USER MOD reduce.3.24.130724 H: found=0, std=0, add=1025, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1024 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 19 MET CE :methyl -126:sc= -0.488 (180deg=-1.22) USER MOD Set 1.2: A 115 MET CE :methyl -135:sc= -3.04! (180deg=-5.27!) USER MOD Set 2.1: A 110 HIS : no HD1:sc= -2 K(o=-2,f=-2.7!) USER MOD Set 2.2: A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 55 LYS NZ :NH3+ -175:sc= 0.145 (180deg=0.0802) USER MOD Set 3.2: A 108 GLN : amide:sc= -0.589 K(o=-0.44,f=-2.3) USER MOD Set 4.1: A 91 LYS NZ :NH3+ 155:sc= -1.16 (180deg=-1.29!) USER MOD Set 4.2: A 95 ASN : amide:sc= -0.706 K(o=-1.9,f=0.4) USER MOD Set 5.1: A 13 LYS NZ :NH3+ -179:sc= 0 (180deg=-7.64e-05) USER MOD Set 5.2: A 129 TYR OH : rot 166:sc= -0.285 USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 10 GLN : amide:sc= -1.77 K(o=-1.8,f=-0.33) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 GLN : amide:sc= -0.394 X(o=-0.39,f=-0.4) USER MOD Single : A 34 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00583) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot -140:sc= -1.88! USER MOD Single : A 42 SER OG : rot 180:sc= -0.191 USER MOD Single : A 44 ASN : amide:sc= -1.63 K(o=-1.6,f=-9.8!) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc= -0.409 X(o=-0.41,f=0) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=-0.0046) USER MOD Single : A 80 SER OG : rot 178:sc= 0 USER MOD Single : A 83 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 165:sc=-0.00569 (180deg=-0.0869) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot 75:sc= 0.946 USER MOD Single : A 93 THR OG1 : rot 80:sc= 0.671 USER MOD Single : A 94 HIS : no HD1:sc= 0 X(o=0,f=-0.0052) USER MOD Single : A 97 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.02) USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot -136:sc= 0.0387 USER MOD Single : A 112 TYR OH : rot 180:sc= 0 USER MOD Single : A 116 LYS NZ :NH3+ -138:sc= 0 (180deg=-0.576) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 91:sc= 1.13 USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 130 GLN : amide:sc= -0.0365 K(o=-0.036,f=-1.6!) USER MOD ----------------------------------------------------------------- ATOM 77 N GLN A 9 -17.802 8.791 2.345 1.00 0.00 N ATOM 78 CA GLN A 9 -18.254 8.313 1.043 1.00 0.00 C ATOM 79 C GLN A 9 -17.613 9.116 -0.084 1.00 0.00 C ATOM 80 O GLN A 9 -17.148 8.550 -1.073 1.00 0.00 O ATOM 81 CB GLN A 9 -19.778 8.401 0.945 1.00 0.00 C ATOM 82 CG GLN A 9 -20.317 8.098 -0.443 1.00 0.00 C ATOM 83 CD GLN A 9 -21.801 8.382 -0.568 1.00 0.00 C ATOM 84 OE1 GLN A 9 -22.571 8.143 0.363 1.00 0.00 O ATOM 85 NE2 GLN A 9 -22.211 8.895 -1.722 1.00 0.00 N ATOM 0 HA GLN A 9 -17.950 7.271 0.941 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -20.220 7.705 1.657 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -20.095 9.402 1.238 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -19.774 8.693 -1.177 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -20.130 7.051 -0.680 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -21.538 9.077 -2.467 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -23.199 9.107 -1.864 1.00 0.00 H new ATOM 94 N GLN A 10 -17.593 10.435 0.073 1.00 0.00 N ATOM 95 CA GLN A 10 -17.010 11.315 -0.933 1.00 0.00 C ATOM 96 C GLN A 10 -15.528 11.012 -1.128 1.00 0.00 C ATOM 97 O GLN A 10 -15.054 10.881 -2.257 1.00 0.00 O ATOM 98 CB GLN A 10 -17.195 12.779 -0.530 1.00 0.00 C ATOM 99 CG GLN A 10 -18.500 13.384 -1.020 1.00 0.00 C ATOM 100 CD GLN A 10 -19.718 12.694 -0.438 1.00 0.00 C ATOM 101 OE1 GLN A 10 -20.388 13.232 0.444 1.00 0.00 O ATOM 102 NE2 GLN A 10 -20.012 11.496 -0.930 1.00 0.00 N ATOM 0 H GLN A 10 -17.974 10.918 0.887 1.00 0.00 H new ATOM 0 HA GLN A 10 -17.526 11.138 -1.877 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -17.154 12.856 0.556 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -16.363 13.363 -0.923 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -18.527 14.442 -0.758 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -18.538 13.324 -2.108 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -19.429 11.088 -1.661 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -20.821 10.984 -0.577 1.00 0.00 H new ATOM 111 N ARG A 11 -14.801 10.902 -0.021 1.00 0.00 N ATOM 112 CA ARG A 11 -13.373 10.616 -0.070 1.00 0.00 C ATOM 113 C ARG A 11 -13.107 9.292 -0.780 1.00 0.00 C ATOM 114 O ARG A 11 -12.159 9.170 -1.556 1.00 0.00 O ATOM 115 CB ARG A 11 -12.790 10.574 1.344 1.00 0.00 C ATOM 116 CG ARG A 11 -12.404 11.942 1.884 1.00 0.00 C ATOM 117 CD ARG A 11 -13.593 12.647 2.518 1.00 0.00 C ATOM 118 NE ARG A 11 -13.193 13.843 3.253 1.00 0.00 N ATOM 119 CZ ARG A 11 -14.053 14.734 3.732 1.00 0.00 C ATOM 120 NH1 ARG A 11 -15.356 14.564 3.554 1.00 0.00 N ATOM 121 NH2 ARG A 11 -13.611 15.798 4.390 1.00 0.00 N ATOM 0 H ARG A 11 -15.178 11.007 0.921 1.00 0.00 H new ATOM 0 HA ARG A 11 -12.888 11.414 -0.632 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -13.519 10.120 2.015 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -11.910 9.930 1.346 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -11.609 11.832 2.622 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -12.006 12.554 1.075 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -14.308 12.921 1.742 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -14.103 11.960 3.193 1.00 0.00 H new ATOM 0 HE ARG A 11 -12.198 14.003 3.407 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -15.699 13.747 3.048 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -16.015 15.250 3.923 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -12.609 15.932 4.528 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -14.273 16.482 4.757 1.00 0.00 H new ATOM 135 N VAL A 12 -13.951 8.301 -0.508 1.00 0.00 N ATOM 136 CA VAL A 12 -13.808 6.986 -1.120 1.00 0.00 C ATOM 137 C VAL A 12 -13.777 7.088 -2.641 1.00 0.00 C ATOM 138 O VAL A 12 -12.800 6.698 -3.281 1.00 0.00 O ATOM 139 CB VAL A 12 -14.954 6.045 -0.704 1.00 0.00 C ATOM 140 CG1 VAL A 12 -14.761 4.665 -1.313 1.00 0.00 C ATOM 141 CG2 VAL A 12 -15.049 5.959 0.812 1.00 0.00 C ATOM 0 H VAL A 12 -14.741 8.385 0.132 1.00 0.00 H new ATOM 0 HA VAL A 12 -12.863 6.574 -0.766 1.00 0.00 H new ATOM 0 HB VAL A 12 -15.891 6.454 -1.082 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -15.581 4.015 -1.008 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -14.747 4.746 -2.400 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -13.816 4.244 -0.969 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -15.864 5.290 1.088 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -14.112 5.574 1.214 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -15.239 6.951 1.221 1.00 0.00 H new ATOM 151 N LYS A 13 -14.852 7.616 -3.215 1.00 0.00 N ATOM 152 CA LYS A 13 -14.949 7.773 -4.662 1.00 0.00 C ATOM 153 C LYS A 13 -13.636 8.288 -5.242 1.00 0.00 C ATOM 154 O LYS A 13 -13.156 7.786 -6.259 1.00 0.00 O ATOM 155 CB LYS A 13 -16.087 8.733 -5.016 1.00 0.00 C ATOM 156 CG LYS A 13 -16.229 8.983 -6.508 1.00 0.00 C ATOM 157 CD LYS A 13 -16.813 7.775 -7.222 1.00 0.00 C ATOM 158 CE LYS A 13 -15.722 6.889 -7.801 1.00 0.00 C ATOM 159 NZ LYS A 13 -16.242 5.547 -8.184 1.00 0.00 N ATOM 0 H LYS A 13 -15.670 7.943 -2.700 1.00 0.00 H new ATOM 0 HA LYS A 13 -15.159 6.795 -5.096 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -17.024 8.329 -4.633 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -15.919 9.684 -4.511 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -16.869 9.849 -6.673 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -15.254 9.222 -6.932 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -17.420 7.198 -6.525 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -17.475 8.108 -8.021 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -15.287 7.373 -8.675 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -14.922 6.773 -7.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -15.464 4.967 -8.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -16.650 5.081 -7.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -16.976 5.654 -8.913 1.00 0.00 H new ATOM 173 N ARG A 14 -13.059 9.292 -4.589 1.00 0.00 N ATOM 174 CA ARG A 14 -11.801 9.874 -5.041 1.00 0.00 C ATOM 175 C ARG A 14 -10.741 8.794 -5.236 1.00 0.00 C ATOM 176 O ARG A 14 -10.091 8.731 -6.279 1.00 0.00 O ATOM 177 CB ARG A 14 -11.306 10.915 -4.035 1.00 0.00 C ATOM 178 CG ARG A 14 -12.218 12.124 -3.910 1.00 0.00 C ATOM 179 CD ARG A 14 -11.434 13.379 -3.558 1.00 0.00 C ATOM 180 NE ARG A 14 -12.290 14.561 -3.503 1.00 0.00 N ATOM 181 CZ ARG A 14 -11.836 15.803 -3.630 1.00 0.00 C ATOM 182 NH1 ARG A 14 -10.542 16.024 -3.819 1.00 0.00 N ATOM 183 NH2 ARG A 14 -12.677 16.827 -3.570 1.00 0.00 N ATOM 0 H ARG A 14 -13.443 9.719 -3.746 1.00 0.00 H new ATOM 0 HA ARG A 14 -11.978 10.361 -6.000 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -11.206 10.444 -3.057 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -10.312 11.250 -4.331 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -12.751 12.278 -4.848 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -12.970 11.936 -3.143 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -10.943 13.242 -2.595 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -10.648 13.535 -4.297 1.00 0.00 H new ATOM 0 HE ARG A 14 -13.291 14.426 -3.359 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -9.892 15.239 -3.867 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -10.197 16.979 -3.916 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -13.673 16.661 -3.426 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -12.328 17.780 -3.668 1.00 0.00 H new ATOM 197 N TRP A 15 -10.572 7.949 -4.226 1.00 0.00 N ATOM 198 CA TRP A 15 -9.591 6.872 -4.286 1.00 0.00 C ATOM 199 C TRP A 15 -9.663 6.143 -5.623 1.00 0.00 C ATOM 200 O TRP A 15 -8.669 5.596 -6.098 1.00 0.00 O ATOM 201 CB TRP A 15 -9.815 5.884 -3.140 1.00 0.00 C ATOM 202 CG TRP A 15 -10.019 6.551 -1.813 1.00 0.00 C ATOM 203 CD1 TRP A 15 -9.710 7.840 -1.487 1.00 0.00 C ATOM 204 CD2 TRP A 15 -10.576 5.959 -0.634 1.00 0.00 C ATOM 205 NE1 TRP A 15 -10.041 8.087 -0.177 1.00 0.00 N ATOM 206 CE2 TRP A 15 -10.574 6.949 0.369 1.00 0.00 C ATOM 207 CE3 TRP A 15 -11.077 4.691 -0.328 1.00 0.00 C ATOM 208 CZ2 TRP A 15 -11.054 6.707 1.653 1.00 0.00 C ATOM 209 CZ3 TRP A 15 -11.552 4.453 0.948 1.00 0.00 C ATOM 210 CH2 TRP A 15 -11.538 5.457 1.926 1.00 0.00 C ATOM 0 H TRP A 15 -11.102 7.989 -3.355 1.00 0.00 H new ATOM 0 HA TRP A 15 -8.599 7.313 -4.187 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -10.685 5.267 -3.366 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -8.958 5.214 -3.074 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -9.270 8.560 -2.161 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -9.911 8.974 0.310 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -11.093 3.911 -1.075 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -11.045 7.480 2.408 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -11.941 3.476 1.196 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -11.917 5.240 2.914 1.00 0.00 H new ATOM 221 N GLY A 16 -10.848 6.141 -6.228 1.00 0.00 N ATOM 222 CA GLY A 16 -11.028 5.476 -7.505 1.00 0.00 C ATOM 223 C GLY A 16 -10.504 6.299 -8.666 1.00 0.00 C ATOM 224 O GLY A 16 -11.009 6.200 -9.784 1.00 0.00 O ATOM 0 H GLY A 16 -11.686 6.588 -5.856 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -10.516 4.514 -7.485 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -12.087 5.271 -7.658 1.00 0.00 H new ATOM 228 N PHE A 17 -9.490 7.115 -8.400 1.00 0.00 N ATOM 229 CA PHE A 17 -8.899 7.961 -9.430 1.00 0.00 C ATOM 230 C PHE A 17 -7.433 7.601 -9.655 1.00 0.00 C ATOM 231 O PHE A 17 -6.923 7.697 -10.771 1.00 0.00 O ATOM 232 CB PHE A 17 -9.020 9.436 -9.041 1.00 0.00 C ATOM 233 CG PHE A 17 -10.420 9.970 -9.141 1.00 0.00 C ATOM 234 CD1 PHE A 17 -11.172 9.770 -10.287 1.00 0.00 C ATOM 235 CD2 PHE A 17 -10.985 10.672 -8.088 1.00 0.00 C ATOM 236 CE1 PHE A 17 -12.461 10.259 -10.382 1.00 0.00 C ATOM 237 CE2 PHE A 17 -12.273 11.163 -8.177 1.00 0.00 C ATOM 238 CZ PHE A 17 -13.012 10.958 -9.326 1.00 0.00 C ATOM 0 H PHE A 17 -9.060 7.208 -7.480 1.00 0.00 H new ATOM 0 HA PHE A 17 -9.443 7.792 -10.359 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -8.663 9.564 -8.019 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -8.367 10.027 -9.683 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -10.746 9.225 -11.116 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -10.412 10.837 -7.188 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -13.037 10.095 -11.281 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -12.702 11.707 -7.349 1.00 0.00 H new ATOM 0 HZ PHE A 17 -14.018 11.343 -9.398 1.00 0.00 H new ATOM 248 N GLY A 18 -6.761 7.186 -8.586 1.00 0.00 N ATOM 249 CA GLY A 18 -5.361 6.819 -8.687 1.00 0.00 C ATOM 250 C GLY A 18 -4.649 6.876 -7.350 1.00 0.00 C ATOM 251 O GLY A 18 -4.969 7.711 -6.504 1.00 0.00 O ATOM 0 H GLY A 18 -7.161 7.097 -7.652 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -5.281 5.811 -9.095 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -4.863 7.488 -9.389 1.00 0.00 H new ATOM 255 N MET A 19 -3.681 5.986 -7.157 1.00 0.00 N ATOM 256 CA MET A 19 -2.923 5.939 -5.913 1.00 0.00 C ATOM 257 C MET A 19 -2.747 7.337 -5.330 1.00 0.00 C ATOM 258 O MET A 19 -2.980 7.558 -4.141 1.00 0.00 O ATOM 259 CB MET A 19 -1.554 5.296 -6.149 1.00 0.00 C ATOM 260 CG MET A 19 -0.858 4.862 -4.869 1.00 0.00 C ATOM 261 SD MET A 19 0.312 3.516 -5.138 1.00 0.00 S ATOM 262 CE MET A 19 1.600 4.364 -6.049 1.00 0.00 C ATOM 0 H MET A 19 -3.403 5.288 -7.847 1.00 0.00 H new ATOM 0 HA MET A 19 -3.482 5.335 -5.199 1.00 0.00 H new ATOM 0 HB2 MET A 19 -1.676 4.429 -6.799 1.00 0.00 H new ATOM 0 HB3 MET A 19 -0.916 6.004 -6.678 1.00 0.00 H new ATOM 0 HG2 MET A 19 -0.333 5.714 -4.438 1.00 0.00 H new ATOM 0 HG3 MET A 19 -1.606 4.548 -4.141 1.00 0.00 H new ATOM 0 HE1 MET A 19 1.796 3.834 -6.981 1.00 0.00 H new ATOM 0 HE2 MET A 19 1.279 5.382 -6.271 1.00 0.00 H new ATOM 0 HE3 MET A 19 2.510 4.393 -5.450 1.00 0.00 H new ATOM 272 N ASP A 20 -2.336 8.277 -6.173 1.00 0.00 N ATOM 273 CA ASP A 20 -2.130 9.655 -5.741 1.00 0.00 C ATOM 274 C ASP A 20 -3.111 10.030 -4.635 1.00 0.00 C ATOM 275 O ASP A 20 -2.708 10.480 -3.562 1.00 0.00 O ATOM 276 CB ASP A 20 -2.288 10.612 -6.924 1.00 0.00 C ATOM 277 CG ASP A 20 -1.643 11.960 -6.668 1.00 0.00 C ATOM 278 OD1 ASP A 20 -1.846 12.516 -5.568 1.00 0.00 O ATOM 279 OD2 ASP A 20 -0.934 12.459 -7.567 1.00 0.00 O ATOM 0 H ASP A 20 -2.139 8.111 -7.160 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.117 9.739 -5.348 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -1.844 10.163 -7.813 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -3.348 10.754 -7.134 1.00 0.00 H new ATOM 284 N GLU A 21 -4.399 9.842 -4.903 1.00 0.00 N ATOM 285 CA GLU A 21 -5.437 10.162 -3.930 1.00 0.00 C ATOM 286 C GLU A 21 -5.385 9.203 -2.744 1.00 0.00 C ATOM 287 O GLU A 21 -5.142 9.615 -1.610 1.00 0.00 O ATOM 288 CB GLU A 21 -6.818 10.104 -4.586 1.00 0.00 C ATOM 289 CG GLU A 21 -7.022 11.152 -5.668 1.00 0.00 C ATOM 290 CD GLU