1.00 0.00 C ATOM 2320 CE LYS A 140 21.627 4.408 -8.195 1.00 0.00 C ATOM 2321 NZ LYS A 140 22.995 4.960 -8.009 1.00 0.00 N ATOM 0 H LYS A 140 20.107 5.514 -4.593 1.00 0.00 H new ATOM 0 HA LYS A 140 20.128 8.001 -5.916 1.00 0.00 H new ATOM 0 HB2 LYS A 140 19.637 5.209 -6.504 1.00 0.00 H new ATOM 0 HB3 LYS A 140 18.417 6.197 -7.283 1.00 0.00 H new ATOM 0 HG2 LYS A 140 20.017 7.405 -8.543 1.00 0.00 H new ATOM 0 HG3 LYS A 140 21.341 6.929 -7.499 1.00 0.00 H new ATOM 0 HD2 LYS A 140 19.770 4.908 -9.128 1.00 0.00 H new ATOM 0 HD3 LYS A 140 21.155 5.756 -9.786 1.00 0.00 H new ATOM 0 HE2 LYS A 140 21.216 4.122 -7.227 1.00 0.00 H new ATOM 0 HE3 LYS A 140 21.680 3.502 -8.799 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 23.684 4.182 -7.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 23.218 5.606 -8.793 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 23.040 5.479 -7.109 1.00 0.00 H new ATOM 2335 N ALA A 141 17.350 7.168 -4.509 1.00 0.00 N ATOM 2336 CA ALA A 141 16.065 7.707 -4.089 1.00 0.00 C ATOM 2337 C ALA A 141 16.223 9.127 -3.545 1.00 0.00 C ATOM 2338 O ALA A 141 15.920 10.091 -4.279 1.00 0.00 O ATOM 2339 CB ALA A 141 15.440 6.807 -3.040 1.00 0.00 C ATOM 2340 OXT ALA A 141 16.668 9.277 -2.386 1.00 0.00 O ATOM 0 H ALA A 141 17.636 6.323 -4.015 1.00 0.00 H new ATOM 0 HA ALA A 141 15.408 7.747 -4.958 1.00 0.00 H new ATOM 0 HB1 ALA A 141 14.479 7.219 -2.733 1.00 0.00 H new ATOM 0 HB2 ALA A 141 15.291 5.811 -3.457 1.00 0.00 H new ATOM 0 HB3 ALA A 141 16.101 6.743 -2.175 1.00 0.00 H new ATOM 2385 N ALA B 215 -18.123 3.290 8.301 1.00 0.00 N ATOM 2386 CA ALA B 215 -19.023 2.245 7.843 1.00 0.00 C ATOM 2387 C ALA B 215 -18.661 0.902 8.471 1.00 0.00 C ATOM 2388 O ALA B 215 -17.506 0.689 8.855 1.00 0.00 O ATOM 2389 CB ALA B 215 -18.964 2.156 6.324 1.00 0.00 C ATOM 0 HA ALA B 215 -20.039 2.494 8.150 1.00 0.00 H new ATOM 0 HB1 ALA B 215 -19.639 1.372 5.979 1.00 0.00 H new ATOM 0 HB2 ALA B 215 -19.265 3.110 5.892 1.00 0.00 H new ATOM 0 HB3 ALA B 215 -17.946 1.921 6.013 1.00 0.00 H new ATOM 2395 N PRO B 216 -19.642 -0.011 8.586 1.00 0.00 N ATOM 2396 CA PRO B 216 -19.430 -1.345 9.161 1.00 0.00 C ATOM 2397 C PRO B 216 -18.349 -2.129 8.423 1.00 0.00 C ATOM 2398 O PRO B 216 -17.899 -1.731 7.346 1.00 0.00 O ATOM 2399 CB PRO B 216 -20.789 -2.037 9.018 1.00 0.00 C ATOM 2400 CG PRO B 216 -21.561 -1.213 8.047 1.00 0.00 C ATOM 2401 CD PRO B 216 -21.037 0.185 8.169 1.00 0.00 C ATOM 0 HA PRO B 216 -19.086 -1.284 10.193 1.00 0.00 H new ATOM 0 HB2 PRO B 216 -20.672 -3.059 8.658 1.00 0.00 H new ATOM 0 HB3 PRO B 216 -21.302 -2.094 9.978 1.00 0.00 H new ATOM 0 HG2 PRO B 216 -21.434 -1.588 7.032 1.00 0.00 H new ATOM 0 HG3 PRO B 216 -22.628 -1.249 8.269 1.00 0.00 H new ATOM 0 HD2 PRO B 216 -21.102 0.723 7.223 1.00 0.00 H new ATOM 0 HD3 PRO B 216 -21.599 0.762 8.903 1.00 0.00 H new ATOM 2409 N ARG B 217 -17.928 -3.240 9.004 1.00 0.00 N ATOM 2410 CA ARG B 217 -16.825 -4.005 8.450 1.00 0.00 C ATOM 2411 C ARG B 217 -17.142 -5.488 8.384 1.00 0.00 C ATOM 2412 O ARG B 217 -18.153 -5.947 8.918 1.00 0.00 O ATOM 2413 CB ARG B 217 -15.567 -3.788 9.288 1.00 0.00 C ATOM 2414 CG ARG B 217 -15.086 -2.353 9.281 1.00 0.00 C ATOM 2415 CD ARG B 217 -13.788 -2.195 10.038 1.00 0.00 C ATOM 2416 NE ARG B 217 -13.255 -0.848 9.898 1.00 0.00 N ATOM 2417 CZ ARG B 217 -11.961 -0.557 9.942 1.00 0.00 C ATOM 2418 NH1 ARG B 217 -11.063 -1.514 10.124 1.00 0.00 N ATOM 2419 NH2 ARG B 217 -11.564 0.696 9.799 1.00 0.00 N ATOM 0 H ARG B 217 -18.332 -3.631 9.855 1.00 0.00 H new ATOM 0 HA ARG B 217 -16.659 -3.651 7.432 1.00 0.00 H new ATOM 0 HB2 ARG B 217 -15.766 -4.093 10.315 1.00 0.00 H new ATOM 0 HB3 ARG B 217 -14.772 -4.433 8.912 1.00 0.00 H new ATOM 0 HG2 ARG B 217 -14.950 -2.020 8.252 1.00 0.00 H new ATOM 0 HG3 ARG B 217 -15.847 -1.712 9.726 1.00 0.00 H new ATOM 0 HD2 ARG B 217 -13.950 -2.416 11.093 1.00 0.00 H new ATOM 0 HD3 ARG B 217 -13.059 -2.917 9.669 1.00 0.00 H new ATOM 0 HE ARG B 217 -13.915 -0.083 9.758 1.00 0.00 H new ATOM 0 HH11 ARG B 217 -11.364 -2.482 10.231 1.00 0.00 H new ATOM 0 HH12 ARG B 217 -10.070 -1.282 10.157 1.00 0.00 H new ATOM 0 HH21 ARG B 217 -12.252 1.436 9.655 1.00 0.00 H new ATOM 0 HH22 ARG B 217 -10.570 0.923 9.832 1.00 0.00 H new