USER MOD reduce.3.24.130724 H: found=0, std=0, add=960, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 963 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 99 THR OG1 : rot -160:sc= 0.313 USER MOD Set 1.2: A 114 LYS NZ :NH3+ -176:sc= 0.0395 (180deg=-0.391) USER MOD Set 2.1: A 108 SER OG : rot 138:sc= 0.557 USER MOD Set 2.2: A 142 LYS NZ :NH3+ -151:sc= 0.661 (180deg=0) USER MOD Set 3.1: A 35 MET CE :methyl -144:sc= -2.4 (180deg=-2.42!) USER MOD Set 3.2: A 86 ASN : amide:sc= -0.492 K(o=-2.9,f=-10!) USER MOD Set 4.1: A 77 MET CE :methyl 147:sc= -0.579 (180deg=-1.47) USER MOD Set 4.2: A 111 MET CE :methyl -162:sc= -2.6! (180deg=-2.79) USER MOD Set 5.1: A 51 GLN : amide:sc= 0.219 K(o=1.5,f=-3.4!) USER MOD Set 5.2: A 66 SER OG : rot -169:sc= 1.24 USER MOD Set 6.1: A 46 THR OG1 : rot 132:sc= 0.642 USER MOD Set 6.2: A 72 HIS : no HE2:sc= -0.472 K(o=0.17,f=-9.3!) USER MOD Set 7.1: A 33 ASN : amide:sc= -0.757 K(o=-1.1,f=1.3) USER MOD Set 7.2: A 39 THR OG1 : rot 80:sc= -0.299 USER MOD Set 8.1: A 23 TYR OH : rot 64:sc= 1.27 USER MOD Set 8.2: A 25 SER OG : rot 112:sc= 0.773 USER MOD Set 9.1: A 18 HIS : no HE2:sc= -0.74 K(o=0.61,f=-9.1!) USER MOD Set 9.2: A 81 SER OG : rot -26:sc= 1.35 USER MOD Single : A 19 ASN : amide:sc= -0.182 K(o=-0.18,f=-1.5) USER MOD Single : A 27 GLN : amide:sc= 0.759 K(o=0.76,f=0) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 60 TYR OH : rot -162:sc= 1.24 USER MOD Single : A 62 CYS SG : rot 180:sc= -2.23! USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 THR OG1 : rot 102:sc= 1.14 USER MOD Single : A 93 ASN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 95 TYR OH : rot 130:sc=-0.00345 USER MOD Single : A 107 ASN : amide:sc= -1.49 K(o=-1.5,f=-0.92) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 THR OG1 : rot -170:sc= -0.0935 USER MOD Single : A 116 TYR OH : rot 0:sc= 0.336 USER MOD Single : A 117 MET CE :methyl -167:sc= -1.34 (180deg=-2.24) USER MOD Single : A 120 ASN : amide:sc= 0.796 K(o=0.8,f=-0.61) USER MOD Single : A 121 LYS NZ :NH3+ 156:sc= 1.25 (180deg=1.07) USER MOD Single : A 126 MET CE :methyl -179:sc= -1.35 (180deg=-1.35) USER MOD Single : A 140 LYS NZ :NH3+ 131:sc= -0.0633 (180deg=-1.69) USER MOD Single : A 141 LYS NZ :NH3+ -140:sc= 1.11 (180deg=-0.123) USER MOD Single : A 146 THR OG1 : rot 77:sc= 0.722 USER MOD Single : A 148 LYS NZ :NH3+ -164:sc= 1.22 (180deg=0.825) USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 153 CYS SG : rot 57:sc= 1.18 USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 93 N LEU A 17 -23.875 -11.769 -11.942 1.00 54.43 N ATOM 94 CA LEU A 17 -23.489 -11.043 -10.801 1.00 11.31 C ATOM 95 C LEU A 17 -22.503 -10.026 -11.226 1.00 32.11 C ATOM 96 O LEU A 17 -21.843 -10.182 -12.248 1.00 4.11 O ATOM 97 CB LEU A 17 -22.881 -11.922 -9.726 1.00 41.44 C ATOM 98 CG LEU A 17 -23.755 -13.020 -9.132 1.00 60.10 C ATOM 99 CD1 LEU A 17 -25.081 -12.472 -8.635 1.00 43.54 C ATOM 100 CD2 LEU A 17 -23.930 -14.171 -10.086 1.00 34.34 C ATOM 0 HA LEU A 17 -24.377 -10.586 -10.365 1.00 11.31 H new ATOM 0 HB2 LEU A 17 -21.989 -12.391 -10.141 1.00 41.44 H new ATOM 0 HB3 LEU A 17 -22.552 -11.277 -8.911 1.00 41.44 H new ATOM 0 HG LEU A 17 -23.234 -13.416 -8.260 1.00 60.10 H new ATOM 0 HD11 LEU A 17 -25.677 -13.284 -8.218 1.00 43.54 H new ATOM 0 HD12 LEU A 17 -24.899 -11.723 -7.864 1.00 43.54 H new ATOM 0 HD13 LEU A 17 -25.620 -12.015 -9.465 1.00 43.54 H new ATOM 0 HD21 LEU A 17 -24.559 -14.933 -9.626 1.00 34.34 