A 21 -7.155 12.553 -5.105 1.00 0.00 C ATOM 291 OE1 GLU A 21 -7.669 12.692 -3.976 1.00 0.00 O ATOM 292 OE2 GLU A 21 -6.746 13.511 -5.794 1.00 0.00 O ATOM 0 H GLU A 21 -4.749 9.470 -5.786 1.00 0.00 H new ATOM 0 HA GLU A 21 -5.258 11.174 -3.566 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -6.964 9.114 -5.018 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -7.581 10.233 -3.819 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -6.182 11.121 -6.361 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -7.917 10.908 -6.241 1.00 0.00 H new ATOM 299 N ALA A 22 -5.615 7.923 -3.015 1.00 0.00 N ATOM 300 CA ALA A 22 -5.593 6.905 -1.972 1.00 0.00 C ATOM 301 C ALA A 22 -4.553 7.233 -0.906 1.00 0.00 C ATOM 302 O ALA A 22 -4.730 6.912 0.269 1.00 0.00 O ATOM 303 CB ALA A 22 -5.320 5.536 -2.576 1.00 0.00 C ATOM 0 H ALA A 22 -5.819 7.566 -3.948 1.00 0.00 H new ATOM 0 HA ALA A 22 -6.572 6.889 -1.493 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -5.306 4.786 -1.785 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -6.103 5.292 -3.294 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -4.355 5.547 -3.082 1.00 0.00 H new ATOM 309 N LEU A 23 -3.467 7.874 -1.325 1.00 0.00 N ATOM 310 CA LEU A 23 -2.396 8.245 -0.406 1.00 0.00 C ATOM 311 C LEU A 23 -2.765 9.499 0.382 1.00 0.00 C ATOM 312 O LEU A 23 -2.750 9.498 1.613 1.00 0.00 O ATOM 313 CB LEU A 23 -1.095 8.477 -1.175 1.00 0.00 C ATOM 314 CG LEU A 23 -0.631 7.329 -2.072 1.00 0.00 C ATOM 315 CD1 LEU A 23 0.455 7.801 -3.026 1.00 0.00 C ATOM 316 CD2 LEU A 23 -0.134 6.162 -1.230 1.00 0.00 C ATOM 0 H LEU A 23 -3.305 8.147 -2.294 1.00 0.00 H new ATOM 0 HA LEU A 23 -2.254 7.425 0.297 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -1.215 9.368 -1.792 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -0.305 8.692 -0.456 1.00 0.00 H new ATOM 0 HG LEU A 23 -1.481 6.989 -2.663 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.772 6.970 -3.656 1.00 0.00 H new ATOM 0 HD12 LEU A 23 0.065 8.603 -3.653 1.00 0.00 H new ATOM 0 HD13 LEU A 23 1.307 8.169 -2.454 1.00 0.00 H new ATOM 0 HD21 LEU A 23 0.192 5.354 -1.885 1.00 0.00 H new ATOM 0 HD22 LEU A 23 0.703 6.489 -0.613 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -0.941 5.806 -0.589 1.00 0.00 H new ATOM 328 N LYS A 24 -3.098 10.566 -0.336 1.00 0.00 N ATOM 329 CA LYS A 24 -3.474 11.826 0.294 1.00 0.00 C ATOM 330 C LYS A 24 -4.452 11.590 1.440 1.00 0.00 C ATOM 331 O LYS A 24 -4.434 12.306 2.441 1.00 0.00 O ATOM 332 CB LYS A 24 -4.098 12.769 -0.737 1.00 0.00 C ATOM 333 CG LYS A 24 -5.576 12.515 -0.977 1.00 0.00 C ATOM 334 CD LYS A 24 -6.273 13.751 -1.521 1.00 0.00 C ATOM 335 CE LYS A 24 -7.768 13.717 -1.240 1.00 0.00 C ATOM 336 NZ LYS A 24 -8.414 15.030 -1.514 1.00 0.00 N ATOM 0 H LYS A 24 -3.115 10.583 -1.356 1.00 0.00 H new ATOM 0 HA LYS A 24 -2.572 12.285 0.698 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -3.964 13.798 -0.404 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -3.562 12.668 -1.681 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -5.695 11.690 -1.680 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -6.050 12.210 -0.044 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -5.837 14.643 -1.071 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -6.105 13.821 -2.596 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -8.235 12.947 -1.854 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -7.936 13.440 -0.199 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -9.432 14.965 -1.310 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -7.986 15.760 -0.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -8.276 15.283 -2.513 1.00 0.00 H new ATOM 350 N ASP A 25 -5.302 10.580 1.288 1.00 0.00 N ATOM 351 CA ASP A 25 -6.286 10.248 2.312 1.00 0.00 C ATOM 352 C ASP A 25 -5.711 9.254 3.316 1.00 0.00 C ATOM 353 O ASP A 25 -4.955 8.347 2.965 1.00 0.00 O ATOM 354 CB ASP A 25 -7.548 9.671 1.669 1.00 0.00 C ATOM 355 CG ASP A 25 -8.335 10.714 0.900 1.00 0.00 C ATOM 356 OD1 ASP A 25 -8.384 11.875 1.356 1.00 0.00 O ATOM 357 OD2 ASP A 25 -8.902 10.368 -0.158 1.00 0.00 O ATOM 0 H ASP A 25 -5.329 9.977 0.466 1.00 0.00 H new ATOM 0 HA ASP A 25 -6.545 11.164 2.843 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -7.271 8.860 0.996 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -8.182 9.240 2.444 1.00 0.00 H new ATOM 362 N PRO A 26 -6.075 9.426 4.595 1.00 0.00 N ATOM 363 CA PRO A 26 -5.606 8.554 5.676 1.00 0.00 C ATOM 364 C PRO A 26 -6.205 7.154 5.592 1.00 0.00 C ATOM 365 O PRO A 26 -5.484 6.157 5.628 1.00 0.00 O ATOM 366 CB PRO A 26 -6.089 9.267 6.942 1.00 0.00 C ATOM 367 CG PRO A 26 -7.264 10.069 6.500 1.00 0.00 C ATOM 368 CD PRO A 26 -6.973 10.486 5.085 1.00 0.00 C ATOM 0 HA PRO A 26 -4.527 8.404 5.640 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -6.366 8.553 7.717 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -5.309 9.904 7.360 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -8.180 9.481 6.553 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -7.406 10.939 7.142 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -7.884 10.549 4.489 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -6.498 11.466 5.045 1.00 0.00 H new ATOM 376 N VAL A 27 -7.528 7.087 5.480 1.00 0.00 N ATOM 377 CA VAL A 27 -8.224 5.809 5.389 1.00 0.00 C ATOM 378 C VAL A 27 -7.867 5.079 4.099 1.00 0.00 C ATOM 379 O VAL A 27 -7.528 3.897 4.116 1.00 0.00 O ATOM 380 CB VAL A 27 -9.751 5.995 5.455 1.00 0.00 C ATOM 381 CG1 VAL A 27 -10.458 4.653 5.343 1.00 0.00 C ATOM 382 CG2 VAL A 27 -10.146 6.709 6.739 1.00 0.00 C ATOM 0 H VAL A 27 -8.139 7.903 5.450 1.00 0.00 H new ATOM 0 HA VAL A 27 -7.901 5.212 6.242 1.00 0.00 H new ATOM 0 HB VAL A 27 -10.061 6.613 4.612 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -11.536 4.805 5.392 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -10.200 4.184 4.394 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -10.145 4.007 6.164 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -11.229 6.832 6.769 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -9.824 6.119 7.597 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -9.669 7.688 6.772 1.00 0.00 H new ATOM 392 N GLY A 28 -7.945 5.794 2.980 1.00 0.00 N ATOM 393 CA GLY A 28 -7.627 5.198 1.696 1.00 0.00 C ATOM 394 C GLY A 28 -6.277 4.507 1.696 1.00 0.00 C ATOM 395 O GLY A 28 -6.068 3.538 0.966 1.00 0.00 O ATOM 0 H GLY A 28 -8.223 6.775 2.940 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -8.401 4.477 1.432 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -7.636 5.971 0.928 1.00 0.00 H new ATOM 399 N ARG A 29 -5.358 5.008 2.515 1.00 0.00 N ATOM 400 CA ARG A 29 -4.020 4.434 2.604 1.00 0.00 C ATOM 401 C ARG A 29 -4.070 3.026 3.189 1.00 0.00 C ATOM 402 O ARG A 29 -3.492 2.093 2.635 1.00 0.00 O ATOM 403 CB ARG A 29 -3.117 5.323 3.461 1.00 0.00 C ATOM 404 CG ARG A 29 -2.360 6.372 2.663 1.00 0.00 C ATOM 405 CD ARG A 29 -1.093 6.810 3.380 1.00 0.00 C ATOM 406 NE ARG A 29 -0.172 7.509 2.488 1.00 0.00 N ATOM 407 CZ ARG A 29 0.635 8.487 2.883 1.00 0.00 C ATOM 408 NH1 ARG A 29 0.636 8.879 4.150 1.00 0.00 N ATOM 409 NH2 ARG A 29 1.444 9.075 2.012 1.00 0.00 N ATOM 0 H ARG A 29 -5.515 5.809 3.126 1.00 0.00 H new ATOM 0 HA ARG A 29 -3.609 4.375 1.596 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -3.724 5.822 4.217 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -2.401 4.695 3.991 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -2.104 5.970 1.683 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -3.002 7.237 2.496 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -1.355 7.462 4.213 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -0.596 5.937 3.803 1.00 0.00 H new ATOM 0 HE ARG A 29 -0.147 7.231 1.507 1.00 0.00 H new ATOM 0 HH11 ARG A 29 0.016 8.429 4.824 1.00 0.00 H new ATOM 0 HH12 ARG A 29 1.257 9.630 4.451 1.00 0.00 H new ATOM 0 HH21 ARG A 29 1.447 8.776 1.037 1.00 0.00 H new ATOM 0 HH22 ARG A 29 2.063 9.826 2.317 1.00 0.00 H new ATOM 423 N GLU A 30 -4.765 2.883 4.314 1.00 0.00 N ATOM 424 CA GLU A 30 -4.889 1.589 4.974 1.00 0.00 C ATOM 425 C GLU A 30 -5.820 0.666 4.193 1.00 0.00 C ATOM 426 O GLU A 30 -5.519 -0.510 3.993 1.00 0.00 O ATOM 427 CB GLU A 30 -5.410 1.768 6.402 1.00 0.00 C ATOM 428 CG GLU A 30 -6.926 1.794 6.498 1.00 0.00 C ATOM 429 CD GLU A 30 -7.418 2.019 7.914 1.00 0.00 C ATOM 430 OE1 GLU A 30 -7.044 3.049 8.515 1.00 0.00 O ATOM 431 OE2 GLU A 30 -8.175 1.167 8.423 1.00 0.00 O ATOM 0 H GLU A 30 -5.250 3.646 4.786 1.00 0.00 H new ATOM 0 HA GLU A 30 -3.900 1.132 5.010 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -5.029 0.957 7.023 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -5.012 2.697 6.811 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -7.313 2.583 5.853 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -7.326 0.852 6.124 1.00 0.00 H new ATOM 438 N GLN A 31 -6.952 1.209 3.756 1.00 0.00 N ATOM 439 CA GLN A 31 -7.928 0.434 2.999 1.00 0.00 C ATOM 440 C GLN A 31 -7.279 -0.217 1.782 1.00 0.00 C ATOM 441 O GLN A 31 -7.313 -1.438 1.626 1.00 0.00 O ATOM 442 CB GLN A 31 -9.087 1.328 2.556 1.00 0.00 C ATOM 443 CG GLN A 31 -10.059 1.664 3.676 1.00 0.00 C ATOM 444 CD GLN A 31 -10.463 0.445 4.483 1.00 0.00 C ATOM 445 OE1 GLN A 31 -10.899 -0.564 3.928 1.00 0.00 O ATOM 446 NE2 GLN A 31 -10.320 0.533 5.800 1.00 0.00 N ATOM 0 H GLN A 31 -7.216 2.182 3.913 1.00 0.00 H new ATOM 0 HA GLN A 31 -8.313 -0.353 3.648 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -8.684 2.254 2.146 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -9.630 0.832 1.751 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -9.603 2.399 4.339 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -10.950 2.126 3.252 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -9.955 1.389 6.217 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -10.576 -0.255 6.395 1.00 0.00 H new ATOM 455 N PHE A 32 -6.689 0.605 0.920 1.00 0.00 N ATOM 456 CA PHE A 32 -6.034 0.109 -0.284 1.00 0.00 C ATOM 457 C PHE A 32 -5.001 -0.960 0.060 1.00 0.00 C ATOM 458 O PHE A 32 -4.846 -1.946 -0.662 1.00 0.00 O ATOM 459 CB PHE A 32 -5.362 1.260 -1.036 1.00 0.00 C ATOM 460 CG PHE A 32 -4.316 0.808 -2.014 1.00 0.00 C ATOM 461 CD1 PHE A 32 -4.669 0.086 -3.142 1.00 0.00 C ATOM 462 CD2 PHE A 32 -2.979 1.106 -1.805 1.00 0.00 C ATOM 463 CE1 PHE A 32 -3.708 -0.332 -4.043 1.00 0.00 C ATOM 464 CE2 PHE A 32 -2.013 0.691 -2.702 1.00 0.00 C ATOM 465 CZ PHE A 32 -2.378 -0.028 -3.823 1.00 0.00 C ATOM 0 H PHE A 32 -6.651 1.618 1.033 1.00 0.00 H new ATOM 0 HA PHE A 32 -6.795 -0.338 -0.923 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -6.124 1.829 -1.569 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -4.905 1.937 -0.314 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -5.707 -0.153 -3.320 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -2.688 1.669 -0.931 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -3.996 -0.896 -4.918 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -0.974 0.929 -2.526 1.00 0.00 H new ATOM 0 HZ PHE A 32 -1.625 -0.352 -4.527 1.00 0.00 H new ATOM 475 N LEU A 33 -4.295 -0.757 1.167 1.00 0.00 N ATOM 476 CA LEU A 33 -3.275 -1.703 1.608 1.00 0.00 C ATOM 477 C LEU A 33 -3.897 -3.052 1.954 1.00 0.00 C ATOM 478 O LEU A 33 -3.480 -4.090 1.440 1.00 0.00 O ATOM 479 CB LEU A 33 -2.527 -1.147 2.821 1.00 0.00 C ATOM 480 CG LEU A 33 -1.828 -2.178 3.708 1.00 0.00 C ATOM 481 CD1 LEU A 33 -0.400 -2.407 3.237 1.00 0.00 C ATOM 482 CD2 LEU A 33 -1.846 -1.730 5.163 1.00 0.00 C ATOM 0 H LEU A 33 -4.410 0.054 1.775 1.00 0.00 H new ATOM 0 HA LEU A 33 -2.570 -1.848 0.789 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -1.781 -0.435 2.468 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -3.234 -0.589 3.435 1.00 0.00 H new ATOM 0 HG LEU A 33 -2.370 -3.121 3.632 1.00 0.00 H new ATOM 0 HD11 LEU A 33 0.082 -3.144 3.880 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -0.410 -2.773 2.210 1.00 0.00 H new ATOM 0 HD13 LEU A 33 0.153 -1.469 3.283 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -1.344 -2.476 5.780 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -1.329 -0.775 5.256 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -2.878 -1.618 5.497 1.00 0.00 H new ATOM 494 N LYS A 34 -4.898 -3.030 2.827 1.00 0.00 N ATOM 495 CA LYS A 34 -5.581 -4.250 3.240 1.00 0.00 C ATOM 496 C LYS A 34 -5.702 -5.227 2.075 1.00 0.00 C ATOM 497 O LYS A 34 -5.430 -6.419 2.220 1.00 0.00 O ATOM 498 CB LYS A 34 -6.970 -3.920 3.790 1.00 0.00 C ATOM 499 CG LYS A 34 -6.942 -3.041 5.028 1.00 0.00 C ATOM 500 CD LYS A 34 -8.141 -3.300 5.925 1.00 0.00 C ATOM 501 CE LYS A 34 -8.062 -2.489 7.209 1.00 0.00 C ATOM 502 NZ LYS A 34 -7.068 -3.054 8.162 1.00 0.00 N ATOM 0 H LYS A 34 -5.255 -2.180 3.263 1.00 0.00 H new ATOM 0 HA LYS A 34 -4.989 -4.720 4.025 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -7.550 -3.421 3.014 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -7.488 -4.849 4.026 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -6.023 -3.225 5.585 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -6.929 -1.993 4.730 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -9.057 -3.049 5.391 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -8.193 -4.362 6.167 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -7.793 -1.460 6.972 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -9.044 -2.462 7.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -7.069 -2.493 9.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -7.319 -4.039 8.382 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -6.121 -3.025 7.733 1.00 0.00 H new ATOM 516 N PHE A 35 -6.111 -4.714 0.919 1.00 0.00 N ATOM 517 CA PHE A 35 -6.268 -5.541 -0.272 1.00 0.00 C ATOM 518 C PHE A 35 -4.937 -6.166 -0.679 1.00 0.00 C ATOM 519 O PHE A 35 -4.865 -7.357 -0.986 1.00 0.00 O ATOM 520 CB PHE A 35 -6.827 -4.708 -1.427 1.00 0.00 C ATOM 521 CG PHE A 35 -6.743 -5.397 -2.759 1.00 0.00 C ATOM 522 CD1 PHE A 35 -5.554 -5.419 -3.468 1.00 0.00 C ATOM 523 CD2 PHE A 35 -7.854 -6.025 -3.300 1.00 0.00 C ATOM 524 CE1 PHE A 35 -5.474 -6.052 -4.694 1.00 0.00 C ATOM 525 CE2 PHE A 35 -7.780 -6.660 -4.526 1.00 0.00 C ATOM 526 CZ PHE A 35 -6.588 -6.674 -5.223 1.00 0.00 C ATOM 0 H PHE A 35 -6.340 -3.729 0.782 1.00 0.00 H new ATOM 0 HA PHE A 35 -6.969 -6.342 -0.038 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -7.869 -4.465 -1.218 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -6.284 -3.765 -1.480 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -4.679 -4.936 -3.058 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -8.788 -6.018 -2.758 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -4.541 -6.060 -5.238 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -8.653 -7.144 -4.938 1.00 0.00 H new ATOM 0 HZ PHE A 35 -6.527 -7.170 -6.180 1.00 0.00 H new ATOM 536 N LEU A 36 -3.885 -5.355 -0.679 1.00 0.00 N ATOM 537 CA LEU A 36 -2.555 -5.827 -1.049 1.00 0.00 C ATOM 538 C LEU A 36 -2.166 -7.054 -0.232 1.00 0.00 C ATOM 539 O LEU A 36 -1.848 -8.106 -0.787 1.00 0.00 O ATOM 540 CB LEU A 36 -1.523 -4.716 -0.844 1.00 0.00 C ATOM 541 CG LEU A 36 -1.289 -3.789 -2.038 1.00 0.00 C ATOM 542 CD1 LEU A 36 -2.533 -2.964 -2.325 1.00 0.00 C ATOM 543 CD2 LEU A 36 -0.093 -2.883 -1.783 1.00 0.00 C ATOM 0 H LEU A 36 -3.927 -4.368 -0.427 1.00 0.00 H new ATOM 0 HA LEU A 36 -2.576 -6.106 -2.102 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.836 -4.109 0.006 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -0.572 -5.176 -0.575 1.00 0.00 H new ATOM 0 HG LEU A 36 -1.075 -4.402 -2.913 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -2.348 -2.311 -3.178 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -3.366 -3.629 -2.552 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -2.778 -2.360 -1.452 1.00 0.00 H new ATOM 0 HD21 LEU A 36 0.059 -2.230 -2.643 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -0.278 -2.277 -0.896 1.00 0.00 H new ATOM 0 HD23 LEU A 36 0.798 -3.492 -1.628 1.00 0.00 H new ATOM 555 N GLU A 37 -2.196 -6.913 1.090 1.00 0.00 N ATOM 556 CA GLU A 37 -1.848 -8.012 1.983 1.00 0.00 C ATOM 557 C GLU A 37 -2.367 -9.340 1.440 1.00 0.00 C ATOM 558 O GLU A 37 -1.692 -10.366 1.528 1.00 0.00 O ATOM 559 CB GLU A 37 -2.418 -7.763 3.381 1.00 0.00 C ATOM 560 CG GLU A 37 -1.949 -6.460 4.006 1.00 0.00 C ATOM 561 CD GLU A 37 -2.081 -6.456 5.516 1.00 0.00 C ATOM 562 OE1 GLU A 37 -3.223 -6.562 6.011 1.00 0.00 O ATOM 563 OE2 GLU A 37 -1.044 -6.348 6.203 1.00 0.00 O ATOM 0 H GLU A 37 -2.457 -6.049 1.566 1.00 0.00 H new ATOM 0 HA GLU A 37 -0.761 -8.065 2.045 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -3.507 -7.758 3.325 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -2.136 -8.591 4.032 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -0.907 -6.286 3.736 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -2.528 -5.634 3.592 1.00 0.00 H new ATOM 570 N SER A 38 -3.571 -9.313 0.877 1.00 0.00 N ATOM 571 CA SER A 38 -4.184 -10.514 0.323 1.00 0.00 C ATOM 572 C SER A 38 -3.369 -11.047 -0.852 1.00 0.00 C ATOM 573 O SER A 38 -3.057 -12.236 -0.915 1.00 0.00 O ATOM 574 CB SER A 38 -5.616 -10.221 -0.126 1.00 0.00 C ATOM 575 OG SER A 38 -6.336 -11.421 -0.350 1.00 0.00 O ATOM 0 H SER A 38 -4.141 -8.472 0.793 1.00 0.00 H new ATOM 0 HA SER A 38 -4.205 -11.275 1.103 1.00 0.00 H new ATOM 0 HB2 SER A 38 -6.123 -9.625 0.632 1.00 0.00 H new ATOM 0 HB3 SER A 38 -5.600 -9.627 -1.040 1.00 0.00 H new ATOM 0 HG SER A 38 -7.249 -11.206 -0.634 1.00 0.00 H new ATOM 581 N GLU A 39 -3.029 -10.158 -1.779 1.00 0.00 N ATOM 582 CA GLU A 39 -2.251 -10.539 -2.953 1.00 0.00 C ATOM 583 C GLU A 39 -0.758 -10.543 -2.638 1.00 0.00 C ATOM 584 O GLU A 39 0.078 -10.611 -3.539 1.00 0.00 O ATOM 585 CB GLU A 39 -2.536 -9.582 -4.113 1.00 0.00 C ATOM 586 CG GLU A 39 -1.869 -8.225 -3.961 1.00 0.00 C ATOM 587 CD GLU A 39 -1.517 -7.596 -5.295 1.00 0.00 C ATOM 588 OE1 GLU A 39 -0.935 -8.299 -6.147 1.00 0.00 O ATOM 589 OE2 GLU A 39 -1.823 -6.401 -5.487 1.00 0.00 O ATOM 0 H GLU A 39 -3.279 -9.170 -1.741 1.00 0.00 H new ATOM 0 HA GLU A 39 -2.547 -11.548 -3.242 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -2.199 -10.041 -5.043 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -3.613 -9.440 -4.200 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -2.533 -7.557 -3.413 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -0.963 -8.334 -3.365 1.00 0.00 H new ATOM 596 N PHE A 40 -0.430 -10.470 -1.352 1.00 0.00 N ATOM 597 CA PHE A 40 0.962 -10.464 -0.917 1.00 0.00 C ATOM 598 C PHE A 40 1.750 -9.369 -1.630 1.00 0.00 C ATOM 599 O PHE A 40 2.869 -9.593 -2.090 1.00 0.00 O ATOM 600 CB PHE A 40 1.607 -11.826 -1.182 1.00 0.00 C ATOM 601 CG PHE A 40 0.818 -12.980 -0.631 1.00 0.00 C ATOM 602 CD1 PHE A 40 -0.362 -13.380 -1.235 1.00 0.00 C ATOM 603 CD2 PHE A 40 1.258 -13.664 0.491 1.00 0.00 C ATOM 604 CE1 PHE A 40 -1.090 -14.441 -0.729 1.00 0.00 C ATOM 605 CE2 PHE A 40 0.535 -14.726 1.001 1.00 0.00 C ATOM 606 CZ PHE A 40 -0.640 -15.115 0.389 1.00 0.00 C ATOM 0 H PHE A 40 -1.109 -10.414 -0.593 1.00 0.00 H new ATOM 0 HA PHE A 40 0.981 -10.262 0.154 1.00 0.00 H new ATOM 0 HB2 PHE A 40 1.728 -11.959 -2.257 1.00 0.00 H new ATOM 0 HB3 PHE A 40 2.606 -11.837 -0.745 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -0.718 -12.858 -2.111 1.00 0.00 H new ATOM 0 HD2 PHE A 40 2.177 -13.364 0.973 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -2.010 -14.742 -1.208 1.00 0.00 H new ATOM 0 HE2 PHE A 40 0.888 -15.250 1.876 1.00 0.00 H new ATOM 0 HZ PHE A 40 -1.206 -15.945 0.784 1.00 0.00 H new ATOM 616 N SER A 41 1.156 -8.182 -1.716 1.00 0.00 N ATOM 617 CA SER A 41 1.800 -7.052 -2.376 1.00 0.00 C ATOM 618 C SER A 41 2.112 -5.944 -1.375 1.00 0.00 C ATOM 619 O SER A 41 2.920 -5.056 -1.647 1.00 0.00 O ATOM 620 CB SER A 41 0.905 -6.510 -3.493 1.00 0.00 C ATOM 621 OG SER A 41 1.070 -7.256 -4.686 1.00 0.00 O ATOM 0 H SER A 41 0.231 -7.978 -1.337 1.00 0.00 H new ATOM 0 HA SER A 41 2.738 -7.401 -2.808 1.00 0.00 H new ATOM 0 HB2 SER A 41 -0.138 -6.548 -3.178 1.00 0.00 H new ATOM 0 HB3 SER A 41 1.144 -5.463 -3.679 1.00 0.00 H new ATOM 0 HG SER A 41 1.065 -6.649 -5.455 1.00 0.00 H new ATOM 627 N SER A 42 1.464 -6.003 -0.216 1.00 0.00 N ATOM 628 CA SER A 42 1.668 -5.003 0.825 1.00 0.00 C ATOM 629 C SER A 42 3.119 -4.530 0.847 1.00 0.00 C ATOM 630 O SER A 42 3.390 -3.330 0.860 1.00 0.00 O ATOM 631 CB SER A 42 1.286 -5.574 2.192 1.00 0.00 C ATOM 632 OG SER A 42 2.187 -6.592 2.590 1.00 0.00 O ATOM 0 H SER A 42 0.793 -6.733 0.026 1.00 0.00 H new ATOM 0 HA SER A 42 1.028 -4.149 0.604 1.00 0.00 H new ATOM 0 HB2 SER A 42 1.283 -4.776 2.935 1.00 0.00 H new ATOM 0 HB3 SER A 42 0.274 -5.976 2.152 1.00 0.00 H new ATOM 0 HG SER A 42 1.922 -6.939 3.467 1.00 0.00 H new ATOM 638 N GLU A 43 4.046 -5.483 0.852 1.00 0.00 N ATOM 639 CA GLU A 43 5.468 -5.164 0.873 1.00 0.00 C ATOM 640 C GLU A 43 5.767 -3.954 -0.008 1.00 0.00 C ATOM 641 O GLU A 43 6.464 -3.028 0.407 1.00 0.00 O ATOM 642 CB GLU A 43 6.290 -6.366 0.403 1.00 0.00 C ATOM 643 CG GLU A 43 5.911 -6.858 -0.984 1.00 0.00 C ATOM 644 CD GLU A 43 6.220 -8.329 -1.185 1.00 0.00 C ATOM 645 OE1 GLU A 43 5.765 -9.148 -0.359 1.00 0.00 O ATOM 646 OE2 GLU A 43 6.915 -8.661 -2.168 1.00 0.00 O ATOM 0 H GLU A 43 3.837 -6.481 0.842 1.00 0.00 H new ATOM 0 HA GLU A 43 5.745 -4.922 1.899 1.00 0.00 H new ATOM 0 HB2 GLU A 43 7.346 -6.097 0.408 1.00 0.00 H new ATOM 0 HB3 GLU A 43 6.165 -7.182 1.115 1.00 0.00 H new ATOM 0 HG2 GLU A 43 4.847 -6.688 -1.148 1.00 0.00 H new ATOM 0 HG3 GLU A 43 6.446 -6.273 -1.732 1.00 0.00 H new ATOM 653 N ASN A 44 5.236 -3.969 -1.226 1.00 0.00 N ATOM 654 CA ASN A 44 5.447 -2.875 -2.166 1.00 0.00 C ATOM 655 C ASN A 44 5.129 -1.531 -1.517 1.00 0.00 C ATOM 656 O ASN A 44 5.966 -0.629 -1.489 1.00 0.00 O ATOM 657 CB ASN A 44 4.579 -3.070 -3.411 1.00 0.00 C ATOM 658 CG ASN A 44 4.749 -4.447 -4.024 1.00 0.00 C ATOM 659 OD1 ASN A 44 5.314 -5.349 -3.405 1.00 0.00 O ATOM 660 ND2 ASN A 44 4.260 -4.614 -5.247 1.00 0.00 N ATOM 0 H ASN A 44 4.656 -4.727 -1.585 1.00 0.00 H new ATOM 0 HA ASN A 44 6.497 -2.878 -2.459 1.00 0.00 H new ATOM 0 HB2 ASN A 44 3.532 -2.919 -3.148 1.00 0.00 H new ATOM 0 HB3 ASN A 44 4.834 -2.312 -4.151 1.00 0.00 H new ATOM 0 HD21 ASN A 44 4.345 -5.518 -5.711 1.00 0.00 H new ATOM 0 HD22 ASN A 44 3.799 -3.838 -5.722 1.00 0.00 H new ATOM 667 N LEU A 45 3.914 -1.406 -0.994 1.00 0.00 N ATOM 668 CA LEU A 45 3.484 -0.173 -0.344 1.00 0.00 C ATOM 669 C LEU A 45 4.260 0.060 0.949 1.00 0.00 C ATOM 670 O LEU A 45 4.910 1.092 1.117 1.00 0.00 O ATOM 671 CB LEU A 45 1.984 -0.224 -0.049 1.00 0.00 C ATOM 672 CG LEU A 45 1.351 1.079 0.440 1.00 0.00 C ATOM 673 CD1 LEU A 45 1.311 2.107 -0.680 1.00 0.00 C ATOM 674 CD2 LEU A 45 -0.048 0.822 0.981 1.00 0.00 C ATOM 0 H LEU A 45 3.209 -2.143 -1.007 1.00 0.00 H new ATOM 0 HA LEU A 45 3.686 0.656 -1.023 1.00 0.00 H new ATOM 0 HB2 LEU A 45 1.466 -0.538 -0.955 1.00 0.00 H new ATOM 0 HB3 LEU A 45 1.808 -0.994 0.702 1.00 0.00 H new ATOM 0 HG LEU A 45 1.964 1.477 1.248 1.00 0.00 H new ATOM 0 HD11 LEU A 45 0.857 3.028 -0.313 1.00 0.00 H new ATOM 0 HD12 LEU A 45 2.326 2.313 -1.021 1.00 0.00 H new ATOM 0 HD13 LEU A 45 0.722 1.718 -1.510 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -0.483 1.760 1.325 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -0.671 0.400 0.193 1.00 0.00 H new ATOM 0 HD23 LEU A 45 0.007 0.121 1.814 1.00 0.00 H new ATOM 686 N ARG A 46 4.189 -0.907 1.858 1.00 0.00 N ATOM 687 CA ARG A 46 4.886 -0.808 3.135 1.00 0.00 C ATOM 688 C ARG A 46 6.245 -0.137 2.962 1.00 0.00 C ATOM 689 O ARG A 46 6.640 0.705 3.768 1.00 0.00 O ATOM 690 CB ARG A 46 5.066 -2.197 3.751 1.00 0.00 C ATOM 691 CG ARG A 46 3.773 -2.807 4.266 1.00 0.00 C ATOM 692 CD ARG A 46 4.036 -3.827 5.363 1.00 0.00 C ATOM 693 NE ARG A 46 4.076 -3.209 6.686 1.00 0.00 N ATOM 694 CZ ARG A 46 3.465 -3.715 7.752 1.00 0.00 C ATOM 695 NH1 ARG A 46 2.772 -4.841 7.651 1.00 0.00 N ATOM 696 NH2 ARG A 46 3.548 -3.095 8.922 1.00 0.00 N ATOM 0 H ARG A 46 3.656 -1.768 1.734 1.00 0.00 H new ATOM 0 HA ARG A 46 4.281 -0.197 3.804 1.00 0.00 H new ATOM 0 HB2 ARG A 46 5.500 -2.863 3.005 1.00 0.00 H new ATOM 0 HB3 ARG A 46 5.779 -2.131 4.573 1.00 0.00 H new ATOM 0 HG2 ARG A 46 3.125 -2.019 4.649 1.00 0.00 H new ATOM 0 HG3 ARG A 46 3.242 -3.285 3.443 1.00 0.00 H new ATOM 0 HD2 ARG A 46 3.258 -4.590 5.343 1.00 0.00 H new ATOM 0 HD3 ARG A 46 4.983 -4.332 5.170 1.00 0.00 H new ATOM 0 HE ARG A 46 4.602 -2.342 6.798 1.00 0.00 H new ATOM 0 HH11 ARG A 46 2.707 -5.321 6.753 1.00 0.00 H new ATOM 0 HH12 ARG A 46 2.304 -5.227 8.471 1.00 0.00 H new ATOM 0 HH21 ARG A 46 4.081 -2.229 9.004 1.00 0.00 H new ATOM 0 HH22 ARG A 46 3.079 -3.484 9.740 1.00 0.00 H new ATOM 710 N PHE A 47 6.956 -0.515 1.905 1.00 0.00 N ATOM 711 CA PHE A 47 8.272 0.049 1.627 1.00 0.00 C ATOM 712 C PHE A 47 8.158 1.510 1.200 1.00 0.00 C ATOM 713 O PHE A 47 8.935 2.358 1.640 1.00 0.00 O ATOM 714 CB PHE A 47 8.976 -0.759 0.535 1.00 0.00 C ATOM 715 CG PHE A 47 10.169 -0.061 -0.053 1.00 0.00 C ATOM 716 CD1 PHE A 47 11.244 0.294 0.746 1.00 0.00 C ATOM 717 CD2 PHE A 47 10.215 0.241 -1.404 1.00 0.00 C ATOM 718 CE1 PHE A 47 12.342 0.938 0.207 1.00 0.00 C ATOM 719 CE2 PHE A 47 11.310 0.884 -1.949 1.00 0.00 C ATOM 720 CZ PHE A 47 12.376 1.232 -1.142 1.00 0.00 C ATOM 0 H PHE A 47 6.643 -1.210 1.227 1.00 0.00 H new ATOM 0 HA PHE A 47 8.861 0.001 2.543 1.00 0.00 H new ATOM 0 HB2 PHE A 47 9.293 -1.716 0.950 1.00 0.00 H new ATOM 0 HB3 PHE A 47 8.264 -0.977 -0.261 1.00 0.00 H new ATOM 0 HD1 PHE A 47 11.224 0.065 1.801 1.00 0.00 H new ATOM 0 HD2 PHE A 47 9.385 -0.029 -2.039 1.00 0.00 H new ATOM 0 HE1 PHE A 47 13.173 1.211 0.841 1.00 0.00 H new ATOM 0 HE2 PHE A 47 11.332 1.114 -3.004 1.00 0.00 H new ATOM 0 HZ PHE A 47 13.234 1.733 -1.565 1.00 0.00 H new ATOM 730 N TRP A 48 7.186 1.795 0.341 1.00 0.00 N ATOM 731 CA TRP A 48 6.971 3.152 -0.146 1.00 0.00 C ATOM 732 C TRP A 48 6.832 4.131 1.015 1.00 0.00 C ATOM 733 O TRP A 48 7.606 5.083 1.133 1.00 0.00 O ATOM 734 CB TRP A 48 5.722 3.208 -1.027 1.00 0.00 C ATOM 735 CG TRP A 48 5.625 4.462 -1.842 1.00 0.00 C ATOM 736 CD1 TRP A 48 6.320 4.756 -2.980 1.00 0.00 C ATOM 737 CD2 TRP A 48 4.786 5.592 -1.578 1.00 0.00 C ATOM 738 NE1 TRP A 48 5.963 6.001 -3.440 1.00 0.00 N ATOM 739 CE2 TRP A 48 5.024 6.534 -2.598 1.00 0.00 C ATOM 740 CE3 TRP A 48 3.857 5.899 -0.581 1.00 0.00 C ATOM 741 CZ2 TRP A 48 4.365 7.760 -2.647 1.00 0.00 C ATOM 742 CZ3 TRP A 48 3.205 7.117 -0.630 1.00 0.00 C ATOM 743 CH2 TRP A 48 3.460 8.034 -1.658 1.00 0.00 C ATOM 0 H TRP A 48 6.535 1.105 -0.032 1.00 0.00 H new ATOM 0 HA TRP A 48 7.839 3.440 -0.739 1.00 0.00 H new ATOM 0 HB2 TRP A 48 5.719 2.347 -1.696 1.00 0.00 H new ATOM 0 HB3 TRP A 48 4.837 3.124 -0.396 1.00 0.00 H new ATOM 0 HD1 TRP A 48 7.044 4.106 -3.449 1.00 0.00 H new ATOM 0 HE1 TRP A 48 6.337 6.454 -4.274 1.00 0.00 H new ATOM 0 HE3 TRP A 48 3.652 5.197 0.214 1.00 0.00 H new ATOM 0 HZ2 TRP A 48 4.561 8.469 -3.438 1.00 0.00 H new ATOM 0 HZ3 TRP A 48 2.487 7.366 0.137 1.00 0.00 H new ATOM 0 HH2 TRP A 48 2.932 8.976 -1.670 1.00 0.00 H new ATOM 754 N LEU A 49 5.844 3.893 1.870 1.00 0.00 N ATOM 755 CA LEU A 49 5.605 4.754 3.023 1.00 0.00 C ATOM 756 C LEU A 49 6.866 4.893 3.870 1.00 0.00 C ATOM 757 O LEU A 49 7.252 5.998 4.249 1.00 0.00 O ATOM 758 CB LEU A 49 4.464 4.195 3.874 1.00 0.00 C ATOM 759 CG LEU A 49 3.086 4.161 3.211 1.00 0.00 C ATOM 760 CD1 LEU A 49 2.104 3.369 4.060 1.00 0.00 C ATOM 761 CD2 LEU A 49 2.572 5.573 2.975 1.00 0.00 C ATOM 0 H LEU A 49 5.195 3.111 1.787 1.00 0.00 H new ATOM 0 HA LEU A 49 5.326 5.742 2.656 1.00 0.00 H new ATOM 0 HB2 LEU A 49 4.725 3.180 4.175 1.00 0.00 H new ATOM 0 HB3 LEU A 49 4.392 4.789 4.785 1.00 0.00 H new ATOM 0 HG LEU A 49 3.182 3.665 2.245 1.00 0.00 H new ATOM 0 HD11 LEU A 49 1.129 3.356 3.572 1.00 0.00 H new ATOM 0 HD12 LEU A 49 2.465 2.347 4.176 1.00 0.00 H new ATOM 0 HD13 LEU A 49 2.013 3.835 5.041 1.00 0.00 H new ATOM 0 HD21 LEU A 49 1.591 5.529 2.503 1.00 0.00 H new ATOM 0 HD22 LEU A 49 2.493 6.095 3.928 1.00 0.00 H new ATOM 0 HD23 LEU A 49 3.264 6.108 2.325 1.00 0.00 H new ATOM 773 N ALA A 50 7.504 3.764 4.161 1.00 0.00 N ATOM 774 CA ALA A 50 8.723 3.760 4.959 1.00 0.00 C ATOM 775 C ALA A 50 9.648 4.903 4.555 1.00 0.00 C ATOM 776 O ALA A 50 10.184 5.613 5.406 1.00 0.00 O ATOM 777 CB ALA A 50 9.440 2.425 4.822 1.00 0.00 C ATOM 0 H ALA A 50 7.196 2.841 3.856 1.00 0.00 H new ATOM 0 HA ALA A 50 8.444 3.905 6.003 1.00 0.00 H new ATOM 0 HB1 ALA A 50 10.349 2.437 5.424 1.00 0.00 H new ATOM 0 HB2 ALA A 50 8.787 1.624 5.167 1.00 0.00 H new ATOM 0 HB3 ALA A 50 9.699 2.257 3.777 1.00 0.00 H new ATOM 783 N VAL A 51 9.832 5.075 3.250 1.00 0.00 N ATOM 784 CA VAL A 51 10.692 6.133 2.732 1.00 0.00 C ATOM 785 C VAL A 51 10.160 7.510 3.112 1.00 0.00 C ATOM 786 O VAL A 51 10.889 8.340 3.654 1.00 0.00 O ATOM 787 CB VAL A 51 10.824 6.050 1.200 1.00 0.00 C ATOM 788 CG1 VAL A 51 11.741 7.147 0.682 1.00 0.00 C ATOM 789 CG2 VAL A 51 11.331 4.678 0.782 1.00 0.00 C ATOM 0 H VAL A 51 9.397 4.495 2.532 1.00 0.00 H new ATOM 0 HA VAL A 51 11.675 5.990 3.182 1.00 0.00 H new ATOM 0 HB VAL A 51 9.838 6.197 0.760 1.00 0.00 H new ATOM 0 HG11 VAL A 51 11.822 7.072 -0.402 1.00 0.00 H new ATOM 0 HG12 VAL A 51 11.330 8.121 0.949 1.00 0.00 H new ATOM 0 HG13 VAL A 51 12.729 7.036 1.128 1.00 0.00 H new ATOM 0 HG21 VAL A 51 11.418 4.638 -0.304 1.00 0.00 H new ATOM 0 HG22 VAL A 51 12.308 4.499 1.231 1.00 0.00 H new ATOM 0 HG23 VAL A 51 10.631 3.913 1.119 1.00 0.00 H new ATOM 799 N GLU A 52 8.883 7.745 2.824 1.00 0.00 N ATOM 800 CA GLU A 52 8.253 9.022 3.136 1.00 0.00 C ATOM 801 C GLU A 52 8.650 9.499 4.530 1.00 0.00 C ATOM 802 O GLU A 52 9.032 10.654 4.717 1.00 0.00 O ATOM 803 CB GLU A 52 6.731 8.902 3.040 1.00 0.00 C ATOM 804 CG GLU A 52 6.187 9.158 1.644 1.00 0.00 C ATOM 805 CD GLU A 52 4.673 9.091 1.587 1.00 0.00 C ATOM 806 OE1 GLU A 52 4.091 8.223 2.270 1.00 0.00 O ATOM 807 OE2 GLU A 52 4.071 9.907 0.859 1.00 0.00 O ATOM 0 H GLU A 52 8.266 7.068 2.376 1.00 0.00 H new ATOM 0 HA GLU A 52 8.599 9.756 2.408 1.00 0.00 H new ATOM 0 HB2 GLU A 52 6.433 7.903 3.360 1.00 0.00 H new ATOM 0 HB3 GLU A 52 6.275 9.608 3.734 1.00 0.00 H new ATOM 0 HG2 GLU A 52 6.517 10.140 1.304 1.00 0.00 H new ATOM 0 HG3 GLU A 52 6.606 8.425 0.955 1.00 0.00 H new ATOM 814 N ASP A 53 8.556 8.601 5.504 1.00 0.00 N ATOM 815 CA ASP A 53 8.905 8.929 6.882 1.00 0.00 C ATOM 816 C ASP A 53 10.419 8.990 7.059 1.00 0.00 C ATOM 817 O ASP A 53 10.943 