H new ATOM 0 HD22 LEU A 17 -24.402 -13.816 -11.002 1.00 34.34 H new ATOM 0 HD23 LEU A 17 -22.956 -14.599 -10.322 1.00 34.34 H new ATOM 112 N HIS A 18 -22.385 -9.011 -10.486 1.00 44.43 N ATOM 113 CA HIS A 18 -21.566 -7.919 -10.895 1.00 44.41 C ATOM 114 C HIS A 18 -20.392 -7.852 -9.978 1.00 71.22 C ATOM 115 O HIS A 18 -20.424 -8.429 -8.872 1.00 60.03 O ATOM 116 CB HIS A 18 -22.361 -6.611 -10.786 1.00 32.22 C ATOM 117 CG HIS A 18 -23.695 -6.629 -11.492 1.00 20.33 C ATOM 118 ND1 HIS A 18 -23.921 -6.055 -12.717 1.00 31.33 N ATOM 119 CD2 HIS A 18 -24.893 -7.136 -11.098 1.00 32.32 C ATOM 120 CE1 HIS A 18 -25.194 -6.202 -13.038 1.00 0.10 C ATOM 121 NE2 HIS A 18 -25.797 -6.852 -12.078 1.00 73.04 N ATOM 0 H HIS A 18 -22.842 -8.895 -9.582 1.00 44.43 H new ATOM 0 HA HIS A 18 -21.242 -8.058 -11.926 1.00 44.41 H new ATOM 0 HB2 HIS A 18 -22.525 -6.387 -9.732 1.00 32.22 H new ATOM 0 HB3 HIS A 18 -21.759 -5.799 -11.194 1.00 32.22 H new ATOM 0 HD1 HIS A 18 -23.217 -5.588 -13.290 1.00 31.33 H new ATOM 0 HD2 HIS A 18 -25.092 -7.666 -10.178 1.00 32.32 H new ATOM 0 HE1 HIS A 18 -25.660 -5.844 -13.944 1.00 0.10 H new ATOM 130 N ASN A 19 -19.357 -7.216 -10.424 1.00 70.21 N ATOM 131 CA ASN A 19 -18.192 -7.048 -9.617 1.00 42.15 C ATOM 132 C ASN A 19 -18.016 -5.555 -9.391 1.00 73.33 C ATOM 133 O ASN A 19 -18.001 -4.779 -10.346 1.00 2.34 O ATOM 134 CB ASN A 19 -16.930 -7.640 -10.290 1.00 11.32 C ATOM 135 CG ASN A 19 -17.036 -9.105 -10.720 1.00 11.10 C ATOM 136 OD1 ASN A 19 -17.802 -9.891 -10.168 1.00 23.31 O ATOM 137 ND2 ASN A 19 -16.220 -9.487 -11.683 1.00 53.44 N ATOM 0 H ASN A 19 -19.295 -6.800 -11.353 1.00 70.21 H new ATOM 0 HA ASN A 19 -18.319 -7.581 -8.675 1.00 42.15 H new ATOM 0 HB2 ASN A 19 -16.692 -7.039 -11.167 1.00 11.32 H new ATOM 0 HB3 ASN A 19 -16.092 -7.542 -9.600 1.00 11.32 H new ATOM 0 HD21 ASN A 19 -16.213 -10.460 -11.990 1.00 53.44 H new ATOM 0 HD22 ASN A 19 -15.596 -8.810 -12.121 1.00 53.44 H new ATOM 144 N VAL A 20 -17.921 -5.150 -8.157 1.00 55.43 N ATOM 145 CA VAL A 20 -17.825 -3.734 -7.823 1.00 42.23 C ATOM 146 C VAL A 20 -16.523 -3.449 -7.097 1.00 14.24 C ATOM 147 O VAL A 20 -16.107 -4.221 -6.236 1.00 70.12 O ATOM 148 CB VAL A 20 -19.030 -3.279 -6.936 1.00 14.25 C ATOM 149 CG1 VAL A 20 -18.941 -1.796 -6.580 1.00 3.55 C ATOM 150 CG2 VAL A 20 -20.348 -3.566 -7.637 1.00 3.33 C ATOM 0 H VAL A 20 -17.907 -5.775 -7.351 1.00 55.43 H new ATOM 0 HA VAL A 20 -17.850 -3.171 -8.756 1.00 42.23 H new ATOM 0 HB VAL A 20 -18.985 -3.851 -6.009 1.00 14.25 H new ATOM 0 HG11 VAL A 20 -19.796 -1.518 -5.963 1.00 3.55 H new ATOM 0 HG12 VAL A 20 -18.020 -1.609 -6.029 1.00 3.55 H new ATOM 0 HG13 VAL A 20 -18.944 -1.202 -7.494 1.00 3.55 H new ATOM 0 HG21 VAL A 20 -21.175 -3.243 -7.004 1.00 3.33 H new ATOM 0 HG22 VAL A 20 -20.382 -3.026 -8.583 1.00 3.33 H new ATOM 0 HG23 VAL A 20 -20.434 -4.636 -7.827 1.00 3.33 H new ATOM 160 N PHE A 21 -15.884 -2.364 -7.450 1.00 43.53 N ATOM 161 CA PHE A 21 -14.662 -1.962 -6.811 1.00 24.45 C ATOM 162 C PHE A 21 -14.998 -0.976 -5.712 1.00 35.02 C ATOM 163 O PHE A 21 -15.611 0.064 -5.959 1.00 22.42 O ATOM 164 CB PHE A 21 -13.725 -1.326 -7.857 1.00 61.03 C ATOM 165 CG PHE A 21 -12.383 -0.846 -7.352 1.00 12.43 C ATOM 166 CD1 PHE A 21 -11.428 -1.751 -6.900 1.00 11.14 C ATOM 167 CD2 PHE A 21 -12.058 0.513 -7.362 1.00 13.44 C ATOM 168 CE1 PHE A 21 -10.194 -1.319 -6.469 1.00 1.30 C ATOM 169 CE2 PHE A 21 -10.823 0.944 -6.925 1.00 34.12 C ATOM 170 CZ PHE A 21 -9.890 0.027 -6.481 1.00 42.41 C ATOM 0 H PHE A 21 -16.198 -1.735 -8.189 1.00 43.53 H new ATOM 0 HA PHE A 21 -14.152 -2.821 -6.375 1.00 24.45 H new ATOM 0 HB2 PHE A 21 -13.552 -2.055 -8.649 1.00 61.03 H new ATOM 0 HB3 PHE A 21 -14.242 -0.480 -8.310 1.00 61.03 H new ATOM 0 HD1 PHE A 21 -11.658 -2.806 -6.887 1.00 11.14 H new ATOM 0 HD2 PHE A 21 -12.781 1.233 -7.715 1.00 13.44 H new ATOM 0 HE1 PHE A 21 -9.463 -2.034 -6.121 1.00 1.30 H new ATOM 0 HE2 PHE A 21 -10.585 1.998 -6.930 1.00 34.12 H new ATOM 0 HZ PHE A 21 -8.921 0.364 -6.143 1.00 42.41 H new ATOM 180 N VAL A 22 -14.615 -1.298 -4.511 1.00 22.22 N ATOM 181 CA VAL A 22 -14.868 -0.433 -3.404 1.00 54.13 C ATOM 182 C VAL A 22 -13.619 0.314 -3.000 1.00 63.42 C ATOM 183 O VAL A 22 -12.682 -0.238 -2.404 1.00 31.25 O ATOM 184 CB VAL A 22 -15.583 -1.128 -2.210 1.00 14.32 C ATOM 185 CG1 VAL A 22 -17.019 -1.452 -2.592 1.00 51.34 C ATOM 186 CG2 VAL A 22 -14.871 -2.412 -1.803 1.00 24.02 C ATOM 0 H VAL A 22 -14.123 -2.160 -4.276 1.00 22.22 H new ATOM 0 HA VAL A 22 -15.590 0.307 -3.748 1.00 54.13 H new ATOM 0 HB VAL A 22 -15.564 -0.442 -1.363 1.00 14.32 H new ATOM 0 HG11 VAL A 22 -17.517 -1.939 -1.754 1.00 51.34 H new ATOM 0 HG12 VAL A 22 -17.546 -0.531 -2.842 1.00 51.34 H new ATOM 0 HG13 VAL A 22 -17.025 -2.119 -3.454 1.00 51.34 H new ATOM 0 HG21 VAL A 22 -15.398 -2.871 -0.966 1.00 24.02 H new ATOM 0 HG22 VAL A 22 -14.857 -3.103 -2.646 1.00 24.02 H new ATOM 0 HG23 VAL A 22 -13.848 -2.182 -1.505 1.00 24.02 H new ATOM 196 N TYR A 23 -13.617 1.574 -3.348 1.00 72.33 N ATOM 197 CA TYR A 23 -12.471 2.445 -3.176 1.00 31.31 C ATOM 198 C TYR A 23 -12.188 2.831 -1.726 1.00 12.23 C ATOM 199 O TYR A 23 -11.089 3.258 -1.407 1.00 54.15 O ATOM 200 CB TYR A 23 -12.606 3.685 -4.061 1.00 24.12 C ATOM 201 CG TYR A 23 -13.842 4.549 -3.813 1.00 52.33 C ATOM 202 CD1 TYR A 23 -15.068 4.241 -4.395 1.00 5.11 C ATOM 203 CD2 TYR A 23 -13.769 5.679 -3.012 1.00 23.31 C ATOM 204 CE1 TYR A 23 -16.181 5.036 -4.185 1.00 41.11 C ATOM 205 CE2 TYR A 23 -14.877 6.474 -2.797 1.00 52.34 C ATOM 206 CZ TYR A 23 -16.077 6.150 -3.383 1.00 10.43 C ATOM 207 OH TYR A 23 -17.176 6.944 -3.164 1.00 74.44 O ATOM 0 H TYR A 23 -14.423 2.037 -3.767 1.00 72.33 H new ATOM 0 HA TYR A 23 -11.603 1.866 -3.492 1.00 31.31 H new ATOM 0 HB2 TYR A 23 -11.720 4.304 -3.923 1.00 24.12 H new ATOM 0 HB3 TYR A 23 -12.613 3.365 -5.103 1.00 24.12 H new ATOM 0 HD1 TYR A 23 -15.152 3.366 -5.022 1.00 5.11 H new ATOM 0 HD2 TYR A 23 -12.829 5.941 -2.549 1.00 23.31 H new ATOM 0 HE1 TYR A 23 -17.124 4.784 -4.647 1.00 41.11 H new ATOM 0 HE2 TYR A 23 -14.801 7.349 -2.169 1.00 52.34 H new ATOM 0 HH TYR A 23 -17.858 6.433 -2.680 1.00 74.44 H new ATOM 217 N GLY A 24 -13.166 2.683 -0.861 1.00 60.33 N ATOM 218 CA GLY A 24 -12.935 3.029 0.523 1.00 72.43 C ATOM 219 C GLY A 24 -14.203 3.161 1.312 1.00 21.14 C ATOM 220 O GLY A 24 -14.274 2.703 2.443 1.00 63.15 O ATOM 0 H GLY A 24 -14.100 2.337 -1.080 1.00 60.33 H new ATOM 0 HA2 GLY A 24 -12.305 2.267 0.982 1.00 72.43 H new ATOM 0 HA3 GLY A 24 -12.384 3.969 0.570 1.00 72.43 H new ATOM 224 N SER A 25 -15.217 3.757 0.696 1.00 51.33 N ATOM 225 CA SER A 25 -16.500 4.018 1.349 1.00 53.04 C ATOM 226 C SER A 25 -17.158 2.731 1.871 1.00 4.30 C ATOM 227 O SER A 25 -17.775 2.722 2.939 1.00 12.31 O ATOM 228 CB SER A 25 -17.428 4.668 0.332 1.00 32.14 C ATOM 229 OG SER A 25 -16.812 5.793 -0.258 1.00 4.24 O ATOM 0 H SER A 25 -15.175 4.075 -0.272 1.00 51.33 H new ATOM 0 HA SER A 25 -16.322 4.669 