9.901 7.701 1.00 0.00 O ATOM 818 CB ASP A 53 8.308 7.897 7.841 1.00 0.00 C ATOM 819 CG ASP A 53 8.184 8.427 9.256 1.00 0.00 C ATOM 820 OD1 ASP A 53 8.141 9.663 9.425 1.00 0.00 O ATOM 821 OD2 ASP A 53 8.131 7.604 10.195 1.00 0.00 O ATOM 0 H ASP A 53 8.241 7.641 5.366 1.00 0.00 H new ATOM 0 HA ASP A 53 8.490 9.910 7.112 1.00 0.00 H new ATOM 0 HB2 ASP A 53 7.324 7.597 7.481 1.00 0.00 H new ATOM 0 HB3 ASP A 53 8.933 7.004 7.844 1.00 0.00 H new ATOM 826 N LEU A 54 11.116 8.015 6.486 1.00 0.00 N ATOM 827 CA LEU A 54 12.571 7.957 6.581 1.00 0.00 C ATOM 828 C LEU A 54 13.173 9.358 6.576 1.00 0.00 C ATOM 829 O LEU A 54 13.779 9.789 7.557 1.00 0.00 O ATOM 830 CB LEU A 54 13.145 7.138 5.424 1.00 0.00 C ATOM 831 CG LEU A 54 14.665 7.173 5.266 1.00 0.00 C ATOM 832 CD1 LEU A 54 15.343 6.580 6.492 1.00 0.00 C ATOM 833 CD2 LEU A 54 15.088 6.428 4.009 1.00 0.00 C ATOM 0 H LEU A 54 10.698 7.254 5.951 1.00 0.00 H new ATOM 0 HA LEU A 54 12.830 7.474 7.523 1.00 0.00 H new ATOM 0 HB2 LEU A 54 12.837 6.100 5.552 1.00 0.00 H new ATOM 0 HB3 LEU A 54 12.695 7.492 4.496 1.00 0.00 H new ATOM 0 HG LEU A 54 14.977 8.213 5.170 1.00 0.00 H new ATOM 0 HD11 LEU A 54 16.425 6.613 6.361 1.00 0.00 H new ATOM 0 HD12 LEU A 54 15.066 7.156 7.375 1.00 0.00 H new ATOM 0 HD13 LEU A 54 15.025 5.545 6.619 1.00 0.00 H new ATOM 0 HD21 LEU A 54 16.173 6.463 3.913 1.00 0.00 H new ATOM 0 HD22 LEU A 54 14.763 5.390 4.075 1.00 0.00 H new ATOM 0 HD23 LEU A 54 14.631 6.896 3.137 1.00 0.00 H new ATOM 845 N LYS A 55 13.000 10.066 5.465 1.00 0.00 N ATOM 846 CA LYS A 55 13.524 11.421 5.332 1.00 0.00 C ATOM 847 C LYS A 55 13.054 12.301 6.485 1.00 0.00 C ATOM 848 O LYS A 55 13.835 13.062 7.057 1.00 0.00 O ATOM 849 CB LYS A 55 13.083 12.030 3.999 1.00 0.00 C ATOM 850 CG LYS A 55 11.576 12.081 3.821 1.00 0.00 C ATOM 851 CD LYS A 55 11.193 12.339 2.374 1.00 0.00 C ATOM 852 CE LYS A 55 11.197 11.054 1.559 1.00 0.00 C ATOM 853 NZ LYS A 55 10.790 11.292 0.146 1.00 0.00 N ATOM 0 H LYS A 55 12.501 9.724 4.644 1.00 0.00 H new ATOM 0 HA LYS A 55 14.612 11.368 5.359 1.00 0.00 H new ATOM 0 HB2 LYS A 55 13.484 13.041 3.921 1.00 0.00 H new ATOM 0 HB3 LYS A 55 13.517 11.451 3.184 1.00 0.00 H new ATOM 0 HG2 LYS A 55 11.138 11.139 4.152 1.00 0.00 H new ATOM 0 HG3 LYS A 55 11.161 12.865 4.454 1.00 0.00 H new ATOM 0 HD2 LYS A 55 10.203 12.794 2.334 1.00 0.00 H new ATOM 0 HD3 LYS A 55 11.889 13.053 1.934 1.00 0.00 H new ATOM 0 HE2 LYS A 55 12.194 10.613 1.581 1.00 0.00 H new ATOM 0 HE3 LYS A 55 10.520 10.332 2.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 10.723 10.382 -0.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 9.865 11.767 0.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 11.497 11.893 -0.322 1.00 0.00 H new ATOM 867 N LYS A 56 11.774 12.193 6.823 1.00 0.00 N ATOM 868 CA LYS A 56 11.200 12.977 7.910 1.00 0.00 C ATOM 869 C LYS A 56 11.962 12.743 9.211 1.00 0.00 C ATOM 870 O LYS A 56 12.187 13.673 9.985 1.00 0.00 O ATOM 871 CB LYS A 56 9.724 12.620 8.100 1.00 0.00 C ATOM 872 CG LYS A 56 8.878 12.847 6.859 1.00 0.00 C ATOM 873 CD LYS A 56 8.561 14.319 6.662 1.00 0.00 C ATOM 874 CE LYS A 56 8.313 14.645 5.197 1.00 0.00 C ATOM 875 NZ LYS A 56 7.868 16.054 5.010 1.00 0.00 N ATOM 0 H LYS A 56 11.113 11.569 6.359 1.00 0.00 H new ATOM 0 HA LYS A 56 11.281 14.031 7.646 1.00 0.00 H new ATOM 0 HB2 LYS A 56 9.647 11.574 8.395 1.00 0.00 H new ATOM 0 HB3 LYS A 56 9.318 13.213 8.920 1.00 0.00 H new ATOM 0 HG2 LYS A 56 9.405 12.467 5.984 1.00 0.00 H new ATOM 0 HG3 LYS A 56 7.950 12.282 6.942 1.00 0.00 H new ATOM 0 HD2 LYS A 56 7.682 14.584 7.249 1.00 0.00 H new ATOM 0 HD3 LYS A 56 9.388 14.923 7.035 1.00 0.00 H new ATOM 0 HE2 LYS A 56 9.226 14.474 4.627 1.00 0.00 H new ATOM 0 HE3 LYS A 56 7.557 13.969 4.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 7.710 16.237 3.999 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 6.983 16.211 5.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 8.600 16.700 5.368 1.00 0.00 H new ATOM 889 N ARG A 57 12.357 11.496 9.444 1.00 0.00 N ATOM 890 CA ARG A 57 13.094 11.140 10.650 1.00 0.00 C ATOM 891 C ARG A 57 14.309 12.046 10.832 1.00 0.00 C ATOM 892 O ARG A 57 14.958 12.454 9.869 1.00 0.00 O ATOM 893 CB ARG A 57 13.539 9.678 10.590 1.00 0.00 C ATOM 894 CG ARG A 57 12.384 8.691 10.542 1.00 0.00 C ATOM 895 CD ARG A 57 11.758 8.499 11.914 1.00 0.00 C ATOM 896 NE ARG A 57 10.450 7.855 11.834 1.00 0.00 N ATOM 897 CZ ARG A 57 9.849 7.279 12.870 1.00 0.00 C ATOM 898 NH1 ARG A 57 10.436 7.268 14.058 1.00 0.00 N ATOM 899 NH2 ARG A 57 8.659 6.713 12.717 1.00 0.00 N ATOM 0 H ARG A 57 12.179 10.715 8.813 1.00 0.00 H new ATOM 0 HA ARG A 57 12.430 11.275 11.504 1.00 0.00 H new ATOM 0 HB2 ARG A 57 14.166 9.534 9.710 1.00 0.00 H new ATOM 0 HB3 ARG A 57 14.157 9.459 11.461 1.00 0.00 H new ATOM 0 HG2 ARG A 57 11.628 9.048 9.843 1.00 0.00 H new ATOM 0 HG3 ARG A 57 12.739 7.732 10.165 1.00 0.00 H new ATOM 0 HD2 ARG A 57 12.422 7.896 12.534 1.00 0.00 H new ATOM 0 HD3 ARG A 57 11.656 9.467 12.404 1.00 0.00 H new ATOM 0 HE ARG A 57 9.971 7.847 10.933 1.00 0.00 H new ATOM 0 HH11 ARG A 57 11.351 7.702 14.179 1.00 0.00 H new ATOM 0 HH12 ARG A 57 9.973 6.825 14.852 1.00 0.00 H new ATOM 0 HH21 ARG A 57 8.205 6.720 11.804 1.00 0.00 H new ATOM 0 HH22 ARG A 57 8.198 6.271 13.513 1.00 0.00 H new ATOM 913 N PRO A 58 14.623 12.368 12.095 1.00 0.00 N ATOM 914 CA PRO A 58 15.761 13.228 12.433 1.00 0.00 C ATOM 915 C PRO A 58 17.100 12.548 12.169 1.00 0.00 C ATOM 916 O PRO A 58 17.157 11.342 11.926 1.00 0.00 O ATOM 917 CB PRO A 58 15.579 13.487 13.930 1.00 0.00 C ATOM 918 CG PRO A 58 14.797 12.318 14.424 1.00 0.00 C ATOM 919 CD PRO A 58 13.893 11.917 13.292 1.00 0.00 C ATOM 0 HA PRO A 58 15.779 14.135 11.829 1.00 0.00 H new ATOM 0 HB2 PRO A 58 16.540 13.564 14.438 1.00 0.00 H new ATOM 0 HB3 PRO A 58 15.048 14.422 14.108 1.00 0.00 H new ATOM 0 HG2 PRO A 58 15.457 11.498 14.706 1.00 0.00 H new ATOM 0 HG3 PRO A 58 14.220 12.581 15.310 1.00 0.00 H new ATOM 0 HD2 PRO A 58 13.722 10.841 13.276 1.00 0.00 H new ATOM 0 HD3 PRO A 58 12.916 12.394 13.370 1.00 0.00 H new ATOM 927 N ILE A 59 18.175 13.328 12.219 1.00 0.00 N ATOM 928 CA ILE A 59 19.513 12.800 11.987 1.00 0.00 C ATOM 929 C ILE A 59 19.805 11.619 12.906 1.00 0.00 C ATOM 930 O ILE A 59 20.545 10.703 12.545 1.00 0.00 O ATOM 931 CB ILE A 59 20.590 13.880 12.200 1.00 0.00 C ATOM 932 CG1 ILE A 59 21.981 13.305 11.927 1.00 0.00 C ATOM 933 CG2 ILE A 59 20.509 14.437 13.614 1.00 0.00 C ATOM 934 CD1 ILE A 59 22.329 13.236 10.457 1.00 0.00 C ATOM 0 H ILE A 59 18.145 14.328 12.418 1.00 0.00 H new ATOM 0 HA ILE A 59 19.545 12.467 10.950 1.00 0.00 H new ATOM 0 HB ILE A 59 20.410 14.695 11.499 1.00 0.00 H new ATOM 0 HG12 ILE A 59 22.724 13.915 12.440 1.00 0.00 H new ATOM 0 HG13 ILE A 59 22.041 12.304 12.354 1.00 0.00 H new ATOM 0 HG21 ILE A 59 21.276 15.199 13.749 1.00 0.00 H new ATOM 0 HG22 ILE A 59 19.526 14.879 13.775 1.00 0.00 H new ATOM 0 HG23 ILE A 59 20.667 13.632 14.332 1.00 0.00 H new ATOM 0 HD11 ILE A 59 23.329 12.819 10.339 1.00 0.00 H new ATOM 0 HD12 ILE A 59 21.608 12.602 9.942 1.00 0.00 H new ATOM 0 HD13 ILE A 59 22.301 14.238 10.029 1.00 0.00 H new ATOM 946 N LYS A 60 19.218 11.645 14.098 1.00 0.00 N ATOM 947 CA LYS A 60 19.411 10.575 15.070 1.00 0.00 C ATOM 948 C LYS A 60 18.752 9.284 14.597 1.00 0.00 C ATOM 949 O LYS A 60 19.223 8.189 14.901 1.00 0.00 O ATOM 950 CB LYS A 60 18.839 10.984 16.429 1.00 0.00 C ATOM 951 CG LYS A 60 17.348 11.274 16.399 1.00 0.00 C ATOM 952 CD LYS A 60 16.837 11.711 17.762 1.00 0.00 C ATOM 953 CE LYS A 60 16.986 13.211 17.959 1.00 0.00 C ATOM 954 NZ LYS A 60 17.053 13.578 19.401 1.00 0.00 N ATOM 0 H LYS A 60 18.604 12.396 14.414 1.00 0.00 H new ATOM 0 HA LYS A 60 20.482 10.399 15.171 1.00 0.00 H new ATOM 0 HB2 LYS A 60 19.032 10.189 17.149 1.00 0.00 H new ATOM 0 HB3 LYS A 60 19.366 11.870 16.784 1.00 0.00 H new ATOM 0 HG2 LYS A 60 17.143 12.054 15.665 1.00 0.00 H new ATOM 0 HG3 LYS A 60 16.810 10.383 16.076 1.00 0.00 H new ATOM 0 HD2 LYS A 60 15.788 11.432 17.865 1.00 0.00 H new ATOM 0 HD3 LYS A 60 17.385 11.184 18.543 1.00 0.00 H new ATOM 0 HE2 LYS A 60 17.889 13.555 17.454 1.00 0.00 H new ATOM 0 HE3 LYS A 60 16.145 13.724 17.493 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 17.154 14.609 19.492 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 16.181 13.272 19.878 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 17.871 13.109 19.841 1.00 0.00 H new ATOM 968 N GLU A 61 17.660 9.421 13.850 1.00 0.00 N ATOM 969 CA GLU A 61 16.938 8.264 13.335 1.00 0.00 C ATOM 970 C GLU A 61 16.975 8.234 11.810 1.00 0.00 C ATOM 971 O GLU A 61 16.228 7.491 11.173 1.00 0.00 O ATOM 972 CB GLU A 61 15.487 8.283 13.820 1.00 0.00 C ATOM 973 CG GLU A 61 15.327 7.880 15.277 1.00 0.00 C ATOM 974 CD GLU A 61 15.808 6.467 15.547 1.00 0.00 C ATOM 975 OE1 GLU A 61 17.038 6.260 15.610 1.00 0.00 O ATOM 976 OE2 GLU A 61 14.953 5.569 15.697 1.00 0.00 O ATOM 0 H GLU A 61 17.257 10.321 13.589 1.00 0.00 H new ATOM 0 HA GLU A 61 17.428 7.366 13.711 1.00 0.00 H new ATOM 0 HB2 GLU A 61 15.080 9.285 13.682 1.00 0.00 H new ATOM 0 HB3 GLU A 61 14.896 7.610 13.199 1.00 0.00 H new ATOM 0 HG2 GLU A 61 15.883 8.576 15.906 1.00 0.00 H new ATOM 0 HG3 GLU A 61 14.278 7.963 15.560 1.00 0.00 H new ATOM 983 N VAL A 62 17.851 9.049 11.229 1.00 0.00 N ATOM 984 CA VAL A 62 17.987 9.117 9.779 1.00 0.00 C ATOM 985 C VAL A 62 18.733 7.901 9.239 1.00 0.00 C ATOM 986 O VAL A 62 18.222 7.145 8.413 1.00 0.00 O ATOM 987 CB VAL A 62 18.728 10.395 9.344 1.00 0.00 C ATOM 988 CG1 VAL A 62 19.535 10.140 8.079 1.00 0.00 C ATOM 989 CG2 VAL A 62 17.745 11.537 9.138 1.00 0.00 C ATOM 0 H VAL A 62 18.477 9.671 11.741 1.00 0.00 H new ATOM 0 HA VAL A 62 16.978 9.133 9.367 1.00 0.00 H new ATOM 0 HB VAL A 62 19.420 10.681 10.136 1.00 0.00 H new ATOM 0 HG11 VAL A 62 20.052 11.054 7.787 1.00 0.00 H new ATOM 0 HG12 VAL A 62 20.266 9.354 8.266 1.00 0.00 H new ATOM 0 HG13 VAL A 62 18.866 9.829 7.277 1.00 0.00 H new ATOM 0 HG21 VAL A 62 18.286 12.432 8.831 1.00 0.00 H new ATOM 0 HG22 VAL A 62 17.027 11.264 8.365 1.00 0.00 H new ATOM 0 HG23 VAL A 62 17.216 11.735 10.071 1.00 0.00 H new ATOM 999 N PRO A 63 19.971 7.707 9.717 1.00 0.00 N ATOM 1000 CA PRO A 63 20.814 6.583 9.297 1.00 0.00 C ATOM 1001 C PRO A 63 20.298 5.245 9.817 1.00 0.00 C ATOM 1002 O PRO A 63 20.129 4.295 9.052 1.00 0.00 O ATOM 1003 CB PRO A 63 22.174 6.909 9.918 1.00 0.00 C ATOM 1004 CG PRO A 63 21.858 7.772 11.091 1.00 0.00 C ATOM 1005 CD PRO A 63 20.643 8.568 10.704 1.00 0.00 C ATOM 0 HA PRO A 63 20.840 6.476 8.213 1.00 0.00 H new ATOM 0 HB2 PRO A 63 22.697 6.003 10.223 1.00 0.00 H new ATOM 0 HB3 PRO A 63 22.819 7.426 9.208 1.00 0.00 H new ATOM 0 HG2 PRO A 63 21.663 7.169 11.978 1.00 0.00 H new ATOM 0 HG3 PRO A 63 22.695 8.428 11.329 1.00 0.00 H new ATOM 0 HD2 PRO A 63 20.004 8.769 11.564 1.00 0.00 H new ATOM 0 HD3 PRO A 63 20.914 9.533 10.276 1.00 0.00 H new ATOM 1013 N SER A 64 20.048 5.179 11.121 1.00 0.00 N ATOM 1014 CA SER A 64 19.554 3.956 11.743 1.00 0.00 C ATOM 1015 C SER A 64 18.407 3.359 10.933 1.00 0.00 C ATOM 1016 O SER A 64 18.280 2.140 10.821 1.00 0.00 O ATOM 1017 CB SER A 64 19.091 4.237 13.173 1.00 0.00 C ATOM 1018 OG SER A 64 20.186 4.235 14.073 1.00 0.00 O ATOM 0 H SER A 64 20.179 5.958 11.767 1.00 0.00 H new ATOM 0 HA SER A 64 20.371 3.235 11.768 1.00 0.00 H new ATOM 0 HB2 SER A 64 18.586 5.202 13.212 1.00 0.00 H new ATOM 0 HB3 SER A 64 18.364 3.484 13.478 1.00 0.00 H new ATOM 0 HG SER A 64 19.864 4.419 14.980 1.00 0.00 H new ATOM 1024 N ARG A 65 17.575 4.229 10.370 1.00 0.00 N ATOM 1025 CA ARG A 65 16.437 3.789 9.571 1.00 0.00 C ATOM 1026 C ARG A 65 16.883 3.372 8.173 1.00 0.00 C ATOM 1027 O ARG A 65 16.461 2.336 7.658 1.00 0.00 O ATOM 1028 CB ARG A 65 15.394 4.905 9.473 1.00 0.00 C ATOM 1029 CG ARG A 65 13.974 4.396 9.289 1.00 0.00 C ATOM 1030 CD ARG A 65 13.341 4.016 10.619 1.00 0.00 C ATOM 1031 NE ARG A 65 11.891 4.192 10.606 1.00 0.00 N ATOM 1032 CZ ARG A 65 11.056 3.467 11.342 1.00 0.00 C ATOM 1033 NH1 ARG A 65 11.525 2.522 12.145 1.00 0.00 N ATOM 1034 NH2 ARG A 65 9.750 3.686 11.275 1.00 0.00 N ATOM 0 H ARG A 65 17.667 5.242 10.452 1.00 0.00 H new ATOM 0 HA ARG A 65 15.991 2.925 10.064 1.00 0.00 H new ATOM 0 HB2 ARG A 65 15.439 5.513 10.376 1.00 0.00 H new ATOM 0 HB3 ARG A 65 15.649 5.557 8.637 1.00 0.00 H new ATOM 0 HG2 ARG A 65 13.371 5.164 8.804 1.00 0.00 H new ATOM 0 HG3 ARG A 65 13.980 3.530 8.627 1.00 0.00 H new ATOM 0 HD2 ARG A 65 13.578 2.977 10.849 1.00 0.00 H new ATOM 0 HD3 ARG A 65 13.773 4.625 11.413 1.00 0.00 H new ATOM 0 HE ARG A 65 11.498 4.911 9.998 1.00 0.00 H new ATOM 0 HH11 ARG A 65 12.529 2.350 12.199 1.00 0.00 H new ATOM 0 HH12 ARG A 65 10.882 1.967 12.709 1.00 0.00 H new ATOM 0 HH21 ARG A 65 9.386 4.412 10.658 1.00 0.00 H new ATOM 0 HH22 ARG A 65 9.110 3.129 11.841 1.00 0.00 H new ATOM 1048 N VAL A 66 17.738 4.186 7.562 1.00 0.00 N ATOM 1049 CA VAL A 66 18.242 3.901 6.224 1.00 0.00 C ATOM 1050 C VAL A 66 18.448 2.404 6.021 1.00 0.00 C ATOM 1051 O VAL A 66 17.766 1.778 5.211 1.00 0.00 O ATOM 1052 CB VAL A 66 19.572 4.632 5.958 1.00 0.00 C ATOM 1053 CG1 VAL A 66 20.251 4.071 4.718 1.00 0.00 C ATOM 1054 CG2 VAL A 66 19.338 6.128 5.816 1.00 0.00 C ATOM 0 H VAL A 66 18.096 5.048 7.973 1.00 0.00 H new ATOM 0 HA VAL A 66 17.491 4.260 5.520 1.00 0.00 H new ATOM 0 HB VAL A 66 20.232 4.470 6.810 1.00 0.00 H new ATOM 0 HG11 VAL A 66 21.189 4.600 4.546 1.00 0.00 H new ATOM 0 HG12 VAL A 66 20.454 3.010 4.863 1.00 0.00 H new ATOM 0 HG13 VAL A 66 19.598 4.201 3.855 1.00 0.00 H new ATOM 0 HG21 VAL A 66 20.288 6.629 5.629 1.00 0.00 H new ATOM 0 HG22 VAL A 66 18.660 6.313 4.983 1.00 0.00 H new ATOM 0 HG23 VAL A 66 18.898 6.516 6.735 1.00 0.00 H new ATOM 1064 N GLN A 67 19.394 1.837 6.764 1.00 0.00 N ATOM 1065 CA GLN A 67 19.689 0.412 6.665 1.00 0.00 C ATOM 1066 C GLN A 67 18.459 -0.424 7.000 1.00 0.00 C ATOM 1067 O GLN A 67 18.114 -1.356 6.275 1.00 0.00 O ATOM 1068 CB GLN A 67 20.842 0.043 7.600 1.00 0.00 C ATOM 1069 CG GLN A 67 20.467 0.083 9.073 1.00 0.00 C ATOM 1070 CD GLN A 67 21.672 -0.029 9.985 1.00 0.00 C ATOM 1071 OE1 GLN A 67 22.419 -1.006 9.930 1.00 0.00 O ATOM 1072 NE2 GLN A 67 21.869 0.975 10.833 1.00 0.00 N ATOM 0 H GLN A 67 19.968 2.341 7.440 1.00 0.00 H new ATOM 0 HA GLN A 67 19.981 0.198 5.637 1.00 0.00 H new ATOM 0 HB2 GLN A 67 21.195 -0.958 7.351 1.00 0.00 H new ATOM 0 HB3 GLN A 67 21.673 0.727 7.426 1.00 0.00 H new ATOM 0 HG2 GLN A 67 19.941 1.014 9.285 1.00 0.00 H new ATOM 0 HG3 GLN A 67 19.775 -0.731 9.290 1.00 0.00 H new ATOM 0 HE21 GLN A 67 21.225 1.766 10.845 1.00 0.00 H new ATOM 0 HE22 GLN A 67 22.664 0.955 11.472 1.00 0.00 H new ATOM 1081 N GLU A 68 17.802 -0.084 8.105 1.00 0.00 N ATOM 1082 CA GLU A 68 16.610 -0.805 8.536 1.00 0.00 C ATOM 1083 C GLU A 68 15.661 -1.038 7.364 1.00 0.00 C ATOM 1084 O GLU A 68 15.363 -2.179 7.011 1.00 0.00 O ATOM 1085 CB GLU A 68 15.891 -0.031 9.643 1.00 0.00 C ATOM 1086 CG GLU A 68 16.457 -0.285 11.030 1.00 0.00 C ATOM 1087 CD GLU A 68 16.261 -1.718 11.486 1.00 0.00 C ATOM 1088 OE1 GLU A 68 15.109 -2.199 11.453 1.00 0.00 O ATOM 1089 OE2 GLU A 68 17.260 -2.359 11.877 1.00 0.00 O ATOM 0 H GLU A 68 18.075 0.685 8.717 1.00 0.00 H new ATOM 0 HA GLU A 68 16.924 -1.774 8.925 1.00 0.00 H new ATOM 0 HB2 GLU A 68 15.949 1.036 9.426 1.00 0.00 H new ATOM 0 HB3 GLU A 68 14.835 -0.300 9.636 1.00 0.00 H new ATOM 0 HG2 GLU A 68 17.521 -0.049 11.033 1.00 0.00 H new ATOM 0 HG3 GLU A 68 15.979 0.388 11.742 1.00 0.00 H new ATOM 1096 N ILE A 69 15.190 0.051 6.767 1.00 0.00 N ATOM 1097 CA ILE A 69 14.275 -0.034 5.635 1.00 0.00 C ATOM 1098 C ILE A 69 14.820 -0.965 4.557 1.00 0.00 C ATOM 1099 O ILE A 69 14.088 -1.787 4.005 1.00 0.00 O ATOM 1100 CB ILE A 69 14.014 1.352 5.017 1.00 0.00 C ATOM 1101 CG1 ILE A 69 13.382 2.285 6.051 1.00 0.00 C ATOM 1102 CG2 ILE A 69 13.120 1.226 3.792 1.00 0.00 C ATOM 1103 CD1 ILE A 69 13.648 3.751 5.786 1.00 0.00 C ATOM 0 H ILE A 69 15.427 1.003 7.048 1.00 0.00 H new ATOM 0 HA ILE A 69 13.336 -0.435 6.017 1.00 0.00 H new ATOM 0 HB ILE A 69 14.967 1.779 4.705 1.00 0.00 H new ATOM 0 HG12 ILE A 69 12.305 2.117 6.069 1.00 0.00 H new ATOM 0 HG13 ILE A 69 13.762 2.028 7.040 1.00 0.00 H new ATOM 0 HG21 ILE A 69 12.945 2.214 3.366 1.00 0.00 H new ATOM 0 HG22 ILE A 69 13.606 0.592 3.050 1.00 0.00 H new ATOM 0 HG23 ILE A 69 12.168 0.781 4.081 1.00 0.00 H new ATOM 0 HD11 ILE A 69 13.170 4.353 6.559 1.00 0.00 H new ATOM 0 HD12 ILE A 69 14.723 3.934 5.797 1.00 0.00 H new ATOM 0 HD13 ILE A 69 13.243 4.024 4.811 1.00 0.00 H new ATOM 1115 N TRP A 70 16.108 -0.831 4.264 1.00 0.00 N ATOM 1116 CA TRP A 70 16.752 -1.662 3.253 1.00 0.00 C ATOM 1117 C TRP A 70 16.913 -3.095 3.748 1.00 0.00 C ATOM 1118 O TRP A 70 17.159 -4.009 2.961 1.00 0.00 O ATOM 1119 CB TRP A 70 18.117 -1.082 2.879 1.00 0.00 C ATOM 1120 CG TRP A 70 19.156 -2.129 2.617 1.00 0.00 C ATOM 1121 CD1 TRP A 70 19.819 -2.877 3.548 1.00 0.00 C ATOM 1122 CD2 TRP A 70 19.652 -2.543 1.339 1.00 0.00 C ATOM 1123 NE1 TRP A 70 20.698 -3.731 2.925 1.00 0.00 N ATOM 1124 CE2 TRP A 70 20.613 -3.546 1.571 1.00 0.00 C ATOM 1125 CE3 TRP A 70 19.375 -2.166 0.022 1.00 0.00 C ATOM 1126 CZ2 TRP A 70 21.299 -4.173 0.533 1.00 0.00 C ATOM 1127 CZ3 TRP A 70 20.057 -2.789 -1.006 1.00 0.00 C ATOM 1128 CH2 TRP A 70 21.009 -3.784 -0.746 1.00 0.00 C ATOM 0 H TRP A 70 16.727 -0.155 4.712 1.00 0.00 H new ATOM 0 HA TRP A 70 16.115 -1.672 2.368 1.00 0.00 H new ATOM 0 HB2 TRP A 70 18.008 -0.459 1.992 1.00 0.00 H new ATOM 0 HB3 TRP A 70 18.461 -0.433 3.684 1.00 0.00 H new ATOM 0 HD1 TRP A 70 19.674 -2.808 4.616 1.00 0.00 H new ATOM 0 HE1 TRP A 70 21.314 -4.395 3.395 1.00 0.00 H new ATOM 0 HE3 TRP A 70 18.641 -1.402 -0.189 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 22.034 -4.939 0.731 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 19.853 -2.504 -2.028 1.00 0.00 H new ATOM 0 HH2 TRP A 70 21.524 -4.253 -1.572 1.00 0.00 H new ATOM 1139 N GLN A 71 16.773 -3.284 5.056 1.00 0.00 N ATOM 1140 CA GLN A 71 16.904 -4.607 5.655 1.00 0.00 C ATOM 1141 C GLN A 71 15.542 -5.278 5.797 1.00 0.00 C ATOM 1142 O GLN A 71 15.446 -6.419 6.248 1.00 0.00 O ATOM 1143 CB GLN A 71 17.582 -4.506 7.023 1.00 0.00 C ATOM 1144 CG GLN A 71 19.072 -4.216 6.943 1.00 0.00 C ATOM 1145 CD GLN A 71 19.837 -4.763 8.133 1.00 0.00 C ATOM 1146 OE1 GLN A 71 19.424 -4.597 9.281 1.00 0.00 O ATOM 1147 NE2 GLN A 71 20.959 -5.420 7.864 1.00 0.00 N ATOM 0 H GLN A 71 16.569 -2.538 5.721 1.00 0.00 H new ATOM 0 HA GLN A 71 17.522 -5.217 4.996 1.00 0.00 H new ATOM 0 HB2 GLN A 71 17.098 -3.720 7.602 1.00 0.00 H new ATOM 0 HB3 GLN A 71 17.431 -5.440 7.564 1.00 0.00 H new ATOM 0 HG2 GLN A 71 19.474 -4.649 6.027 1.00 0.00 H new ATOM 0 HG3 GLN A 71 19.226 -3.139 6.881 1.00 0.00 H new ATOM 0 HE21 GLN A 71 21.264 -5.534 6.897 1.00 0.00 H new ATOM 0 HE22 GLN A 71 21.516 -5.811 8.624 1.00 0.00 H new ATOM 1156 N GLU A 72 14.492 -4.561 5.411 1.00 0.00 N ATOM 1157 CA GLU A 72 13.134 -5.087 5.497 1.00 0.00 C ATOM 1158 C GLU A 72 12.620 -5.493 4.119 1.00 0.00 C ATOM 1159 O GLU A 72 12.022 -6.557 3.956 1.00 0.00 O ATOM 1160 CB GLU A 72 12.199 -4.048 6.118 1.00 0.00 C ATOM 1161 CG GLU A 72 10.781 -4.552 6.325 1.00 0.00 C ATOM 1162 CD GLU A 72 10.589 -5.217 7.674 1.00 0.00 C ATOM 1163 OE1 GLU A 72 11.027 -6.376 7.833 1.00 0.00 O ATOM 1164 OE2 GLU A 72 10.002 -4.577 8.572 1.00 0.00 O ATOM 0 H GLU A 72 14.555 -3.615 5.036 1.00 0.00 H new ATOM 0 HA GLU A 72 13.154 -5.972 6.133 1.00 0.00 H new ATOM 0 HB2 GLU A 72 12.607 -3.732 7.078 1.00 0.00 H new ATOM 0 HB3 GLU A 72 12.172 -3.167 5.477 1.00 0.00 H new ATOM 0 HG2 GLU A 72 10.086 -3.717 6.233 1.00 0.00 H new ATOM 0 HG3 GLU A 72 10.533 -5.262 5.536 1.00 0.00 H new ATOM 1171 N PHE A 73 12.855 -4.637 3.130 1.00 0.00 N ATOM 1172 CA PHE A 73 12.414 -4.904 1.766 1.00 0.00 C ATOM 1173 C PHE A 73 13.609 -5.099 0.837 1.00 0.00 C ATOM 1174 O PHE A 73 13.650 -6.046 0.050 1.00 0.00 O ATOM 1175 CB PHE A 73 11.539 -3.758 1.257 1.00 0.00 C ATOM 1176 CG PHE A 73 10.618 -3.196 2.302 1.00 0.00 C ATOM 1177 CD1 PHE A 73 11.067 -2.236 3.195 1.00 0.00 C ATOM 1178 CD2 PHE A 73 9.305 -3.627 2.392 1.00 0.00 C ATOM 1179 CE1 PHE A 73 10.222 -1.718 4.158 1.00 0.00 C ATOM 1180 CE2 PHE A 73 8.455 -3.113 3.353 1.00 0.00 C ATOM 1181 CZ PHE A 73 8.915 -2.156 4.237 1.00 0.00 C ATOM 0 H PHE A 73 13.349 -3.752 3.248 1.00 0.00 H new ATOM 0 HA PHE A 73 11.828 -5.823 1.773 1.00 0.00 H new ATOM 0 HB2 PHE A 73 12.181 -2.960 0.883 1.00 0.00 H new ATOM 0 HB3 PHE A 73 10.946 -4.112 0.414 1.00 0.00 H new ATOM 0 HD1 PHE A 73 12.088 -1.889 3.138 1.00 0.00 H new ATOM 0 HD2 PHE A 73 8.941 -4.374 1.703 1.00 0.00 H new ATOM 0 HE1 PHE A 73 10.584 -0.971 4.849 1.00 0.00 H new ATOM 0 HE2 PHE A 73 7.434 -3.459 3.413 1.00 0.00 H new ATOM 0 HZ PHE A 73 8.253 -1.751 4.989 1.00 0.00 H new ATOM 1191 N LEU A 74 14.578 -4.196 0.933 1.00 0.00 N ATOM 1192 CA LEU A 74 15.775 -4.267 0.101 1.00 0.00 C ATOM 1193 C LEU A 74 16.761 -5.291 0.652 1.00 0.00 C ATOM 1194 O LEU A 74 17.943 -5.278 0.308 1.00 0.00 O ATOM 1195 CB LEU A 74 16.442 -2.893 0.016 1.00 0.00 C ATOM 1196 CG LEU A 74 15.520 -1.717 -0.307 1.00 0.00 C ATOM 1197 CD1 LEU A 74 16.314 -0.423 -0.389 1.00 0.00 C ATOM 1198 CD2 LEU A 74 14.770 -1.969 -1.607 1.00 0.00 C ATOM 0 H LEU A 74 14.559 -3.406 1.578 1.00 0.00 H new ATOM 0 HA LEU A 74 15.475 -4.581 -0.899 1.00 0.00 H new ATOM 0 HB2 LEU A 74 16.935 -2.691 0.967 1.00 0.00 H new ATOM 0 HB3 LEU A 74 17.222 -2.937 -0.744 1.00 0.00 H new ATOM 0 HG LEU A 74 14.790 -1.620 0.497 1.00 0.00 H new ATOM 0 HD11 LEU A 74 15.641 0.403 -0.620 1.00 0.00 H new ATOM 0 HD12 LEU A 74 16.804 -0.236 0.566 1.00 0.00 H new ATOM 0 HD13 LEU A 74 17.067 -0.507 -1.173 1.00 0.00 H new ATOM 0 HD21 LEU A 74 14.118 -1.122 -1.821 1.00 0.00 H new ATOM 0 HD22 LEU A 74 15.484 -2.093 -2.421 1.00 0.00 H new ATOM 0 HD23 LEU A 74 14.169 -2.873 -1.511 1.00 0.00 H new ATOM 1210 N ALA A 75 16.267 -6.180 1.508 1.00 0.00 N ATOM 1211 CA ALA A 75 17.104 -7.214 2.103 1.00 0.00 C ATOM 1212 C ALA A 75 16.598 -8.606 1.740 1.00 0.00 C ATOM 1213 O ALA A 75 15.395 -8.867 1.707 1.00 0.00 O ATOM 1214 CB ALA A 75 17.155 -7.047 3.615 1.00 0.00 C ATOM 0 H ALA A 75 15.291 -6.204 1.805 1.00 0.00 H new ATOM 0 HA ALA A 75 18.112 -7.106 1.702 1.00 0.00 H new ATOM 0 HB1 ALA A 75 17.784 -7.826 4.046 1.00 0.00 H new ATOM 0 HB2 ALA A 75 17.570 -6.069 3.859 1.00 0.00 H new ATOM 0 HB3 ALA A 75 16.148 -7.126 4.024 1.00 0.00 H new ATOM 1220 N PRO A 76 17.536 -9.523 1.459 1.00 0.00 N ATOM 1221 CA PRO A 76 17.209 -10.904 1.093 1.00 0.00 C ATOM 1222 C PRO A 76 16.645 -11.697 2.267 1.00 0.00 C ATOM 1223 O PRO A 76 17.085 -11.538 3.405 1.00 0.00 O ATOM 1224 CB PRO A 76 18.555 -11.484 0.654 1.00 0.00 C ATOM 1225 CG PRO A 76 19.572 -10.664 1.370 1.00 0.00 C ATOM 1226 CD PRO A 76 18.989 -9.282 1.479 1.00 0.00 C ATOM 0 HA PRO A 76 16.439 -10.949 0.323 1.00 0.00 H new ATOM 0 HB2 PRO A 76 18.638 -12.538 0.920 1.00 0.00 H new ATOM 0 HB3 PRO A 76 18.682 -11.417 -0.427 1.00 0.00 H new ATOM 0 HG2 PRO A 76 19.782 -11.078 2.356 1.00 0.00 H new ATOM 0 HG3 PRO A 76 20.515 -10.648 0.823 1.00 0.00 H new ATOM 0 HD2 PRO A 76 19.301 -8.785 2.398 1.00 0.00 H new ATOM 0 HD3 PRO A 76 19.303 -8.647 0.651 1.00 0.00 H new ATOM 1234 N GLY A 77 15.668 -12.554 1.983 1.00 0.00 N ATOM 1235 CA GLY A 77 15.061 -13.359 3.027 1.00 0.00 C ATOM 1236 C GLY A 77 14.055 -12.579 3.850 1.00 0.00 C ATOM 1237 O GLY A 77 13.207 -13.164 4.523 1.00 0.00 O ATOM 0 H GLY A 77 15.287 -12.705 1.049 1.00 0.00 H new ATOM 0 HA2 GLY A 77 14.568 -14.220 2.577 1.00 0.00 H new ATOM 0 HA3 GLY A 77 15.841 -13.745 3.683 1.00 0.00 H new ATOM 1241 N ALA A 78 14.150 -11.254 3.797 1.00 0.00 N ATOM 1242 CA ALA A 78 13.241 -10.393 4.544 1.00 0.00 C ATOM 1243 C ALA A 78 11.787 -10.759 4.267 1.00 0.00 C ATOM 1244 O ALA A 78 11.466 -11.428 3.284 1.00 0.00 O ATOM 1245 CB ALA A 78 13.494 -8.933 4.198 1.00 0.00 C ATOM 0 H ALA A 78 14.847 -10.754 3.245 1.00 0.00 H new ATOM 0 HA ALA A 78 13.430 -10.542 5.607 1.00 0.00 H new ATOM 0 HB1 ALA A 78 12.808 -8.301 4.763 1.00 0.00 H new ATOM 0 HB2 ALA A 78 14.521 -8.672 4.452 1.00 0.00 H new ATOM 0 HB3 ALA A 78 13.334 -8.779 3.131 1.00 0.00 H new ATOM 1251 N PRO A 79 10.884 -10.313 5.153 1.00 0.00 N ATOM 1252 CA PRO A 79 9.449 -10.582 5.025 1.00 0.00 C ATOM 1253 C PRO A 79 8.820 -9.830 3.858 1.00 0.00 C ATOM 1254 O PRO A 79 8.109 -10.415 3.041 1.00 0.00 O ATOM 1255 CB PRO A 79 8.875 -10.083 6.354 1.00 0.00 C ATOM 1256 CG PRO A 79 9.844 -9.053 6.823 1.00 0.00 C ATOM 1257 CD PRO A 79 11.196 -9.510 6.348 1.00 0.00 C ATOM 0 HA PRO A 79 9.248 -11.635 4.826 1.00 0.00 H new ATOM 0 HB2 PRO A 79 7.880 -9.659 6.221 1.00 0.00 H new ATOM 0 HB3 PRO A 79 8.781 -10.895 7.075 1.00 0.00 H new ATOM 0 HG2 PRO A 79 9.598 -8.072 6.416 1.00 0.00 H new ATOM 0 HG3 PRO A 79 9.822 -8.962 7.909 1.00 0.00 H new ATOM 0 HD2 PRO A 79 11.844 -8.667 6.108 1.00 0.00 H new ATOM 0 HD3 PRO A 79 11.710 -10.101 7.106 1.00 0.00 H new ATOM 1265 N SER A 80 9.086 -8.529 3.785 1.00 0.00 N ATOM 1266 CA SER A 80 8.543 -7.696 2.718 1.00 0.00 C ATOM 1267 C SER A 80 9.564 -7.510 1.601 1.00 0.00 C ATOM 1268 O SER A 80 9.446 -6.599 0.782 1.00 0.00 O ATOM 1269 CB SER A 80 8.121 -6.334 3.272 1.00 0.00 C ATOM 1270 OG SER A 80 7.135 -6.476 4.279 1.00 0.00 O ATOM 0 H SER A 80 9.674 -8.029 4.452 1.00 0.00 H new ATOM 0 HA SER A 80 7.669 -8.200 2.306 1.00 0.00 H new ATOM 0 HB2 SER A 80 8.991 -5.819 3.680 1.00 0.00 H new ATOM 0 HB3 SER A 80 7.733 -5.714 2.464 1.00 0.00 H new ATOM 0 HG SER A 80 6.905 -5.594 4.638 1.00 0.00 H new ATOM 1276 N ALA A 81 10.568 -8.381 1.574 1.00 0.00 N ATOM 1277 CA ALA A 81 11.610 -8.314 0.557 1.00 0.00 C ATOM 1278 C ALA A 81 11.011 -8.115 -0.831 1.00 0.00 C ATOM 1279 O ALA A 81 10.445 -9.042 -1.412 1.00 0.00 O ATOM 1280 CB ALA A 81 12.461 -9.575 0.590 1.00 0.00 C ATOM 0 H ALA A 81 10.681 -9.141 2.245 1.00 0.00 H new ATOM 0 HA ALA A 81 12.243 -7.455 0.777 1.00 0.00 H new ATOM 0 HB1 ALA A 81 13.235 -9.512 -0.175 1.00 0.00 H new ATOM 0 HB2 ALA A 81 12.927 -9.674 1.571 1.00 0.00 H new ATOM 0 HB3 ALA A 81 11.832 -10.444 0.398 1.00 0.00 H new ATOM 1286 N ILE A 82 11.137 -6.901 -1.356 1.00 0.00 N ATOM 1287 CA ILE A 82 10.608 -6.582 -2.676 1.00 0.00 C ATOM 1288 C ILE A 82 11.661 -6.798 -3.758 1.00 0.00 C ATOM 1289 O ILE A 82 12.782 -7.216 -3.472 1.00 0.00 O ATOM 1290 CB ILE A 82 10.108 -5.127 -2.745 1.00 0.00 C ATOM 1291 CG1 ILE A 82 11.272 -4.155 -2.538 1.00 0.00 C ATOM 1292 CG2 ILE A 82 9.022 -4.890 -1.707 1.00 0.00 C ATOM 1293 CD1 ILE A 82 11.088 -2.831 -3.247 1.00 0.00 C ATOM 0 H ILE A 82 11.601 -6.123 -0.888 1.00 0.00 H new ATOM 0 HA ILE A 82 9.769 -7.255 -2.851 1.00 0.00 H new ATOM 0 HB ILE A 82 9.683 -4.951 -3.733 1.00 0.00 H new ATOM 0 HG12 ILE A 82 11.396 -3.972 -1.471 1.00 0.00 H new ATOM 0 HG13 ILE A 82 12.192 -4.622 -2.891 1.00 0.00 H new ATOM 0 HG21 ILE A 82 8.679 -3.857 -1.768 1.00 0.00 H new ATOM 0 HG22 ILE A 82 8.185 -5.562 -1.896 1.00 0.00 H new ATOM 0 HG23 ILE A 82 9.423 -5.081 -0.711 1.00 0.00 H new ATOM 0 HD11 ILE A 82 11.951 -2.193 -3.056 1.00 0.00 H new ATOM 0 HD12 ILE A 82 10.994 -3.002 -4.319 1.00 0.00 H new ATOM 0 HD13 ILE A 82 10.186 -2.342 -2.877 1.00 0.00 H new ATOM 1305 N ASN A 83 11.292 -6.508 -5.001 1.00 0.00 N ATOM 1306 CA ASN A 83 12.205 -6.669 -6.127 1.00 0.00 C ATOM 1307 C ASN A 83 12.242 -5.407 -6.983 1.00 0.00 C ATOM 1308 O ASN A 83 11.206 -4.924 -7.443 1.00 0.00 O ATOM 1309 CB ASN A 83 11.787 -7.867 -6.983 1.00 0.00 C ATOM 1310 CG ASN A 83 12.817 -8.208 -8.042 1.00 0.00 C ATOM 1311 OD1 ASN A 83 13.932 -8.625 -7.728 1.00 0.00 O ATOM 1312 ND2 ASN A 83 12.447 -8.031 -9.305 1.00 0.00 N ATOM 0 H ASN A 83 10.367 -6.160 -5.254 1.00 0.00 H new ATOM 0 HA ASN A 83 13.204 -6.846 -5.729 1.00 0.00 H new ATOM 0 HB2 ASN A 83 11.631 -8.733 -6.340 1.00 0.00 H new ATOM 0 HB3 ASN A 83 10.833 -7.651 -7.464 1.00 0.00 H new ATOM 0 HD21 ASN A 83 13.098 -8.243 -10.061 1.00 0.00 H new ATOM 0 HD22 ASN A 83 11.512 -7.683 -9.519 1.00 0.00 H new ATOM 1319 N LEU A 84 13.442 -4.876 -7.193 1.00 0.00 N ATOM 1320 CA LEU A 84 13.615 -3.669 -7.995 1.00 0.00 C ATOM 1321 C LEU A 84 14.309 -3.988 -9.315 1.00 0.00 C ATOM 1322 O LEU A 84 14.936 -5.037 -9.461 1.00 0.00 O ATOM 1323 CB LEU A 84 14.423 -2.629 -7.218 1.00 0.00 C ATOM 1324 CG LEU A 84 13.870 -2.235 -5.848 1.00 0.00 C ATOM 1325 CD1 LEU A 84 14.877 -1.383 -5.090 1.00 0.00 C ATOM 1326 CD2 LEU A 84 12.549 -1.495 -5.999 1.00 0.00 C ATOM 0 H LEU A 84 14.309 -5.262 -6.819 1.00 0.00 H new ATOM 0 HA LEU A 84 12.628 -3.263 -8.214 1.00 0.00 H new ATOM 0 HB2 LEU A 84 15.435 -3.011 -7.083 1.00 0.00 H new ATOM 0 HB3 LEU A 84 14.501 -1.729 -7.828 1.00 0.00 H new ATOM 0 HG LEU A 84 13.691 -3.145 -5.275 1.00 0.00 H new ATOM 0 HD11 LEU A 84 14.466 -1.112 -4.118 1.00 0.00 H new ATOM 0 HD12 LEU A 84 15.799 -1.948 -4.950 1.00 0.00 H new ATOM 0 HD13 LEU A 84 15.089 -0.478 -5.659 1.00 0.00 H new ATOM 0 HD21 LEU A 84 12.170 -1.222 -5.014 1.00 0.00 H new ATOM 0 HD22 LEU A 84 12.703 -0.593 -6.591 1.00 0.00 H new ATOM 0 HD23 LEU A 84 11.826 -2.139 -6.500 1.00 0.00 H new ATOM 1338 N ASP A 85 14.195 -3.074 -10.272 1.00 0.00 N ATOM 1339 CA ASP A 85 14.815 -3.255 -11.580 1.00 0.00 C ATOM 1340 C ASP A 85 16.330 -3.381 -11.451 1.00 0.00 C ATOM 1341 O ASP A 85 16.964 -2.634 -10.706 1.00 0.00 O ATOM 1342 CB ASP A 85 14.465 -2.085 -12.501 1.00 0.00 C ATOM 1343 CG ASP A 85 14.480 -2.477 -13.965 1.00 0.00 C ATOM 1344 OD1 ASP A 85 15.241 -3.400 -14.324 1.00 0.00 O ATOM 1345 OD2 ASP A 85 13.732 -1.860 -14.753 1.00 0.00 O ATOM 0 H ASP A 85 13.679 -2.200 -10.167 1.00 0.00 H new ATOM 0 HA ASP A 85 14.427 -4.177 -12.013 1.00 0.00 H new ATOM 0 HB2 ASP A 85 13.478 -1.704 -12.240 1.00 0.00 H new ATOM 0 HB3 ASP A 85 15.174 -1.273 -12.338 1.00 0.00 H new ATOM 1350 N SER A 86 16.904 -4.332 -12.180 1.00 0.00 N ATOM 1351 CA SER A 86 18.344 -4.560 -12.143 1.00 0.00 C ATOM 1352 C SER A 86 19.097 -3.245 -11.966 1.00 0.00 C ATOM 1353 O SER A 86 20.113 -3.186 -11.273 1.00 0.00 O ATOM 1354 CB SER A 86 18.805 -5.256 -13.425 1.00 0.00 C ATOM 1355 OG SER A 86 20.063 -5.881 -13.242 1.00 0.00 O ATOM 0 H SER A 86 16.394 -4.957 -12.804 1.00 0.00 H new ATOM 0 HA SER A 86 18.564 -5.203 -11.290 1.00 0.00 H new ATOM 0 HB2 SER A 86 18.066 -5.999 -13.725 1.00 0.00 H new ATOM 0 HB3 SER A 86 18.871 -4.528 -14.234 1.00 0.00 H new ATOM 0 HG SER A 86 20.335 -6.320 -14.075 1.00 0.00 H new ATOM 1361 N LYS A 87 18.592 -2.191 -12.598 1.00 0.00 N ATOM 1362 CA LYS A 87 19.214 -0.875 -12.512 1.00 0.00 C ATOM 1363 C LYS A 87 18.913 -0.219 -11.168 1.00 0.00 C ATOM 1364 O LYS A 87 19.818 0.033 -10.373 1.00 0.00 O ATOM 1365 CB LYS A 87 18.721 0.020 -13.651 1.00 0.00 C ATOM 1366 CG LYS A 87 19.015 1.495 -13.435 1.00 0.00 C ATOM 1367 CD LYS A 87 20.509 1.775 -13.455 1.00 0.00 C ATOM 1368 CE LYS A 87 21.003 2.064 -14.864 1.00 0.00 C ATOM 1369 NZ LYS A 87 20.586 3.415 -15.331 1.00 0.00 N ATOM 0 H LYS A 87 17.752 -2.223 -13.176 1.00 0.00 H new ATOM 0 HA LYS A 87 20.293 -1.003 -12.601 1.00 0.00 H new ATOM 0 HB2 LYS A 87 19.186 -0.302 -14.583 1.00 0.00 H new ATOM 0 HB3 LYS A 87 17.646 -0.114 -13.768 1.00 0.00 H new ATOM 0 HG2 LYS A 87 18.523 2.082 -14.211 1.00 0.00 H new ATOM 0 HG3 LYS A 87 18.597 1.814 -12.480 1.00 0.00 H new ATOM 0 HD2 LYS A 87 20.730 2.625 -12.809 1.00 0.00 H new ATOM 0 HD3 LYS A 87 21.046 0.918 -13.048 1.00 0.00 H new ATOM 0 HE2 LYS A 87 22.090 1.990 -14.890 1.00 0.00 H new ATOM 0 HE3 LYS A 87 20.616 1.308 -15.