2.205 1.00 53.04 H new ATOM 0 HB2 SER A 25 -17.693 3.946 -0.440 1.00 32.14 H new ATOM 0 HB3 SER A 25 -18.356 4.969 0.819 1.00 32.14 H new ATOM 0 HG SER A 25 -16.630 5.608 -1.203 1.00 4.24 H new ATOM 235 N PHE A 26 -17.002 1.656 1.126 1.00 2.20 N ATOM 236 CA PHE A 26 -17.627 0.385 1.454 1.00 44.33 C ATOM 237 C PHE A 26 -16.618 -0.726 1.297 1.00 11.13 C ATOM 238 O PHE A 26 -16.945 -1.830 0.906 1.00 45.12 O ATOM 239 CB PHE A 26 -18.820 0.159 0.519 1.00 42.44 C ATOM 240 CG PHE A 26 -19.875 1.211 0.658 1.00 13.31 C ATOM 241 CD1 PHE A 26 -20.502 1.419 1.873 1.00 31.50 C ATOM 242 CD2 PHE A 26 -20.222 2.006 -0.412 1.00 32.52 C ATOM 243 CE1 PHE A 26 -21.452 2.403 2.015 1.00 1.34 C ATOM 244 CE2 PHE A 26 -21.178 2.986 -0.273 1.00 51.11 C ATOM 245 CZ PHE A 26 -21.793 3.186 0.942 1.00 21.02 C ATOM 0 H PHE A 26 -16.439 1.636 0.276 1.00 2.20 H new ATOM 0 HA PHE A 26 -17.978 0.395 2.486 1.00 44.33 H new ATOM 0 HB2 PHE A 26 -18.468 0.138 -0.512 1.00 42.44 H new ATOM 0 HB3 PHE A 26 -19.258 -0.817 0.726 1.00 42.44 H new ATOM 0 HD1 PHE A 26 -20.242 0.801 2.720 1.00 31.50 H new ATOM 0 HD2 PHE A 26 -19.740 1.859 -1.367 1.00 32.52 H new ATOM 0 HE1 PHE A 26 -21.929 2.559 2.971 1.00 1.34 H new ATOM 0 HE2 PHE A 26 -21.447 3.600 -1.120 1.00 51.11 H new ATOM 0 HZ PHE A 26 -22.542 3.957 1.050 1.00 21.02 H new ATOM 255 N GLN A 27 -15.397 -0.436 1.663 1.00 3.24 N ATOM 256 CA GLN A 27 -14.316 -1.362 1.483 1.00 43.45 C ATOM 257 C GLN A 27 -14.219 -2.337 2.677 1.00 24.34 C ATOM 258 O GLN A 27 -13.395 -3.268 2.690 1.00 13.44 O ATOM 259 CB GLN A 27 -13.037 -0.571 1.307 1.00 32.11 C ATOM 260 CG GLN A 27 -11.857 -1.375 0.858 1.00 11.02 C ATOM 261 CD GLN A 27 -10.640 -0.525 0.682 1.00 33.23 C ATOM 262 OE1 GLN A 27 -9.855 -0.351 1.597 1.00 10.11 O ATOM 263 NE2 GLN A 27 -10.497 0.041 -0.481 1.00 12.14 N ATOM 0 H GLN A 27 -15.127 0.448 2.094 1.00 3.24 H new ATOM 0 HA GLN A 27 -14.491 -1.971 0.596 1.00 43.45 H new ATOM 0 HB2 GLN A 27 -13.215 0.223 0.582 1.00 32.11 H new ATOM 0 HB3 GLN A 27 -12.791 -0.089 2.253 1.00 32.11 H new ATOM 0 HG2 GLN A 27 -11.651 -2.157 1.588 1.00 11.02 H new ATOM 0 HG3 GLN A 27 -12.093 -1.872 -0.083 1.00 11.02 H new ATOM 0 HE21 GLN A 27 -11.179 -0.132 -1.220 1.00 12.14 H new ATOM 0 HE22 GLN A 27 -9.703 0.658 -0.654 1.00 12.14 H new ATOM 272 N ASP A 28 -15.037 -2.116 3.674 1.00 21.24 N ATOM 273 CA ASP A 28 -15.059 -2.979 4.834 1.00 45.14 C ATOM 274 C ASP A 28 -16.313 -3.860 4.789 1.00 74.21 C ATOM 275 O ASP A 28 -17.432 -3.343 4.745 1.00 31.32 O ATOM 276 CB ASP A 28 -15.028 -2.147 6.115 1.00 45.13 C ATOM 277 CG ASP A 28 -14.903 -2.987 7.363 1.00 72.05 C ATOM 278 OD1 ASP A 28 -15.920 -3.507 7.858 1.00 51.34 O ATOM 279 OD2 ASP A 28 -13.770 -3.145 7.871 1.00 42.33 O ATOM 0 H ASP A 28 -15.701 -1.342 3.708 1.00 21.24 H new ATOM 0 HA ASP A 28 -14.176 -3.618 4.826 1.00 45.14 H new ATOM 0 HB2 ASP A 28 -14.192 -1.450 6.068 1.00 45.13 H new ATOM 0 HB3 ASP A 28 -15.938 -1.550 6.176 1.00 45.13 H new ATOM 284 N PRO A 29 -16.146 -5.205 4.782 1.00 65.44 N ATOM 285 CA PRO A 29 -17.263 -6.152 4.688 1.00 44.15 C ATOM 286 C PRO A 29 -18.310 -5.986 5.787 1.00 34.13 C ATOM 287 O PRO A 29 -19.495 -6.207 5.551 1.00 35.01 O ATOM 288 CB PRO A 29 -16.607 -7.531 4.784 1.00 4.14 C ATOM 289 CG PRO A 29 -15.233 -7.281 5.287 1.00 33.42 C ATOM 290 CD PRO A 29 -14.857 -5.903 4.835 1.00 24.42 C ATOM 0 HA PRO A 29 -17.815 -5.991 3.762 1.00 44.15 H new ATOM 0 HB2 PRO A 29 -17.160 -8.183 5.460 1.00 4.14 H new ATOM 0 HB3 PRO A 29 -16.586 -8.024 3.812 1.00 4.14 H new ATOM 0 HG2 PRO A 29 -15.199 -7.355 6.374 1.00 33.42 H new ATOM 0 HG3 PRO A 29 -14.536 -8.021 4.895 1.00 33.42 H new ATOM 0 HD2 PRO A 29 -14.168 -5.425 5.531 1.00 24.42 H new ATOM 0 HD3 PRO A 29 -14.367 -5.918 3.862 1.00 24.42 H new ATOM 298 N ASP A 30 -17.892 -5.562 6.970 1.00 11.30 N ATOM 299 CA ASP A 30 -18.831 -5.392 8.080 1.00 2.13 C ATOM 300 C ASP A 30 -19.780 -4.240 7.786 1.00 63.32 C ATOM 301 O ASP A 30 -20.968 -4.274 8.142 1.00 4.01 O ATOM 302 CB ASP A 30 -18.100 -5.180 9.401 1.00 34.51 C ATOM 303 CG ASP A 30 -19.041 -4.947 10.552 1.00 55.21 C ATOM 304 OD1 ASP A 30 -19.570 -5.927 11.109 1.00 52.22 O ATOM 305 OD2 ASP A 30 -19.283 -3.772 10.909 1.00 11.01 O ATOM 0 H ASP A 30 -16.923 -5.331 7.190 1.00 11.30 H new ATOM 0 HA ASP A 30 -19.414 -6.307 8.180 1.00 2.13 H new ATOM 0 HB2 ASP A 30 -17.481 -6.052 9.613 1.00 34.51 H new ATOM 0 HB3 ASP A 30 -17.428 -4.327 9.307 1.00 34.51 H new ATOM 310 N VAL A 31 -19.258 -3.246 7.098 1.00 64.42 N ATOM 311 CA VAL A 31 -20.050 -2.117 6.642 1.00 31.21 C ATOM 312 C VAL A 31 -21.036 -2.603 5.590 1.00 45.50 C ATOM 313 O VAL A 31 -22.200 -2.201 5.565 1.00 45.03 O ATOM 314 CB VAL A 31 -19.147 -1.019 6.030 1.00 45.15 C ATOM 315 CG1 VAL A 31 -19.976 0.129 5.474 1.00 35.24 C ATOM 316 CG2 VAL A 31 -18.163 -0.514 7.062 1.00 44.24 C ATOM 0 H VAL A 31 -18.273 -3.196 6.838 1.00 64.42 H new ATOM 0 HA VAL A 31 -20.580 -1.690 7.494 1.00 31.21 H new ATOM 0 HB VAL A 31 -18.591 -1.460 5.202 1.00 45.15 H new ATOM 0 HG11 VAL A 31 -19.314 0.884 5.051 1.00 35.24 H new ATOM 0 HG12 VAL A 31 -20.642 -0.246 4.697 1.00 35.24 H new ATOM 0 HG13 VAL A 31 -20.567 0.572 6.275 1.00 35.24 H new ATOM 0 HG21 VAL A 31 -17.534 0.258 6.618 1.00 44.24 H new ATOM 0 HG22 VAL A 31 -18.707 -0.096 7.909 1.00 44.24 H new ATOM 0 HG23 VAL A 31 -17.538 -1.339 7.403 1.00 44.24 H new ATOM 326 N ILE A 32 -20.566 -3.503 4.752 1.00 71.24 N ATOM 327 CA ILE A 32 -21.361 -4.087 3.704 1.00 62.14 C ATOM 328 C ILE A 32 -22.551 -4.876 4.306 1.00 21.21 C ATOM 329 O ILE A 32 -23.666 -4.850 3.770 1.00 65.43 O ATOM 330 CB ILE A 32 -20.480 -5.012 2.843 1.00 31.42 C ATOM 331 CG1 ILE A 32 -19.372 -4.227 2.146 1.00 64.21 C ATOM 332 CG2 ILE A 32 -21.295 -5.771 1.831 1.00 52.05 C ATOM 333 CD1 ILE A 32 -19.882 -3.171 1.201 1.00 62.41 C ATOM 0 H ILE A 32 -19.608 -3.851 4.784 1.00 71.24 H new ATOM 0 HA ILE A 32 -21.763 -3.293 3.075 1.00 62.14 H new ATOM 0 HB ILE A 32 -20.021 -5.735 3.518 1.00 31.42 H new ATOM 0 HG12 ILE A 32 -18.744 -3.754 2.901 1.00 64.21 H new ATOM 0 HG13 ILE A 32 -18.739 -4.921 1.594 1.00 64.21 H new ATOM 0 HG21 ILE A 32 -20.639 -6.413 1.243 1.00 52.05 H new ATOM 0 HG22 ILE A 32 -22.035 -6.383 2.346 1.00 52.05 H new ATOM 0 HG23 ILE A 32 -21.802 -5.067 1.171 1.00 52.05 H new ATOM 0 HD11 ILE A 32 -19.038 -2.655 0.743 1.00 62.41 H new ATOM 0 HD12 ILE A 32 -20.486 -3.639 0.424 1.00 62.41 H new ATOM 0 HD13 ILE A 32 -20.491 -2.454 1.751 1.00 62.41 H new ATOM 345 N ASN A 33 -22.307 -5.546 5.435 1.00 10.03 N ATOM 346 CA ASN A 33 -23.361 -6.287 6.155 1.00 70.30 C ATOM 347 C ASN A 33 -24.537 -5.380 6.442 1.00 35.11 C ATOM 348 O ASN A 33 -25.685 -5.706 6.155 1.00 60.04 O ATOM 349 CB ASN A 33 -22.863 -6.803 7.528 1.00 34.00 C ATOM 350 CG ASN A 33 -21.929 -8.009 7.540 1.00 73.42 C ATOM 351 OD1 ASN A 33 -21.924 -8.767 8.502 1.00 5.51 O ATOM 352 ND2 ASN A 33 -21.154 -8.207 6.528 1.00 13.14 N ATOM 0 H ASN A 33 -21.388 -5.594 5.876 1.00 10.03 H new ATOM 