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 21.140 3.678 -16.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 19.575 3.402 -15.573 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 20.752 4.110 -14.575 1.00 0.00 H new ATOM 1383 N SER A 88 17.636 0.055 -10.921 1.00 0.00 N ATOM 1384 CA SER A 88 17.216 0.684 -9.674 1.00 0.00 C ATOM 1385 C SER A 88 17.902 0.032 -8.478 1.00 0.00 C ATOM 1386 O SER A 88 18.365 0.715 -7.565 1.00 0.00 O ATOM 1387 CB SER A 88 15.697 0.591 -9.518 1.00 0.00 C ATOM 1388 OG SER A 88 15.055 1.716 -10.095 1.00 0.00 O ATOM 0 H SER A 88 16.874 -0.149 -11.568 1.00 0.00 H new ATOM 0 HA SER A 88 17.507 1.734 -9.710 1.00 0.00 H new ATOM 0 HB2 SER A 88 15.335 -0.321 -9.992 1.00 0.00 H new ATOM 0 HB3 SER A 88 15.440 0.524 -8.461 1.00 0.00 H new ATOM 0 HG SER A 88 14.085 1.632 -9.984 1.00 0.00 H new ATOM 1394 N TYR A 89 17.965 -1.295 -8.492 1.00 0.00 N ATOM 1395 CA TYR A 89 18.592 -2.042 -7.408 1.00 0.00 C ATOM 1396 C TYR A 89 20.056 -1.642 -7.247 1.00 0.00 C ATOM 1397 O TYR A 89 20.489 -1.252 -6.163 1.00 0.00 O ATOM 1398 CB TYR A 89 18.488 -3.545 -7.669 1.00 0.00 C ATOM 1399 CG TYR A 89 18.575 -4.385 -6.415 1.00 0.00 C ATOM 1400 CD1 TYR A 89 17.576 -4.334 -5.450 1.00 0.00 C ATOM 1401 CD2 TYR A 89 19.657 -5.229 -6.194 1.00 0.00 C ATOM 1402 CE1 TYR A 89 17.652 -5.099 -4.302 1.00 0.00 C ATOM 1403 CE2 TYR A 89 19.740 -5.999 -5.050 1.00 0.00 C ATOM 1404 CZ TYR A 89 18.735 -5.930 -4.107 1.00 0.00 C ATOM 1405 OH TYR A 89 18.815 -6.694 -2.965 1.00 0.00 O ATOM 0 H TYR A 89 17.590 -1.875 -9.242 1.00 0.00 H new ATOM 0 HA TYR A 89 18.065 -1.804 -6.484 1.00 0.00 H new ATOM 0 HB2 TYR A 89 17.543 -3.753 -8.171 1.00 0.00 H new ATOM 0 HB3 TYR A 89 19.284 -3.843 -8.352 1.00 0.00 H new ATOM 0 HD1 TYR A 89 16.726 -3.685 -5.600 1.00 0.00 H new ATOM 0 HD2 TYR A 89 20.446 -5.284 -6.929 1.00 0.00 H new ATOM 0 HE1 TYR A 89 16.868 -5.046 -3.562 1.00 0.00 H new ATOM 0 HE2 TYR A 89 20.587 -6.651 -4.895 1.00 0.00 H new ATOM 0 HH TYR A 89 19.639 -7.224 -2.983 1.00 0.00 H new ATOM 1415 N ASP A 90 20.812 -1.742 -8.335 1.00 0.00 N ATOM 1416 CA ASP A 90 22.227 -1.390 -8.317 1.00 0.00 C ATOM 1417 C ASP A 90 22.427 0.029 -7.793 1.00 0.00 C ATOM 1418 O ASP A 90 23.277 0.271 -6.935 1.00 0.00 O ATOM 1419 CB ASP A 90 22.824 -1.518 -9.719 1.00 0.00 C ATOM 1420 CG ASP A 90 24.333 -1.377 -9.721 1.00 0.00 C ATOM 1421 OD1 ASP A 90 25.000 -2.128 -8.978 1.00 0.00 O ATOM 1422 OD2 ASP A 90 24.848 -0.515 -10.464 1.00 0.00 O ATOM 0 H ASP A 90 20.469 -2.064 -9.240 1.00 0.00 H new ATOM 0 HA ASP A 90 22.740 -2.081 -7.648 1.00 0.00 H new ATOM 0 HB2 ASP A 90 22.552 -2.486 -10.139 1.00 0.00 H new ATOM 0 HB3 ASP A 90 22.390 -0.756 -10.366 1.00 0.00 H new ATOM 1427 N LYS A 91 21.640 0.963 -8.314 1.00 0.00 N ATOM 1428 CA LYS A 91 21.730 2.358 -7.900 1.00 0.00 C ATOM 1429 C LYS A 91 21.449 2.502 -6.407 1.00 0.00 C ATOM 1430 O LYS A 91 22.161 3.212 -5.696 1.00 0.00 O ATOM 1431 CB LYS A 91 20.744 3.214 -8.699 1.00 0.00 C ATOM 1432 CG LYS A 91 20.715 4.670 -8.269 1.00 0.00 C ATOM 1433 CD LYS A 91 19.698 4.905 -7.165 1.00 0.00 C ATOM 1434 CE LYS A 91 19.605 6.378 -6.797 1.00 0.00 C ATOM 1435 NZ LYS A 91 18.840 6.588 -5.536 1.00 0.00 N ATOM 0 H LYS A 91 20.932 0.779 -9.025 1.00 0.00 H new ATOM 0 HA LYS A 91 22.745 2.704 -8.097 1.00 0.00 H new ATOM 0 HB2 LYS A 91 21.004 3.161 -9.756 1.00 0.00 H new ATOM 0 HB3 LYS A 91 19.744 2.793 -8.595 1.00 0.00 H new ATOM 0 HG2 LYS A 91 21.705 4.968 -7.923 1.00 0.00 H new ATOM 0 HG3 LYS A 91 20.475 5.299 -9.126 1.00 0.00 H new ATOM 0 HD2 LYS A 91 18.720 4.547 -7.487 1.00 0.00 H new ATOM 0 HD3 LYS A 91 19.975 4.326 -6.284 1.00 0.00 H new ATOM 0 HE2 LYS A 91 20.609 6.788 -6.685 1.00 0.00 H new ATOM 0 HE3 LYS A 91 19.125 6.925 -7.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 19.137 7.481 -5.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 17.823 6.629 -5.750 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 19.025 5.800 -4.882 1.00 0.00 H new ATOM 1449 N THR A 92 20.408 1.822 -5.937 1.00 0.00 N ATOM 1450 CA THR A 92 20.034 1.873 -4.529 1.00 0.00 C ATOM 1451 C THR A 92 21.110 1.245 -3.651 1.00 0.00 C ATOM 1452 O THR A 92 21.697 1.910 -2.797 1.00 0.00 O ATOM 1453 CB THR A 92 18.696 1.153 -4.277 1.00 0.00 C ATOM 1454 OG1 THR A 92 17.658 1.762 -5.053 1.00 0.00 O ATOM 1455 CG2 THR A 92 18.327 1.199 -2.802 1.00 0.00 C ATOM 0 H THR A 92 19.809 1.229 -6.511 1.00 0.00 H new ATOM 0 HA THR A 92 19.926 2.926 -4.269 1.00 0.00 H new ATOM 0 HB THR A 92 18.808 0.111 -4.575 1.00 0.00 H new ATOM 0 HG1 THR A 92 17.754 1.498 -5.992 1.00 0.00 H new ATOM 0 HG21 THR A 92 17.379 0.684 -2.648 1.00 0.00 H new ATOM 0 HG22 THR A 92 19.105 0.709 -2.217 1.00 0.00 H new ATOM 0 HG23 THR A 92 18.233 2.237 -2.483 1.00 0.00 H new ATOM 1463 N THR A 93 21.366 -0.042 -3.867 1.00 0.00 N ATOM 1464 CA THR A 93 22.372 -0.761 -3.095 1.00 0.00 C ATOM 1465 C THR A 93 23.631 0.079 -2.915 1.00 0.00 C ATOM 1466 O THR A 93 24.215 0.116 -1.831 1.00 0.00 O ATOM 1467 CB THR A 93 22.750 -2.094 -3.767 1.00 0.00 C ATOM 1468 OG1 THR A 93 21.569 -2.860 -4.033 1.00 0.00 O ATOM 1469 CG2 THR A 93 23.694 -2.897 -2.885 1.00 0.00 C ATOM 0 H THR A 93 20.890 -0.607 -4.570 1.00 0.00 H new ATOM 0 HA THR A 93 21.933 -0.967 -2.119 1.00 0.00 H new ATOM 0 HB THR A 93 23.258 -1.871 -4.706 1.00 0.00 H new ATOM 0 HG1 THR A 93 21.138 -2.525 -4.847 1.00 0.00 H new ATOM 0 HG21 THR A 93 23.947 -3.834 -3.381 1.00 0.00 H new ATOM 0 HG22 THR A 93 24.604 -2.323 -2.709 1.00 0.00 H new ATOM 0 HG23 THR A 93 23.209 -3.110 -1.932 1.00 0.00 H new ATOM 1477 N HIS A 94 24.045 0.753 -3.983 1.00 0.00 N ATOM 1478 CA HIS A 94 25.235 1.595 -3.942 1.00 0.00 C ATOM 1479 C HIS A 94 24.994 2.837 -3.090 1.00 0.00 C ATOM 1480 O HIS A 94 25.834 3.215 -2.274 1.00 0.00 O ATOM 1481 CB HIS A 94 25.645 2.005 -5.357 1.00 0.00 C ATOM 1482 CG HIS A 94 26.890 2.837 -5.403 1.00 0.00 C ATOM 1483 ND1 HIS A 94 28.031 2.522 -4.697 1.00 0.00 N ATOM 1484 CD2 HIS A 94 27.169 3.976 -6.079 1.00 0.00 C ATOM 1485 CE1 HIS A 94 28.958 3.433 -4.934 1.00 0.00 C ATOM 1486 NE2 HIS A 94 28.460 4.326 -5.770 1.00 0.00 N ATOM 0 H HIS A 94 23.574 0.732 -4.887 1.00 0.00 H new ATOM 0 HA HIS A 94 26.042 1.018 -3.491 1.00 0.00 H new ATOM 0 HB2 HIS A 94 25.795 1.108 -5.957 1.00 0.00 H new ATOM 0 HB3 HIS A 94 24.828 2.562 -5.816 1.00 0.00 H new ATOM 0 HD2 HIS A 94 26.501 4.510 -6.738 1.00 0.00 H new ATOM 0 HE1 HIS A 94 29.954 3.445 -4.515 1.00 0.00 H new ATOM 0 HE2 HIS A 94 28.954 5.143 -6.128 1.00 0.00 H new ATOM 1494 N ASN A 95 23.840 3.468 -3.285 1.00 0.00 N ATOM 1495 CA ASN A 95 23.489 4.668 -2.535 1.00 0.00 C ATOM 1496 C ASN A 95 23.444 4.380 -1.037 1.00 0.00 C ATOM 1497 O ASN A 95 23.994 5.132 -0.232 1.00 0.00 O ATOM 1498 CB ASN A 95 22.136 5.209 -3.002 1.00 0.00 C ATOM 1499 CG ASN A 95 22.263 6.119 -4.209 1.00 0.00 C ATOM 1500 OD1 ASN A 95 23.115 5.908 -5.072 1.00 0.00 O ATOM 1501 ND2 ASN A 95 21.414 7.137 -4.273 1.00 0.00 N ATOM 0 H ASN A 95 23.133 3.168 -3.956 1.00 0.00 H new ATOM 0 HA ASN A 95 24.257 5.419 -2.720 1.00 0.00 H new ATOM 0 HB2 ASN A 95 21.479 4.375 -3.247 1.00 0.00 H new ATOM 0 HB3 ASN A 95 21.665 5.756 -2.185 1.00 0.00 H new ATOM 0 HD21 ASN A 95 21.451 7.784 -5.061 1.00 0.00 H new ATOM 0 HD22 ASN A 95 20.724 7.273 -3.534 1.00 0.00 H new ATOM 1508 N VAL A 96 22.785 3.285 -0.670 1.00 0.00 N ATOM 1509 CA VAL A 96 22.670 2.895 0.730 1.00 0.00 C ATOM 1510 C VAL A 96 23.959 3.187 1.490 1.00 0.00 C ATOM 1511 O VAL A 96 23.930 3.662 2.625 1.00 0.00 O ATOM 1512 CB VAL A 96 22.331 1.399 0.871 1.00 0.00 C ATOM 1513 CG1 VAL A 96 22.311 0.992 2.336 1.00 0.00 C ATOM 1514 CG2 VAL A 96 20.999 1.090 0.204 1.00 0.00 C ATOM 0 H VAL A 96 22.323 2.652 -1.323 1.00 0.00 H new ATOM 0 HA VAL A 96 21.859 3.485 1.157 1.00 0.00 H new ATOM 0 HB VAL A 96 23.106 0.819 0.369 1.00 0.00 H new ATOM 0 HG11 VAL A 96 22.070 -0.068 2.416 1.00 0.00 H new ATOM 0 HG12 VAL A 96 23.290 1.176 2.778 1.00 0.00 H new ATOM 0 HG13 VAL A 96 21.559 1.576 2.866 1.00 0.00 H new ATOM 0 HG21 VAL A 96 20.775 0.029 0.313 1.00 0.00 H new ATOM 0 HG22 VAL A 96 20.211 1.678 0.675 1.00 0.00 H new ATOM 0 HG23 VAL A 96 21.055 1.342 -0.855 1.00 0.00 H new ATOM 1524 N LYS A 97 25.091 2.899 0.856 1.00 0.00 N ATOM 1525 CA LYS A 97 26.393 3.132 1.470 1.00 0.00 C ATOM 1526 C LYS A 97 26.367 4.383 2.342 1.00 0.00 C ATOM 1527 O LYS A 97 26.892 4.384 3.455 1.00 0.00 O ATOM 1528 CB LYS A 97 27.470 3.271 0.392 1.00 0.00 C ATOM 1529 CG LYS A 97 27.608 2.043 -0.492 1.00 0.00 C ATOM 1530 CD LYS A 97 28.353 0.925 0.218 1.00 0.00 C ATOM 1531 CE LYS A 97 28.384 -0.344 -0.619 1.00 0.00 C ATOM 1532 NZ LYS A 97 29.218 -0.181 -1.842 1.00 0.00 N ATOM 0 H LYS A 97 25.133 2.504 -0.083 1.00 0.00 H new ATOM 0 HA LYS A 97 26.628 2.275 2.102 1.00 0.00 H new ATOM 0 HB2 LYS A 97 27.238 4.134 -0.233 1.00 0.00 H new ATOM 0 HB3 LYS A 97 28.428 3.473 0.871 1.00 0.00 H new ATOM 0 HG2 LYS A 97 26.619 1.693 -0.786 1.00 0.00 H new ATOM 0 HG3 LYS A 97 28.137 2.310 -1.407 1.00 0.00 H new ATOM 0 HD2 LYS A 97 29.372 1.245 0.433 1.00 0.00 H new ATOM 0 HD3 LYS A 97 27.875 0.719 1.176 1.00 0.00 H new ATOM 0 HE2 LYS A 97 28.776 -1.165 -0.019 1.00 0.00 H new ATOM 0 HE3 LYS A 97 27.368 -0.615 -0.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 29.269 -1.087 -2.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 28.792 0.539 -2.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 30.176 0.119 -1.571 1.00 0.00 H new ATOM 1546 N GLU A 98 25.752 5.444 1.830 1.00 0.00 N ATOM 1547 CA GLU A 98 25.659 6.700 2.564 1.00 0.00 C ATOM 1548 C GLU A 98 24.226 6.958 3.021 1.00 0.00 C ATOM 1549 O GLU A 98 23.315 7.148 2.214 1.00 0.00 O ATOM 1550 CB GLU A 98 26.146 7.862 1.695 1.00 0.00 C ATOM 1551 CG GLU A 98 25.512 7.897 0.315 1.00 0.00 C ATOM 1552 CD GLU A 98 25.648 9.251 -0.355 1.00 0.00 C ATOM 1553 OE1 GLU A 98 25.489 10.276 0.339 1.00 0.00 O ATOM 1554 OE2 GLU A 98 25.914 9.284 -1.575 1.00 0.00 O ATOM 0 H GLU A 98 25.311 5.459 0.910 1.00 0.00 H new ATOM 0 HA GLU A 98 26.295 6.624 3.446 1.00 0.00 H new ATOM 0 HB2 GLU A 98 25.934 8.801 2.207 1.00 0.00 H new ATOM 0 HB3 GLU A 98 27.229 7.795 1.587 1.00 0.00 H new ATOM 0 HG2 GLU A 98 25.976 7.137 -0.313 1.00 0.00 H new ATOM 0 HG3 GLU A 98 24.456 7.641 0.398 1.00 0.00 H new ATOM 1561 N PRO A 99 24.020 6.965 4.346 1.00 0.00 N ATOM 1562 CA PRO A 99 22.700 7.198 4.941 1.00 0.00 C ATOM 1563 C PRO A 99 22.230 8.637 4.762 1.00 0.00 C ATOM 1564 O PRO A 99 22.947 9.581 5.093 1.00 0.00 O ATOM 1565 CB PRO A 99 22.920 6.888 6.424 1.00 0.00 C ATOM 1566 CG PRO A 99 24.373 7.126 6.649 1.00 0.00 C ATOM 1567 CD PRO A 99 25.059 6.746 5.366 1.00 0.00 C ATOM 0 HA PRO A 99 21.928 6.587 4.473 1.00 0.00 H new ATOM 0 HB2 PRO A 99 22.311 7.532 7.058 1.00 0.00 H new ATOM 0 HB3 PRO A 99 22.646 5.859 6.658 1.00 0.00 H new ATOM 0 HG2 PRO A 99 24.563 8.170 6.899 1.00 0.00 H new ATOM 0 HG3 PRO A 99 24.742 6.527 7.481 1.00 0.00 H new ATOM 0 HD2 PRO A 99 25.939 7.363 5.183 1.00 0.00 H new ATOM 0 HD3 PRO A 99 25.395 5.709 5.382 1.00 0.00 H new ATOM 1575 N GLY A 100 21.019 8.798 4.236 1.00 0.00 N ATOM 1576 CA GLY A 100 20.474 10.126 4.022 1.00 0.00 C ATOM 1577 C GLY A 100 18.967 10.166 4.177 1.00 0.00 C ATOM 1578 O GLY A 100 18.398 9.417 4.972 1.00 0.00 O ATOM 0 H GLY A 100 20.406 8.033 3.955 1.00 0.00 H new ATOM 0 HA2 GLY A 100 20.927 10.820 4.730 1.00 0.00 H new ATOM 0 HA3 GLY A 100 20.743 10.469 3.023 1.00 0.00 H new ATOM 1582 N ARG A 101 18.318 11.042 3.417 1.00 0.00 N ATOM 1583 CA ARG A 101 16.868 11.178 3.476 1.00 0.00 C ATOM 1584 C ARG A 101 16.231 10.789 2.145 1.00 0.00 C ATOM 1585 O ARG A 101 15.149 10.201 2.111 1.00 0.00 O ATOM 1586 CB ARG A 101 16.483 12.614 3.838 1.00 0.00 C ATOM 1587 CG ARG A 101 16.830 12.995 5.268 1.00 0.00 C ATOM 1588 CD ARG A 101 16.773 14.501 5.472 1.00 0.00 C ATOM 1589 NE ARG A 101 17.499 14.919 6.668 1.00 0.00 N ATOM 1590 CZ ARG A 101 17.205 16.013 7.362 1.00 0.00 C ATOM 1591 NH1 ARG A 101 16.204 16.795 6.980 1.00 0.00 N ATOM 1592 NH2 ARG A 101 17.912 16.327 8.440 1.00 0.00 N ATOM 0 H ARG A 101 18.774 11.668 2.753 1.00 0.00 H new ATOM 0 HA ARG A 101 16.496 10.504 4.248 1.00 0.00 H new ATOM 0 HB2 ARG A 101 16.986 13.299 3.156 1.00 0.00 H new ATOM 0 HB3 ARG A 101 15.411 12.743 3.686 1.00 0.00 H new ATOM 0 HG2 ARG A 101 16.138 12.507 5.954 1.00 0.00 H new ATOM 0 HG3 ARG A 101 17.828 12.631 5.511 1.00 0.00 H new ATOM 0 HD2 ARG A 101 17.193 15.001 4.599 1.00 0.00 H new ATOM 0 HD3 ARG A 101 15.733 14.817 5.550 1.00 0.00 H new ATOM 0 HE ARG A 101 18.275 14.339 6.988 1.00 0.00 H new ATOM 0 HH11 ARG A 101 15.658 16.557 6.152 1.00 0.00 H new ATOM 0 HH12 ARG A 101 15.980 17.634 7.514 1.00 0.00 H new ATOM 0 HH21 ARG A 101 18.682 15.728 8.737 1.00 0.00 H new ATOM 0 HH22 ARG A 101 17.685 17.167 8.972 1.00 0.00 H new ATOM 1606 N TYR A 102 16.907 11.123 1.051 1.00 0.00 N ATOM 1607 CA TYR A 102 16.406 10.812 -0.282 1.00 0.00 C ATOM 1608 C TYR A 102 17.253 9.728 -0.943 1.00 0.00 C ATOM 1609 O TYR A 102 17.216 9.549 -2.161 1.00 0.00 O ATOM 1610 CB TYR A 102 16.398 12.069 -1.153 1.00 0.00 C ATOM 1611 CG TYR A 102 15.279 13.030 -0.819 1.00 0.00 C ATOM 1612 CD1 TYR A 102 15.445 14.009 0.154 1.00 0.00 C ATOM 1613 CD2 TYR A 102 14.057 12.958 -1.474 1.00 0.00 C ATOM 1614 CE1 TYR A 102 14.426 14.888 0.463 1.00 0.00 C ATOM 1615 CE2 TYR A 102 13.032 13.834 -1.172 1.00 0.00 C ATOM 1616 CZ TYR A 102 13.221 14.797 -0.203 1.00 0.00 C ATOM 1617 OH TYR A 102 12.203 15.671 0.101 1.00 0.00 O ATOM 0 H TYR A 102 17.804 11.609 1.062 1.00 0.00 H new ATOM 0 HA TYR A 102 15.386 10.441 -0.181 1.00 0.00 H new ATOM 0 HB2 TYR A 102 17.353 12.583 -1.043 1.00 0.00 H new ATOM 0 HB3 TYR A 102 16.313 11.775 -2.199 1.00 0.00 H new ATOM 0 HD1 TYR A 102 16.387 14.083 0.677 1.00 0.00 H new ATOM 0 HD2 TYR A 102 13.905 12.204 -2.233 1.00 0.00 H new ATOM 0 HE1 TYR A 102 14.571 15.643 1.222 1.00 0.00 H new ATOM 0 HE2 TYR A 102 12.088 13.765 -1.692 1.00 0.00 H new ATOM 0 HH TYR A 102 11.423 15.473 -0.459 1.00 0.00 H new ATOM 1627 N THR A 103 18.016 9.004 -0.130 1.00 0.00 N ATOM 1628 CA THR A 103 18.872 7.937 -0.633 1.00 0.00 C ATOM 1629 C THR A 103 18.077 6.944 -1.473 1.00 0.00 C ATOM 1630 O THR A 103 18.519 6.530 -2.545 1.00 0.00 O ATOM 1631 CB THR A 103 19.563 7.182 0.518 1.00 0.00 C ATOM 1632 OG1 THR A 103 20.325 8.094 1.316 1.00 0.00 O ATOM 1633 CG2 THR A 103 20.475 6.090 -0.022 1.00 0.00 C ATOM 0 H THR A 103 18.058 9.137 0.880 1.00 