0 HA ASN A 33 -23.642 -7.123 5.515 1.00 70.30 H new ATOM 0 HB2 ASN A 33 -22.354 -5.980 8.030 1.00 34.00 H new ATOM 0 HB3 ASN A 33 -23.738 -7.051 8.130 1.00 34.00 H new ATOM 0 HD21 ASN A 33 -20.521 -9.007 6.519 1.00 13.14 H new ATOM 0 HD22 ASN A 33 -21.174 -7.564 5.737 1.00 13.14 H new ATOM 359 N VAL A 34 -24.234 -4.238 6.999 1.00 55.34 N ATOM 360 CA VAL A 34 -25.254 -3.323 7.466 1.00 4.21 C ATOM 361 C VAL A 34 -25.841 -2.424 6.372 1.00 64.01 C ATOM 362 O VAL A 34 -27.060 -2.273 6.281 1.00 72.03 O ATOM 363 CB VAL A 34 -24.788 -2.494 8.707 1.00 2.14 C ATOM 364 CG1 VAL A 34 -23.573 -1.649 8.401 1.00 33.10 C ATOM 365 CG2 VAL A 34 -25.918 -1.647 9.272 1.00 33.44 C ATOM 0 H VAL A 34 -23.278 -3.912 7.144 1.00 55.34 H new ATOM 0 HA VAL A 34 -26.074 -3.965 7.787 1.00 4.21 H new ATOM 0 HB VAL A 34 -24.497 -3.213 9.473 1.00 2.14 H new ATOM 0 HG11 VAL A 34 -23.285 -1.090 9.291 1.00 33.10 H new ATOM 0 HG12 VAL A 34 -22.749 -2.294 8.094 1.00 33.10 H new ATOM 0 HG13 VAL A 34 -23.808 -0.953 7.596 1.00 33.10 H new ATOM 0 HG21 VAL A 34 -25.556 -1.085 10.133 1.00 33.44 H new ATOM 0 HG22 VAL A 34 -26.270 -0.954 8.508 1.00 33.44 H new ATOM 0 HG23 VAL A 34 -26.739 -2.294 9.580 1.00 33.44 H new ATOM 375 N MET A 35 -24.975 -1.861 5.538 1.00 13.44 N ATOM 376 CA MET A 35 -25.377 -0.868 4.539 1.00 74.34 C ATOM 377 C MET A 35 -26.364 -1.478 3.534 1.00 74.30 C ATOM 378 O MET A 35 -27.327 -0.831 3.115 1.00 15.04 O ATOM 379 CB MET A 35 -24.119 -0.348 3.816 1.00 62.33 C ATOM 380 CG MET A 35 -24.239 1.031 3.161 1.00 65.44 C ATOM 381 SD MET A 35 -25.462 1.192 1.860 1.00 65.32 S ATOM 382 CE MET A 35 -24.743 0.138 0.622 1.00 50.42 C ATOM 0 H MET A 35 -23.978 -2.076 5.532 1.00 13.44 H new ATOM 0 HA MET A 35 -25.880 -0.038 5.036 1.00 74.34 H new ATOM 0 HB2 MET A 35 -23.299 -0.317 4.534 1.00 62.33 H new ATOM 0 HB3 MET A 35 -23.842 -1.070 3.048 1.00 62.33 H new ATOM 0 HG2 MET A 35 -24.469 1.760 3.938 1.00 65.44 H new ATOM 0 HG3 MET A 35 -23.266 1.300 2.750 1.00 65.44 H new ATOM 0 HE1 MET A 35 -24.930 0.558 -0.366 1.00 50.42 H new ATOM 0 HE2 MET A 35 -23.668 0.063 0.787 1.00 50.42 H new ATOM 0 HE3 MET A 35 -25.190 -0.854 0.685 1.00 50.42 H new ATOM 392 N LEU A 36 -26.160 -2.726 3.198 1.00 41.15 N ATOM 393 CA LEU A 36 -27.048 -3.388 2.299 1.00 25.31 C ATOM 394 C LEU A 36 -27.752 -4.546 2.955 1.00 34.25 C ATOM 395 O LEU A 36 -28.912 -4.407 3.346 1.00 71.34 O ATOM 396 CB LEU A 36 -26.414 -3.750 0.913 1.00 30.51 C ATOM 397 CG LEU A 36 -24.998 -4.372 0.893 1.00 53.20 C ATOM 398 CD1 LEU A 36 -24.725 -4.988 -0.455 1.00 12.20 C ATOM 399 CD2 LEU A 36 -23.961 -3.292 1.122 1.00 3.11 C ATOM 0 H LEU A 36 -25.386 -3.297 3.537 1.00 41.15 H new ATOM 0 HA LEU A 36 -27.814 -2.654 2.051 1.00 25.31 H new ATOM 0 HB2 LEU A 36 -27.088 -4.443 0.410 1.00 30.51 H new ATOM 0 HB3 LEU A 36 -26.386 -2.841 0.313 1.00 30.51 H new ATOM 0 HG LEU A 36 -24.945 -5.129 1.676 1.00 53.20 H new ATOM 0 HD11 LEU A 36 -23.726 -5.424 -0.460 1.00 12.20 H new ATOM 0 HD12 LEU A 36 -25.461 -5.766 -0.655 1.00 12.20 H new ATOM 0 HD13 LEU A 36 -24.790 -4.220 -1.226 1.00 12.20 H new ATOM 0 HD21 LEU A 36 -22.965 -3.735 1.107 1.00 3.11 H new ATOM 0 HD22 LEU A 36 -24.037 -2.542 0.334 1.00 3.11 H new ATOM 0 HD23 LEU A 36 -24.134 -2.821 2.089 1.00 3.11 H new ATOM 411 N ASP A 37 -27.039 -5.652 3.155 1.00 53.24 N ATOM 412 CA ASP A 37 -27.644 -6.888 3.692 1.00 21.43 C ATOM 413 C ASP A 37 -26.663 -8.028 3.664 1.00 72.32 C ATOM 414 O ASP A 37 -26.468 -8.725 4.654 1.00 1.21 