0.00 H new ATOM 0 HA THR A 103 19.632 8.408 -1.256 1.00 0.00 H new ATOM 0 HB THR A 103 18.791 6.719 1.133 1.00 0.00 H new ATOM 0 HG1 THR A 103 21.198 7.699 1.521 1.00 0.00 H new ATOM 0 HG21 THR A 103 20.952 5.570 0.809 1.00 0.00 H new ATOM 0 HG22 THR A 103 19.887 5.380 -0.604 1.00 0.00 H new ATOM 0 HG23 THR A 103 21.240 6.536 -0.658 1.00 0.00 H new ATOM 1641 N PHE A 104 16.903 6.566 -0.980 1.00 0.00 N ATOM 1642 CA PHE A 104 16.046 5.621 -1.686 1.00 0.00 C ATOM 1643 C PHE A 104 15.020 6.353 -2.546 1.00 0.00 C ATOM 1644 O PHE A 104 14.022 5.772 -2.969 1.00 0.00 O ATOM 1645 CB PHE A 104 15.332 4.705 -0.690 1.00 0.00 C ATOM 1646 CG PHE A 104 16.253 4.089 0.325 1.00 0.00 C ATOM 1647 CD1 PHE A 104 16.586 4.774 1.483 1.00 0.00 C ATOM 1648 CD2 PHE A 104 16.784 2.826 0.122 1.00 0.00 C ATOM 1649 CE1 PHE A 104 17.434 4.210 2.417 1.00 0.00 C ATOM 1650 CE2 PHE A 104 17.632 2.257 1.053 1.00 0.00 C ATOM 1651 CZ PHE A 104 17.957 2.950 2.203 1.00 0.00 C ATOM 0 H PHE A 104 16.523 6.900 -0.094 1.00 0.00 H new ATOM 0 HA PHE A 104 16.676 5.017 -2.339 1.00 0.00 H new ATOM 0 HB2 PHE A 104 14.562 5.276 -0.171 1.00 0.00 H new ATOM 0 HB3 PHE A 104 14.825 3.911 -1.238 1.00 0.00 H new ATOM 0 HD1 PHE A 104 16.178 5.759 1.657 1.00 0.00 H new ATOM 0 HD2 PHE A 104 16.532 2.279 -0.775 1.00 0.00 H new ATOM 0 HE1 PHE A 104 17.688 4.755 3.314 1.00 0.00 H new ATOM 0 HE2 PHE A 104 18.040 1.272 0.882 1.00 0.00 H new ATOM 0 HZ PHE A 104 18.619 2.507 2.933 1.00 0.00 H new ATOM 1661 N GLU A 105 15.275 7.633 -2.799 1.00 0.00 N ATOM 1662 CA GLU A 105 14.373 8.446 -3.606 1.00 0.00 C ATOM 1663 C GLU A 105 13.962 7.705 -4.875 1.00 0.00 C ATOM 1664 O GLU A 105 12.781 7.648 -5.218 1.00 0.00 O ATOM 1665 CB GLU A 105 15.038 9.775 -3.972 1.00 0.00 C ATOM 1666 CG GLU A 105 16.288 9.617 -4.820 1.00 0.00 C ATOM 1667 CD GLU A 105 16.944 10.945 -5.146 1.00 0.00 C ATOM 1668 OE1 GLU A 105 16.849 11.872 -4.314 1.00 0.00 O ATOM 1669 OE2 GLU A 105 17.551 11.058 -6.231 1.00 0.00 O ATOM 0 H GLU A 105 16.098 8.129 -2.457 1.00 0.00 H new ATOM 0 HA GLU A 105 13.479 8.646 -3.016 1.00 0.00 H new ATOM 0 HB2 GLU A 105 14.320 10.395 -4.510 1.00 0.00 H new ATOM 0 HB3 GLU A 105 15.295 10.307 -3.056 1.00 0.00 H new ATOM 0 HG2 GLU A 105 17.002 8.983 -4.294 1.00 0.00 H new ATOM 0 HG3 GLU A 105 16.031 9.106 -5.748 1.00 0.00 H new ATOM 1676 N ASP A 106 14.944 7.139 -5.567 1.00 0.00 N ATOM 1677 CA ASP A 106 14.686 6.400 -6.798 1.00 0.00 C ATOM 1678 C ASP A 106 13.767 5.211 -6.535 1.00 0.00 C ATOM 1679 O ASP A 106 12.635 5.171 -7.016 1.00 0.00 O ATOM 1680 CB ASP A 106 16.000 5.919 -7.415 1.00 0.00 C ATOM 1681 CG ASP A 106 16.763 7.037 -8.098 1.00 0.00 C ATOM 1682 OD1 ASP A 106 16.883 8.126 -7.499 1.00 0.00 O ATOM 1683 OD2 ASP A 106 17.240 6.822 -9.232 1.00 0.00 O ATOM 0 H ASP A 106 15.927 7.178 -5.297 1.00 0.00 H new ATOM 0 HA ASP A 106 14.190 7.072 -7.499 1.00 0.00 H new ATOM 0 HB2 ASP A 106 16.624 5.480 -6.637 1.00 0.00 H new ATOM 0 HB3 ASP A 106 15.791 5.131 -8.138 1.00 0.00 H new ATOM 1688 N ALA A 107 14.263 4.244 -5.770 1.00 0.00 N ATOM 1689 CA ALA A 107 13.487 3.055 -5.443 1.00 0.00 C ATOM 1690 C ALA A 107 12.037 3.413 -5.136 1.00 0.00 C ATOM 1691 O ALA A 107 11.112 2.786 -5.650 1.00 0.00 O ATOM 1692 CB ALA A 107 14.113 2.323 -4.265 1.00 0.00 C ATOM 0 H ALA A 107 15.199 4.261 -5.365 1.00 0.00 H new ATOM 0 HA ALA A 107 13.495 2.396 -6.311 1.00 0.00 H new ATOM 0 HB1 ALA A 107 13.523 1.437 -4.032 1.00 0.00 H new ATOM 0 HB2 ALA A 107 15.130 2.025 -4.521 1.00 0.00 H new ATOM 0 HB3 ALA A 107 14.136 2.982 -3.397 1.00 0.00 H new ATOM 1698 N GLN A 108 11.848 4.424 -4.294 1.00 0.00 N ATOM 1699 CA GLN A 108 10.509 4.863 -3.918 1.00 0.00 C ATOM 1700 C GLN A 108 9.684 5.211 -5.152 1.00 0.00 C ATOM 1701 O GLN A 108 8.492 4.911 -5.217 1.00 0.00 O ATOM 1702 CB GLN A 108 10.590 6.074 -2.986 1.00 0.00 C ATOM 1703 CG GLN A 108 9.239 6.703 -2.686 1.00 0.00 C ATOM 1704 CD GLN A 108 9.324 7.800 -1.644 1.00 0.00 C ATOM 1705 OE1 GLN A 108 10.206 8.658 -1.699 1.00 0.00 O ATOM 1706 NE2 GLN A 108 8.406 7.779 -0.685 1.00 0.00 N ATOM 0 H GLN A 108 12.604 4.954 -3.860 1.00 0.00 H new ATOM 0 HA GLN A 108 10.018 4.042 -3.395 1.00 0.00 H new ATOM 0 HB2 GLN A 108 11.056 5.770 -2.049 1.00 0.00 H new ATOM 0 HB3 GLN A 108 11.239 6.825 -3.436 1.00 0.00 H new ATOM 0 HG2 GLN A 108 8.821 7.112 -3.606 1.00 0.00 H new ATOM 0 HG3 GLN A 108 8.552 5.931 -2.340 1.00 0.00 H new ATOM 0 HE21 GLN A 108 7.693 7.050 -0.677 1.00 0.00 H new ATOM 0 HE22 GLN A 108 8.414 8.492 0.044 1.00 0.00 H new ATOM 1715 N GLU A 109 10.325 5.846 -6.127 1.00 0.00 N ATOM 1716 CA GLU A 109 9.648 6.236 -7.359 1.00 0.00 C ATOM 1717 C GLU A 109 9.338 5.014 -8.219 1.00 0.00 C ATOM 1718 O GLU A 109 8.257 4.908 -8.799 1.00 0.00 O ATOM 1719 CB GLU A 109 10.508 7.225 -8.149 1.00 0.00 C ATOM 1720 CG GLU A 109 10.186 7.261 -9.633 1.00 0.00 C ATOM 1721 CD GLU A 109 11.017 8.282 -10.386 1.00 0.00 C ATOM 1722 OE1 GLU A 109 10.867 9.490 -10.107 1.00 0.00 O ATOM 1723 OE2 GLU A 109 11.817 7.874 -11.254 1.00 0.00 O ATOM 0 H GLU A 109 11.312 6.102 -6.089 1.00 0.00 H new ATOM 0 HA GLU A 109 8.708 6.718 -7.090 1.00 0.00 H new ATOM 0 HB2 GLU A 109 10.374 8.223 -7.732 1.00 0.00 H new ATOM 0 HB3 GLU A 109 11.558 6.964 -8.020 1.00 0.00 H new ATOM 0 HG2 GLU A 109 10.355 6.273 -10.062 1.00 0.00 H new ATOM 0 HG3 GLU A 109 9.129 7.489 -9.766 1.00 0.00 H new ATOM 1730 N HIS A 110 10.295 4.095 -8.297 1.00 0.00 N ATOM 1731 CA HIS A 110 10.125 2.880 -9.086 1.00 0.00 C ATOM 1732 C HIS A 110 8.860 2.135 -8.671 1.00 0.00 C ATOM 1733 O HIS A 110 8.007 1.829 -9.505 1.00 0.00 O ATOM 1734 CB HIS A 110 11.342 1.969 -8.928 1.00 0.00 C ATOM 1735 CG HIS A 110 11.461 0.935 -10.005 1.00 0.00 C ATOM 1736 ND1 HIS A 110 11.694 1.249 -11.327 1.00 0.00 N ATOM 1737 CD2 HIS A 110 11.380 -0.415 -9.949 1.00 0.00 C ATOM 1738 CE1 HIS A 110 11.749 0.137 -12.038 1.00 0.00 C ATOM 1739 NE2 HIS A 110 11.562 -0.887 -11.225 1.00 0.00 N ATOM 0 H HIS A 110 11.196 4.168 -7.824 1.00 0.00 H new ATOM 0 HA HIS A 110 10.029 3.167 -10.133 1.00 0.00 H new ATOM 0 HB2 HIS A 110 12.244 2.580 -8.921 1.00 0.00 H new ATOM 0 HB3 HIS A 110 11.288 1.469 -7.961 1.00 0.00 H new ATOM 0 HD2 HIS A 110 11.205 -1.010 -9.065 1.00 0.00 H new ATOM 0 HE1 HIS A 110 11.918 0.076 -13.103 1.00 0.00 H new ATOM 0 HE2 HIS A 110 11.554 -1.869 -11.501 1.00 0.00 H new ATOM 1747 N ILE A 111 8.746 1.846 -7.380 1.00 0.00 N ATOM 1748 CA ILE A 111 7.585 1.137 -6.855 1.00 0.00 C ATOM 1749 C ILE A 111 6.304 1.927 -7.098 1.00 0.00 C ATOM 1750 O ILE A 111 5.255 1.353 -7.393 1.00 0.00 O ATOM 1751 CB ILE A 111 7.728 0.862 -5.347 1.00 0.00 C ATOM 1752 CG1 ILE A 111 8.975 0.017 -5.076 1.00 0.00 C ATOM 1753 CG2 ILE A 111 6.484 0.166 -4.815 1.00 0.00 C ATOM 1754 CD1 ILE A 111 8.891 -1.382 -5.644 1.00 0.00 C ATOM 0 H ILE A 111 9.443 2.092 -6.677 1.00 0.00 H new ATOM 0 HA ILE A 111 7.529 0.186 -7.385 1.00 0.00 H new ATOM 0 HB ILE A 111 7.838 1.814 -4.828 1.00 0.00 H new ATOM 0 HG12 ILE A 111 9.844 0.521 -5.499 1.00 0.00 H new ATOM 0 HG13 ILE A 111 9.135 -0.045 -4.000 1.00 0.00 H new ATOM 0 HG21 ILE A 111 6.600 -0.022 -3.748 1.00 0.00 H new ATOM 0 HG22 ILE A 111 5.614 0.801 -4.979 1.00 0.00 H new ATOM 0 HG23 ILE A 111 6.346 -0.781 -5.337 1.00 0.00 H new ATOM 0 HD11 ILE A 111 9.809 -1.924 -5.414 1.00 0.00 H new ATOM 0 HD12 ILE A 111 8.042 -1.903 -5.203 1.00 0.00 H new ATOM 0 HD13 ILE A 111 8.762 -1.329 -6.725 1.00 0.00 H new ATOM 1766 N TYR A 112 6.396 3.246 -6.972 1.00 0.00 N ATOM 1767 CA TYR A 112 5.243 4.115 -7.177 1.00 0.00 C ATOM 1768 C TYR A 112 4.649 3.913 -8.567 1.00 0.00 C ATOM 1769 O TYR A 112 3.464 3.612 -8.712 1.00 0.00 O ATOM 1770 CB TYR A 112 5.643 5.580 -6.988 1.00 0.00 C ATOM 1771 CG TYR A 112 4.581 6.559 -7.436 1.00 0.00 C ATOM 1772 CD1 TYR A 112 4.355 6.800 -8.786 1.00 0.00 C ATOM 1773 CD2 TYR A 112 3.804 7.243 -6.509 1.00 0.00 C ATOM 1774 CE1 TYR A 112 3.387 7.695 -9.199 1.00 0.00 C ATOM 1775 CE2 TYR A 112 2.833 8.138 -6.914 1.00 0.00 C ATOM 1776 CZ TYR A 112 2.629 8.361 -8.260 1.00 0.00 C ATOM 1777 OH TYR A 112 1.663 9.252 -8.668 1.00 0.00 O ATOM 0 H TYR A 112 7.256 3.737 -6.729 1.00 0.00 H new ATOM 0 HA TYR A 112 4.486 3.853 -6.437 1.00 0.00 H new ATOM 0 HB2 TYR A 112 5.866 5.754 -5.935 1.00 0.00 H new ATOM 0 HB3 TYR A 112 6.561 5.772 -7.544 1.00 0.00 H new ATOM 0 HD1 TYR A 112 4.946 6.279 -9.525 1.00 0.00 H new ATOM 0 HD2 TYR A 112 3.962 7.072 -5.454 1.00 0.00 H new ATOM 0 HE1 TYR A 112 3.225 7.872 -10.252 1.00 0.00 H new ATOM 0 HE2 TYR A 112 2.237 8.660 -6.181 1.00 0.00 H new ATOM 0 HH TYR A 112 1.218 9.635 -7.883 1.00 0.00 H new ATOM 1787 N LYS A 113 5.481 4.080 -9.589 1.00 0.00 N ATOM 1788 CA LYS A 113 5.042 3.915 -10.970 1.00 0.00 C ATOM 1789 C LYS A 113 4.432 2.534 -11.185 1.00 0.00 C ATOM 1790 O LYS A 113 3.757 2.291 -12.187 1.00 0.00 O ATOM 1791 CB LYS A 113 6.216 4.122 -11.929 1.00 0.00 C ATOM 1792 CG LYS A 113 6.995 5.400 -11.670 1.00 0.00 C ATOM 1793 CD LYS A 113 8.255 5.467 -12.518 1.00 0.00 C ATOM 1794 CE LYS A 113 9.279 4.433 -12.075 1.00 0.00 C ATOM 1795 NZ LYS A 113 10.200 4.056 -13.183 1.00 0.00 N ATOM 0 H LYS A 113 6.465 4.330 -9.487 1.00 0.00 H new ATOM 0 HA LYS A 113 4.279 4.666 -11.175 1.00 0.00 H new ATOM 0 HB2 LYS A 113 6.893 3.271 -11.850 1.00 0.00 H new ATOM 0 HB3 LYS A 113 5.840 4.136 -12.952 1.00 0.00 H new ATOM 0 HG2 LYS A 113 6.364 6.262 -11.886 1.00 0.00 H new ATOM 0 HG3 LYS A 113 7.262 5.457 -10.615 1.00 0.00 H new ATOM 0 HD2 LYS A 113 8.000 5.303 -13.565 1.00 0.00 H new ATOM 0 HD3 LYS A 113 8.689 6.464 -12.448 1.00 0.00 H new ATOM 0 HE2 LYS A 113 9.858 4.829 -11.240 1.00 0.00 H new ATOM 0 HE3 LYS A 113 8.764 3.544 -11.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 10.883 3.350 -12.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 9.651 3.655 -13.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 10.711 4.900 -13.512 1.00 0.00 H new ATOM 1809 N LEU A 114 4.673 1.632 -10.240 1.00 0.00 N ATOM 1810 CA LEU A 114 4.147 0.274 -10.326 1.00 0.00 C ATOM 1811 C LEU A 114 2.808 0.163 -9.603 1.00 0.00 C ATOM 1812 O LEU A 114 1.761 0.018 -10.234 1.00 0.00 O ATOM 1813 CB LEU A 114 5.145 -0.720 -9.730 1.00 0.00 C ATOM 1814 CG LEU A 114 4.575 -2.075 -9.311 1.00 0.00 C ATOM 1815 CD1 LEU A 114 4.597 -3.048 -10.480 1.00 0.00 C ATOM 1816 CD2 LEU A 114 5.352 -2.640 -8.131 1.00 0.00 C ATOM 0 H LEU A 114 5.229 1.816 -9.405 1.00 0.00 H new ATOM 0 HA LEU A 114 3.992 0.036 -11.379 1.00 0.00 H new ATOM 0 HB2 LEU A 114 5.936 -0.891 -10.460 1.00 0.00 H new ATOM 0 HB3 LEU A 114 5.610 -0.259 -8.859 1.00 0.00 H new ATOM 0 HG LEU A 114 3.539 -1.931 -9.003 1.00 0.00 H new ATOM 0 HD11 LEU A 114 4.188 -4.007 -10.163 1.00 0.00 H new ATOM 0 HD12 LEU A 114 3.996 -2.649 -11.297 1.00 0.00 H new ATOM 0 HD13 LEU A 114 5.624 -3.186 -10.819 1.00 0.00 H new ATOM 0 HD21 LEU A 114 4.932 -3.605 -7.847 1.00 0.00 H new ATOM 0 HD22 LEU A 114 6.397 -2.768 -8.412 1.00 0.00 H new ATOM 0 HD23 LEU A 114 5.284 -1.952 -7.288 1.00 0.00 H new ATOM 1828 N MET A 115 2.850 0.232 -8.277 1.00 0.00 N ATOM 1829 CA MET A 115 1.640 0.143 -7.468 1.00 0.00 C ATOM 1830 C MET A 115 0.512 0.963 -8.086 1.00 0.00 C ATOM 1831 O MET A 115 -0.654 0.570 -8.037 1.00 0.00 O ATOM 1832 CB MET A 115 1.916 0.625 -6.043 1.00 0.00 C ATOM 1833 CG MET A 115 2.924 -0.232 -5.295 1.00 0.00 C ATOM 1834 SD MET A 115 3.330 0.431 -3.669 1.00 0.00 S ATOM 1835 CE MET A 115 3.754 2.120 -4.089 1.00 0.00 C ATOM 0 H MET A 115 3.709 0.349 -7.740 1.00 0.00 H new ATOM 0 HA MET A 115 1.331 -0.902 -7.436 1.00 0.00 H new ATOM 0 HB2 MET A 115 2.281 1.651 -6.080 1.00 0.00 H new ATOM 0 HB3 MET A 115 0.979 0.640 -5.486 1.00 0.00 H new ATOM 0 HG2 MET A 115 2.525 -1.240 -5.182 1.00 0.00 H new ATOM 0 HG3 MET A 115 3.835 -0.314 -5.887 1.00 0.00 H new ATOM 0 HE1 MET A 115 4.667 2.407 -3.567 1.00 0.00 H new ATOM 0 HE2 MET A 115 3.911 2.199 -5.165 1.00 0.00 H new ATOM 0 HE3 MET A 115 2.942 2.784 -3.791 1.00 0.00 H new ATOM 1845 N LYS A 116 0.865 2.105 -8.666 1.00 0.00 N ATOM 1846 CA LYS A 116 -0.116 2.981 -9.294 1.00 0.00 C ATOM 1847 C LYS A 116 -0.981 2.207 -10.285 1.00 0.00 C ATOM 1848 O LYS A 116 -2.208 2.303 -10.260 1.00 0.00 O ATOM 1849 CB LYS A 116 0.585 4.138 -10.009 1.00 0.00 C ATOM 1850 CG LYS A 116 1.361 3.710 -11.242 1.00 0.00 C ATOM 1851 CD LYS A 116 1.958 4.905 -11.967 1.00 0.00 C ATOM 1852 CE LYS A 116 0.961 5.525 -12.934 1.00 0.00 C ATOM 1853 NZ LYS A 116 0.838 4.733 -14.189 1.00 0.00 N ATOM 0 H LYS A 116 1.825 2.446 -8.714 1.00 0.00 H new ATOM 0 HA LYS A 116 -0.760 3.383 -8.512 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -0.159 4.880 -10.298 1.00 0.00 H new ATOM 0 HB3 LYS A 116 1.267 4.625 -9.312 1.00 0.00 H new ATOM 0 HG2 LYS A 116 2.157 3.024 -10.952 1.00 0.00 H new ATOM 0 HG3 LYS A 116 0.701 3.166 -11.918 1.00 0.00 H new ATOM 0 HD2 LYS A 116 2.274 5.653 -11.239 1.00 0.00 H new ATOM 0 HD3 LYS A 116 2.849 4.593 -12.512 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -0.015 5.597 -12.453 1.00 0.00 H new ATOM 0 HE3 LYS A 116 1.273 6.541 -13.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 0.801 5.378 -15.004 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 1.660 4.102 -14.