O ATOM 415 CB ASP A 37 -28.882 -7.295 2.868 1.00 12.51 C ATOM 416 CG ASP A 37 -29.457 -8.631 3.275 1.00 2.21 C ATOM 417 OD1 ASP A 37 -30.134 -8.716 4.327 1.00 2.32 O ATOM 418 OD2 ASP A 37 -29.250 -9.610 2.544 1.00 63.23 O ATOM 0 H ASP A 37 -26.041 -5.727 2.956 1.00 53.24 H new ATOM 0 HA ASP A 37 -27.935 -6.680 4.722 1.00 21.43 H new ATOM 0 HB2 ASP A 37 -29.650 -6.529 2.976 1.00 12.51 H new ATOM 0 HB3 ASP A 37 -28.612 -7.330 1.813 1.00 12.51 H new ATOM 423 N ARG A 38 -26.024 -8.189 2.544 1.00 43.40 N ATOM 424 CA ARG A 38 -25.137 -9.319 2.322 1.00 51.04 C ATOM 425 C ARG A 38 -23.787 -8.826 1.879 1.00 63.23 C ATOM 426 O ARG A 38 -23.660 -7.678 1.487 1.00 22.01 O ATOM 427 CB ARG A 38 -25.738 -10.251 1.267 1.00 72.31 C ATOM 428 CG ARG A 38 -25.994 -9.575 -0.069 1.00 21.12 C ATOM 429 CD ARG A 38 -26.628 -10.516 -1.067 1.00 14.35 C ATOM 430 NE ARG A 38 -27.923 -11.034 -0.606 1.00 61.11 N ATOM 431 CZ ARG A 38 -28.985 -11.246 -1.393 1.00 35.45 C ATOM 432 NH1 ARG A 38 -28.988 -10.803 -2.650 1.00 44.12 N ATOM 433 NH2 ARG A 38 -30.069 -11.835 -0.897 1.00 1.43 N ATOM 0 H ARG A 38 -26.095 -7.549 1.753 1.00 43.40 H new ATOM 0 HA ARG A 38 -25.019 -9.875 3.252 1.00 51.04 H new ATOM 0 HB2 ARG A 38 -25.065 -11.095 1.114 1.00 72.31 H new ATOM 0 HB3 ARG A 38 -26.677 -10.656 1.645 1.00 72.31 H new ATOM 0 HG2 ARG A 38 -26.644 -8.713 0.080 1.00 21.12 H new ATOM 0 HG3 ARG A 38 -25.053 -9.200 -0.472 1.00 21.12 H new ATOM 0 HD2 ARG A 38 -26.765 -9.997 -2.015 1.00 14.35 H new ATOM 0 HD3 ARG A 38 -25.952 -11.350 -1.255 1.00 14.35 H new ATOM 0 HE ARG A 38 -28.020 -11.248 0.387 1.00 61.11 H new ATOM 0 HH11 ARG A 38 -28.179 -10.300 -3.016 1.00 44.12 H new ATOM 0 HH12 ARG A 38 -29.799 -10.967 -3.246 1.00 44.12 H new ATOM 0 HH21 ARG A 38 -30.090 -12.124 0.081 1.00 1.43 H new ATOM 0 HH22 ARG A 38 -30.880 -11.998 -1.494 1.00 1.43 H new ATOM 447 N THR A 39 -22.790 -9.676 1.937 1.00 71.24 N ATOM 448 CA THR A 39 -21.448 -9.296 1.572 1.00 33.41 C ATOM 449 C THR A 39 -20.897 -10.228 0.493 1.00 75.31 C ATOM 450 O THR A 39 -20.648 -11.412 0.751 1.00 22.22 O ATOM 451 CB THR A 39 -20.540 -9.308 2.815 1.00 32.31 C ATOM 452 OG1 THR A 39 -21.200 -8.536 3.820 1.00 31.45 O ATOM 453 CG2 THR A 39 -19.177 -8.666 2.527 1.00 73.24 C ATOM 0 H THR A 39 -22.886 -10.646 2.237 1.00 71.24 H new ATOM 0 HA THR A 39 -21.470 -8.285 1.165 1.00 33.41 H new ATOM 0 HB THR A 39 -20.366 -10.338 3.126 1.00 32.31 H new ATOM 0 HG1 THR A 39 -21.894 -9.080 4.248 1.00 31.45 H new ATOM 0 HG21 THR A 39 -18.564 -8.693 3.428 1.00 73.24 H new ATOM 0 HG22 THR A 39 -18.676 -9.217 1.731 1.00 73.24 H new ATOM 0 HG23 THR A 39 -19.321 -7.631 2.217 1.00 73.24 H new ATOM 461 N PRO A 40 -20.760 -9.708 -0.739 1.00 74.14 N ATOM 462 CA PRO A 40 -20.197 -10.447 -1.873 1.00 14.55 C ATOM 463 C PRO A 40 -18.741 -10.819 -1.637 1.00 40.21 C ATOM 464 O PRO A 40 -18.038 -10.134 -0.890 1.00 22.10 O ATOM 465 CB PRO A 40 -20.306 -9.461 -3.042 1.00 3.13 C ATOM 466 CG PRO A 40 -21.318 -8.471 -2.610 1.00 73.12 C ATOM 467 CD PRO A 40 -21.156 -8.348 -1.134 1.00 71.31 C ATOM 0 HA PRO A 40 -20.720 -11.387 -2.046 1.00 14.55 H new ATOM 0 HB2 PRO A 40 -19.348 -8.983 -3.247 1.00 3.13 H new ATOM 0 HB3 PRO A 40 -20.613 -9.966 -3.958 1.00 3.13 H new ATOM 0 HG2 PRO A 40 -21.162 -7.511 -3.102 1.00 73.12 H new ATOM 0 HG3 PRO A 40 -22.324 -8.802 -2.867 1.00 73.12 H new ATOM 0 HD2 PRO A 40 -20.397 -7.612 -0.870 1.00 71.31 H new ATOM 0 HD3 PRO A 40 -22.082 -8.039 -0.649 1.00 71.31 H new ATOM 