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -0.033 4.165 -14.157 1.00 0.00 H new ATOM 1867 N SER A 117 -0.333 1.439 -11.155 1.00 0.00 N ATOM 1868 CA SER A 117 -1.042 0.651 -12.155 1.00 0.00 C ATOM 1869 C SER A 117 -0.788 -0.840 -11.952 1.00 0.00 C ATOM 1870 O SER A 117 -1.045 -1.652 -12.842 1.00 0.00 O ATOM 1871 CB SER A 117 -0.611 1.066 -13.563 1.00 0.00 C ATOM 1872 OG SER A 117 -1.664 0.885 -14.494 1.00 0.00 O ATOM 0 H SER A 117 0.682 1.346 -11.187 1.00 0.00 H new ATOM 0 HA SER A 117 -2.109 0.839 -12.040 1.00 0.00 H new ATOM 0 HB2 SER A 117 -0.301 2.111 -13.558 1.00 0.00 H new ATOM 0 HB3 SER A 117 0.254 0.478 -13.870 1.00 0.00 H new ATOM 0 HG SER A 117 -1.363 1.159 -15.386 1.00 0.00 H new ATOM 1878 N ASP A 118 -0.282 -1.193 -10.776 1.00 0.00 N ATOM 1879 CA ASP A 118 0.006 -2.585 -10.454 1.00 0.00 C ATOM 1880 C ASP A 118 -1.078 -3.171 -9.555 1.00 0.00 C ATOM 1881 O ASP A 118 -1.771 -4.115 -9.935 1.00 0.00 O ATOM 1882 CB ASP A 118 1.370 -2.701 -9.771 1.00 0.00 C ATOM 1883 CG ASP A 118 1.856 -4.135 -9.688 1.00 0.00 C ATOM 1884 OD1 ASP A 118 2.438 -4.622 -10.680 1.00 0.00 O ATOM 1885 OD2 ASP A 118 1.653 -4.770 -8.632 1.00 0.00 O ATOM 0 H ASP A 118 -0.063 -0.534 -10.029 1.00 0.00 H new ATOM 0 HA ASP A 118 0.025 -3.151 -11.385 1.00 0.00 H new ATOM 0 HB2 ASP A 118 2.099 -2.104 -10.319 1.00 0.00 H new ATOM 0 HB3 ASP A 118 1.307 -2.283 -8.766 1.00 0.00 H new ATOM 1890 N SER A 119 -1.219 -2.605 -8.360 1.00 0.00 N ATOM 1891 CA SER A 119 -2.216 -3.075 -7.405 1.00 0.00 C ATOM 1892 C SER A 119 -3.496 -2.252 -7.508 1.00 0.00 C ATOM 1893 O SER A 119 -4.589 -2.799 -7.656 1.00 0.00 O ATOM 1894 CB SER A 119 -1.662 -3.002 -5.981 1.00 0.00 C ATOM 1895 OG SER A 119 -2.233 -4.005 -5.160 1.00 0.00 O ATOM 0 H SER A 119 -0.656 -1.821 -8.031 1.00 0.00 H new ATOM 0 HA SER A 119 -2.452 -4.112 -7.643 1.00 0.00 H new ATOM 0 HB2 SER A 119 -0.578 -3.119 -6.003 1.00 0.00 H new ATOM 0 HB3 SER A 119 -1.869 -2.019 -5.557 1.00 0.00 H new ATOM 0 HG SER A 119 -1.678 -4.812 -5.196 1.00 0.00 H new ATOM 1901 N TYR A 120 -3.353 -0.934 -7.427 1.00 0.00 N ATOM 1902 CA TYR A 120 -4.497 -0.034 -7.508 1.00 0.00 C ATOM 1903 C TYR A 120 -5.547 -0.574 -8.473 1.00 0.00 C ATOM 1904 O TYR A 120 -6.736 -0.648 -8.160 1.00 0.00 O ATOM 1905 CB TYR A 120 -4.047 1.359 -7.953 1.00 0.00 C ATOM 1906 CG TYR A 120 -5.128 2.148 -8.656 1.00 0.00 C ATOM 1907 CD1 TYR A 120 -5.422 1.920 -9.995 1.00 0.00 C ATOM 1908 CD2 TYR A 120 -5.853 3.123 -7.982 1.00 0.00 C ATOM 1909 CE1 TYR A 120 -6.408 2.640 -10.642 1.00 0.00 C ATOM 1910 CE2 TYR A 120 -6.842 3.846 -8.621 1.00 0.00 C ATOM 1911 CZ TYR A 120 -7.116 3.601 -9.950 1.00 0.00 C ATOM 1912 OH TYR A 120 -8.099 4.320 -10.590 1.00 0.00 O ATOM 0 H TYR A 120 -2.455 -0.465 -7.305 1.00 0.00 H new ATOM 0 HA TYR A 120 -4.943 0.036 -6.516 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -3.709 1.919 -7.081 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -3.190 1.259 -8.619 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -4.871 1.167 -10.539 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -5.640 3.319 -6.942 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -6.623 2.452 -11.683 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -7.398 4.599 -8.082 1.00 0.00 H new ATOM 0 HH TYR A 120 -8.501 4.955 -9.962 1.00 0.00 H new ATOM 1922 N PRO A 121 -5.100 -0.962 -9.676 1.00 0.00 N ATOM 1923 CA PRO A 121 -5.984 -1.503 -10.713 1.00 0.00 C ATOM 1924 C PRO A 121 -6.915 -2.584 -10.174 1.00 0.00 C ATOM 1925 O PRO A 121 -8.136 -2.431 -10.195 1.00 0.00 O ATOM 1926 CB PRO A 121 -5.010 -2.097 -11.734 1.00 0.00 C ATOM 1927 CG PRO A 121 -3.752 -1.319 -11.555 1.00 0.00 C ATOM 1928 CD PRO A 121 -3.696 -0.902 -10.118 1.00 0.00 C ATOM 0 HA PRO A 121 -6.643 -0.740 -11.126 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -4.847 -3.160 -11.554 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -5.394 -2.001 -12.750 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -2.884 -1.925 -11.815 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -3.741 -0.448 -12.210 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -3.064 -1.570 -9.533 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -3.286 0.102 -10.009 1.00 0.00 H new ATOM 1936 N ARG A 122 -6.330 -3.676 -9.693 1.00 0.00 N ATOM 1937 CA ARG A 122 -7.108 -4.783 -9.149 1.00 0.00 C ATOM 1938 C ARG A 122 -8.000 -4.310 -8.005 1.00 0.00 C ATOM 1939 O ARG A 122 -9.193 -4.611 -7.968 1.00 0.00 O ATOM 1940 CB ARG A 122 -6.179 -5.895 -8.660 1.00 0.00 C ATOM 1941 CG ARG A 122 -5.358 -6.534 -9.768 1.00 0.00 C ATOM 1942 CD ARG A 122 -4.429 -7.608 -9.224 1.00 0.00 C ATOM 1943 NE ARG A 122 -5.163 -8.777 -8.747 1.00 0.00 N ATOM 1944 CZ ARG A 122 -4.639 -9.996 -8.676 1.00 0.00 C ATOM 1945 NH1 ARG A 122 -3.383 -10.203 -9.049 1.00 0.00 N ATOM 1946 NH2 ARG A 122 -5.371 -11.009 -8.231 1.00 0.00 N ATOM 0 H ARG A 122 -5.320 -3.818 -9.669 1.00 0.00 H new ATOM 0 HA ARG A 122 -7.743 -5.173 -9.944 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -5.504 -5.488 -7.908 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -6.775 -6.665 -8.170 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -6.025 -6.971 -10.511 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -4.772 -5.768 -10.276 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -3.731 -7.912 -10.004 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -3.836 -7.195 -8.408 1.00 0.00 H new ATOM 0 HE ARG A 122 -6.131 -8.651 -8.452 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -2.818 -9.426 -9.391 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -2.982 -11.139 -8.994 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -6.337 -10.852 -7.943 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -4.968 -11.944 -8.177 1.00 0.00 H new ATOM 1960 N PHE A 123 -7.413 -3.568 -7.072 1.00 0.00 N ATOM 1961 CA PHE A 123 -8.153 -3.054 -5.925 1.00 0.00 C ATOM 1962 C PHE A 123 -9.536 -2.565 -6.345 1.00 0.00 C ATOM 1963 O PHE A 123 -10.530 -2.825 -5.668 1.00 0.00 O ATOM 1964 CB PHE A 123 -7.378 -1.916 -5.259 1.00 0.00 C ATOM 1965 CG PHE A 123 -8.125 -1.260 -4.133 1.00 0.00 C ATOM 1966 CD1 PHE A 123 -8.604 -2.011 -3.071 1.00 0.00 C ATOM 1967 CD2 PHE A 123 -8.351 0.107 -4.137 1.00 0.00 C ATOM 1968 CE1 PHE A 123 -9.292 -1.410 -2.034 1.00 0.00 C ATOM 1969 CE2 PHE A 123 -9.037 0.713 -3.102 1.00 0.00 C ATOM 1970 CZ PHE A 123 -9.510 -0.047 -2.050 1.00 0.00 C ATOM 0 H PHE A 123 -6.427 -3.309 -7.088 1.00 0.00 H new ATOM 0 HA PHE A 123 -8.276 -3.867 -5.210 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -6.433 -2.304 -4.880 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -7.135 -1.164 -6.010 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -8.438 -3.078 -3.054 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -7.987 0.706 -4.959 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -9.659 -2.006 -1.212 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -9.203 1.780 -3.115 1.00 0.00 H new ATOM 0 HZ PHE A 123 -10.049 0.424 -1.242 1.00 0.00 H new ATOM 1980 N ILE A 124 -9.590 -1.855 -7.467 1.00 0.00 N ATOM 1981 CA ILE A 124 -10.850 -1.330 -7.979 1.00 0.00 C ATOM 1982 C ILE A 124 -11.780 -2.458 -8.413 1.00 0.00 C ATOM 1983 O ILE A 124 -12.983 -2.417 -8.156 1.00 0.00 O ATOM 1984 CB ILE A 124 -10.622 -0.380 -9.169 1.00 0.00 C ATOM 1985 CG1 ILE A 124 -9.656 0.740 -8.779 1.00 0.00 C ATOM 1986 CG2 ILE A 124 -11.946 0.197 -9.647 1.00 0.00 C ATOM 1987 CD1 ILE A 124 -10.122 1.554 -7.593 1.00 0.00 C ATOM 0 H ILE A 124 -8.776 -1.630 -8.039 1.00 0.00 H new ATOM 0 HA ILE A 124 -11.314 -0.773 -7.165 1.00 0.00 H new ATOM 0 HB ILE A 124 -10.178 -0.947 -9.987 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -8.682 0.306 -8.552 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -9.518 1.403 -9.633 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -11.768 0.867 -10.489 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -12.604 -0.613 -9.961 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -12.416 0.752 -8.835 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -9.388 2.329 -7.373 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -11.081 2.017 -7.824 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -10.233 0.903 -6.726 1.00 0.00 H new ATOM 1999 N ARG A 125 -11.213 -3.465 -9.070 1.00 0.00 N ATOM 2000 CA ARG A 125 -11.992 -4.605 -9.539 1.00 0.00 C ATOM 2001 C ARG A 125 -12.732 -5.271 -8.383 1.00 0.00 C ATOM 2002 O ARG A 125 -13.922 -5.567 -8.483 1.00 0.00 O ATOM 2003 CB ARG A 125 -11.081 -5.622 -10.229 1.00 0.00 C ATOM 2004 CG ARG A 125 -10.218 -5.021 -11.326 1.00 0.00 C ATOM 2005 CD ARG A 125 -11.024 -4.765 -12.591 1.00 0.00 C ATOM 2006 NE ARG A 125 -11.319 -6.000 -13.311 1.00 0.00 N ATOM 2007 CZ ARG A 125 -11.206 -6.127 -14.629 1.00 0.00 C ATOM 2008 NH1 ARG A 125 -10.805 -5.100 -15.365 1.00 0.00 N ATOM 2009 NH2 ARG A 125 -11.492 -7.284 -15.212 1.00 0.00 N ATOM 0 H ARG A 125 -10.218 -3.515 -9.289 1.00 0.00 H new ATOM 0 HA ARG A 125 -12.728 -4.240 -10.256 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -10.435 -6.084 -9.482 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -11.694 -6.416 -10.655 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -9.781 -4.086 -10.976 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -9.391 -5.695 -11.550 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -11.957 -4.265 -12.331 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -10.471 -4.089 -13.243 1.00 0.00 H new ATOM 0 HE ARG A 125 -11.629 -6.810 -12.773 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -10.582 -4.210 -14.920 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -10.719 -5.200 -16.376 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -11.799 -8.077 -14.649 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -11.405 -7.381 -16.224 1.00 0.00 H new ATOM 2023 N SER A 126 -12.018 -5.504 -7.286 1.00 0.00 N ATOM 2024 CA SER A 126 -12.606 -6.139 -6.112 1.00 0.00 C ATOM 2025 C SER A 126 -13.678 -5.248 -5.492 1.00 0.00 C ATOM 2026 O SER A 126 -13.632 -4.024 -5.616 1.00 0.00 O ATOM 2027 CB SER A 126 -11.522 -6.448 -5.077 1.00 0.00 C ATOM 2028 OG SER A 126 -12.048 -7.200 -3.997 1.00 0.00 O ATOM 0 H SER A 126 -11.032 -5.263 -7.186 1.00 0.00 H new ATOM 0 HA SER A 126 -13.072 -7.072 -6.429 1.00 0.00 H new ATOM 0 HB2 SER A 126 -10.711 -7.002 -5.549 1.00 0.00 H new ATOM 0 HB3 SER A 126 -11.096 -5.517 -4.703 1.00 0.00 H new ATOM 0 HG SER A 126 -11.336 -7.386 -3.350 1.00 0.00 H new ATOM 2034 N SER A 127 -14.643 -5.871 -4.824 1.00 0.00 N ATOM 2035 CA SER A 127 -15.730 -5.137 -4.187 1.00 0.00 C ATOM 2036 C SER A 127 -15.236 -4.410 -2.940 1.00 0.00 C ATOM 2037 O SER A 127 -15.733 -3.338 -2.595 1.00 0.00 O ATOM 2038 CB SER A 127 -16.870 -6.088 -3.819 1.00 0.00 C ATOM 2039 OG SER A 127 -17.690 -6.361 -4.943 1.00 0.00 O ATOM 0 H SER A 127 -14.694 -6.883 -4.710 1.00 0.00 H new ATOM 0 HA SER A 127 -16.100 -4.396 -4.896 1.00 0.00 H new ATOM 0 HB2 SER A 127 -16.459 -7.020 -3.430 1.00 0.00 H new ATOM 0 HB3 SER A 127 -17.472 -5.648 -3.024 1.00 0.00 H new ATOM 0 HG SER A 127 -18.410 -6.972 -4.682 1.00 0.00 H new ATOM 2045 N ALA A 128 -14.255 -5.002 -2.267 1.00 0.00 N ATOM 2046 CA ALA A 128 -13.692 -4.411 -1.059 1.00 0.00 C ATOM 2047 C ALA A 128 -13.634 -2.891 -1.167 1.00 0.00 C ATOM 2048 O ALA A 128 -13.880 -2.180 -0.193 1.00 0.00 O ATOM 2049 CB ALA A 128 -12.305 -4.976 -0.792 1.00 0.00 C ATOM 0 H ALA A 128 -13.834 -5.891 -2.538 1.00 0.00 H new ATOM 0 HA ALA A 128 -14.343 -4.665 -0.223 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -11.897 -4.526 0.113 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -12.371 -6.056 -0.662 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -11.652 -4.751 -1.635 1.00 0.00 H new ATOM 2055 N TYR A 129 -13.308 -2.399 -2.357 1.00 0.00 N ATOM 2056 CA TYR A 129 -13.214 -0.963 -2.591 1.00 0.00 C ATOM 2057 C TYR A 129 -14.601 -0.333 -2.673 1.00 0.00 C ATOM 2058 O TYR A 129 -14.857 0.710 -2.073 1.00 0.00 O ATOM 2059 CB TYR A 129 -12.438 -0.685 -3.880 1.00 0.00 C ATOM 2060 CG TYR A 129 -12.799 0.631 -4.532 1.00 0.00 C ATOM 2061 CD1 TYR A 129 -13.917 0.739 -5.351 1.00 0.00 C ATOM 2062 CD2 TYR A 129 -12.022 1.765 -4.330 1.00 0.00 C ATOM 2063 CE1 TYR A 129 -14.250 1.939 -5.949 1.00 0.00 C ATOM 2064 CE2 TYR A 129 -12.349 2.969 -4.923 1.00 0.00 C ATOM 2065 CZ TYR A 129 -13.463 3.051 -5.732 1.00 0.00 C ATOM 2066 OH TYR A 129 -13.791 4.248 -6.326 1.00 0.00 O ATOM 0 H TYR A 129 -13.104 -2.974 -3.175 1.00 0.00 H new ATOM 0 HA TYR A 129 -12.681 -0.517 -1.751 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -11.370 -0.691 -3.660 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -12.622 -1.494 -4.587 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -14.535 -0.130 -5.523 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -11.148 1.704 -3.699 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -15.122 2.006 -6.583 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -11.735 3.842 -4.754 1.00 0.00 H new ATOM 0 HH TYR A 129 -13.282 4.972 -5.905 1.00 0.00 H new ATOM 2076 N GLN A 130 -15.493 -0.976 -3.421 1.00 0.00 N ATOM 2077 CA GLN A 130 -16.854 -0.479 -3.582 1.00 0.00 C ATOM 2078 C GLN A 130 -17.564 -0.391 -2.235 1.00 0.00 C ATOM 2079 O GLN A 130 -18.300 0.559 -1.973 1.00 0.00 O ATOM 2080 CB GLN A 130 -17.642 -1.387 -4.529 1.00 0.00 C ATOM 2081 CG GLN A 130 -16.988 -1.558 -5.891 1.00 0.00 C ATOM 2082 CD GLN A 130 -17.233 -0.376 -6.808 1.00 0.00 C ATOM 2083 OE1 GLN A 130 -18.093 0.463 -6.542 1.00 0.00 O ATOM 2084 NE2 GLN A 130 -16.475 -0.304 -7.896 1.00 0.00 N ATOM 0 H GLN A 130 -15.297 -1.841 -3.924 1.00 0.00 H new ATOM 0 HA GLN A 130 -16.801 0.522 -4.010 1.00 0.00 H new ATOM 0 HB2 GLN A 130 -17.760 -2.367 -4.066 1.00 0.00 H new ATOM 0 HB3 GLN A 130 -18.643 -0.976 -4.664 1.00 0.00 H new ATOM 0 HG2 GLN A 130 -15.915 -1.695 -5.760 1.00 0.00 H new ATOM 0 HG3 GLN A 130 -17.370 -2.464 -6.362 1.00 0.00 H new ATOM 0 HE21 GLN A 130 -15.774 -1.022 -8.077 1.00 0.00 H new ATOM 0 HE22 GLN A 130 -16.594 0.469 -8.550 1.00 0.00 H new ATOM 2093 N GLU A 131 -17.338 -1.389 -1.386 1.00 0.00 N ATOM 2094 CA GLU A 131 -17.959 -1.423 -0.067 1.00 0.00 C ATOM 2095 C GLU A 131 -18.032 -0.023 0.536 1.00 0.00 C ATOM 2096 O GLU A 131 -19.117 0.487 0.818 1.00 0.00 O ATOM 2097 CB GLU A 131 -17.176 -2.351 0.865 1.00 0.00 C ATOM 2098 CG GLU A 131 -17.078 -3.780 0.359 1.00 0.00 C ATOM 2099 CD GLU A 131 -18.382 -4.541 0.504 1.00 0.00 C ATOM 2100 OE1 GLU A 131 -18.678 -5.003 1.626 1.00 0.00 O ATOM 2101 OE2 GLU A 131 -19.106 -4.675 -0.505 1.00 0.00 O ATOM 0 H GLU A 131 -16.731 -2.183 -1.588 1.00 0.00 H new ATOM 0 HA GLU A 131 -18.974 -1.804 -0.181 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -16.170 -1.953 1.000 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -17.652 -2.353 1.846 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -16.782 -3.771 -0.690 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -16.294 -4.303 0.907 1.00 0.00 H new ATOM 2108 N LEU A 132 -16.871 0.592 0.732 1.00 0.00 N ATOM 2109 CA LEU A 132 -16.803 1.933 1.302 1.00 0.00 C ATOM 2110 C LEU A 132 -17.796 2.867 0.618 1.00 0.00 C ATOM 2111 O LEU A 132 -18.711 3.391 1.254 1.00 0.00 O ATOM 2112 CB LEU A 132 -15.385 2.492 1.171 1.00 0.00 C ATOM 2113 CG LEU A 132 -14.284 1.702 1.878 1.00 0.00 C ATOM 2114 CD1 LEU A 132 -14.812 1.081 3.162 1.00 0.00 C ATOM 2115 CD2 LEU A 132 -13.723 0.628 0.957 1.00 0.00 C ATOM 0 H LEU A 132 -15.964 0.184 0.505 1.00 0.00 H new ATOM 0 HA LEU A 132 -17.065 1.866 2.358 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -15.137 2.554 0.111 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -15.380 3.510 1.559 1.00 0.00 H new ATOM 0 HG LEU A 132 -13.479 2.390 2.135 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -14.014 0.523 3.651 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -15.165 1.868 3.828 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -15.636 0.407 2.928 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -12.940 0.075 1.477 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -14.520 -0.057 0.669 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -13.306 1.095 0.065 1.00 0.00 H new ATOM 2127 N LEU A 133 -17.610 3.070 -0.682 1.00 0.00 N ATOM 2128 CA LEU A 133 -18.491 3.939 -1.454 1.00 0.00 C ATOM 2129 C LEU A 133 -19.926 3.852 -0.944 1.00 0.00 C ATOM 2130 O LEU A 133 -20.484 4.836 -0.461 1.00 0.00 O ATOM 2131 CB LEU A 133 -18.440 3.563 -2.936 1.00 0.00 C ATOM 2132 CG LEU A 133 -17.315 4.200 -3.752 1.00 0.00 C ATOM 2133 CD1 LEU A 133 -17.065 3.407 -5.026 1.00 0.00 C ATOM 2134 CD2 LEU A 133 -17.648 5.648 -4.079 1.00 0.00 C ATOM 0 H LEU A 133 -16.857 2.645 -1.223 1.00 0.00 H new ATOM 0 HA LEU A 133 -18.144 4.965 -1.334 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -18.348 2.480 -3.012 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -19.392 3.835 -3.392 1.00 0.00 H new ATOM 0 HG LEU A 133 -16.404 4.184 -3.154 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -16.261 3.875 -5.594 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -16.781 2.386 -4.769 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -17.973 3.391 -5.629 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -16.836 6.086 -4.660 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -18.571 5.687 -4.658 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -17.776 6.210 -3.154 1.00 0.00 H new