475 N GLU A 41 -18.309 -11.913 -2.256 1.00 54.43 N ATOM 476 CA GLU A 41 -16.938 -12.399 -2.141 1.00 20.31 C ATOM 477 C GLU A 41 -15.968 -11.301 -2.570 1.00 30.24 C ATOM 478 O GLU A 41 -16.198 -10.607 -3.568 1.00 3.34 O ATOM 479 CB GLU A 41 -16.744 -13.667 -2.980 1.00 51.40 C ATOM 480 CG GLU A 41 -15.354 -14.267 -2.871 1.00 43.44 C ATOM 481 CD GLU A 41 -15.199 -15.541 -3.649 1.00 44.03 C ATOM 482 OE1 GLU A 41 -14.842 -15.485 -4.829 1.00 64.24 O ATOM 483 OE2 GLU A 41 -15.416 -16.629 -3.075 1.00 33.25 O ATOM 0 H GLU A 41 -18.902 -12.489 -2.853 1.00 54.43 H new ATOM 0 HA GLU A 41 -16.734 -12.657 -1.102 1.00 20.31 H new ATOM 0 HB2 GLU A 41 -17.477 -14.412 -2.670 1.00 51.40 H new ATOM 0 HB3 GLU A 41 -16.948 -13.435 -4.025 1.00 51.40 H new ATOM 0 HG2 GLU A 41 -14.623 -13.541 -3.226 1.00 43.44 H new ATOM 0 HG3 GLU A 41 -15.129 -14.460 -1.822 1.00 43.44 H new ATOM 490 N ILE A 42 -14.902 -11.148 -1.829 1.00 41.03 N ATOM 491 CA ILE A 42 -14.021 -10.031 -2.018 1.00 54.42 C ATOM 492 C ILE A 42 -12.642 -10.489 -2.478 1.00 70.01 C ATOM 493 O ILE A 42 -12.100 -11.477 -1.972 1.00 14.40 O ATOM 494 CB ILE A 42 -13.860 -9.257 -0.684 1.00 21.32 C ATOM 495 CG1 ILE A 42 -15.226 -8.956 -0.069 1.00 74.54 C ATOM 496 CG2 ILE A 42 -13.118 -7.969 -0.925 1.00 3.14 C ATOM 497 CD1 ILE A 42 -15.169 -8.241 1.267 1.00 44.21 C ATOM 0 H ILE A 42 -14.624 -11.788 -1.085 1.00 41.03 H new ATOM 0 HA ILE A 42 -14.458 -9.389 -2.783 1.00 54.42 H new ATOM 0 HB ILE A 42 -13.293 -9.878 0.010 1.00 21.32 H new ATOM 0 HG12 ILE A 42 -15.799 -8.348 -0.768 1.00 74.54 H new ATOM 0 HG13 ILE A 42 -15.768 -9.893 0.057 1.00 74.54 H new ATOM 0 HG21 ILE A 42 -13.009 -7.431 0.016 1.00 3.14 H new ATOM 0 HG22 ILE A 42 -12.132 -8.188 -1.334 1.00 3.14 H new ATOM 0 HG23 ILE A 42 -13.676 -7.355 -1.632 1.00 3.14 H new ATOM 0 HD11 ILE A 42 -16.182 -8.067 1.630 1.00 44.21 H new ATOM 0 HD12 ILE A 42 -14.626 -8.855 1.985 1.00 44.21 H new ATOM 0 HD13 ILE A 42 -14.658 -7.286 1.147 1.00 44.21 H new ATOM 509 N VAL A 43 -12.096 -9.780 -3.431 1.00 73.53 N ATOM 510 CA VAL A 43 -10.747 -10.021 -3.905 1.00 31.02 C ATOM 511 C VAL A 43 -9.981 -8.695 -3.932 1.00 71.45 C ATOM 512 O VAL A 43 -10.577 -7.634 -4.158 1.00 23.42 O ATOM 513 CB VAL A 43 -10.715 -10.677 -5.330 1.00 64.03 C ATOM 514 CG1 VAL A 43 -11.296 -9.745 -6.384 1.00 4.44 C ATOM 515 CG2 VAL A 43 -9.296 -11.109 -5.706 1.00 32.25 C ATOM 0 H VAL A 43 -12.572 -9.014 -3.907 1.00 73.53 H new ATOM 0 HA VAL A 43 -10.277 -10.725 -3.218 1.00 31.02 H new ATOM 0 HB VAL A 43 -11.341 -11.569 -5.294 1.00 64.03 H new ATOM 0 HG11 VAL A 43 -11.259 -10.230 -7.359 1.00 4.44 H new ATOM 0 HG12 VAL A 43 -12.331 -9.513 -6.134 1.00 4.44 H new ATOM 0 HG13 VAL A 43 -10.715 -8.823 -6.415 1.00 4.44 H new ATOM 0 HG21 VAL A 43 -9.304 -11.560 -6.698 1.00 32.25 H new ATOM 0 HG22 VAL A 43 -8.639 -10.239 -5.708 1.00 32.25 H new ATOM 0 HG23 VAL A 43 -8.933 -11.836 -4.980 1.00 32.25 H new ATOM 525 N SER A 44 -8.708 -8.746 -3.668 1.00 64.53 N ATOM 526 CA SER A 44 -7.872 -7.577 -3.733 1.00 4.04 C ATOM 527 C SER A 44 -7.567 -7.259 -5.204 1.00 12.15 C ATOM 528 O SER A 44 -7.138 -8.139 -5.959 1.00 24.31 O ATOM 529 CB SER A 44 -6.585 -7.846 -2.968 1.00 33.04 C ATOM 530 OG SER A 44 -6.859 -8.180 -1.606 1.00 33.23 O ATOM 0 H SER A 44 -8.217 -9.599 -3.401 1.00 64.53 H new ATOM 0 HA SER A 44 -8.379 -6.722 -3.285 1.00 4.04 H new ATOM 0 HB2 SER A 44 -6.039 -8.661 -3.443 1.00 33.04 H new ATOM 0 HB3 SER A 44 -5.943 -6.966 -3.008 1.00 33.04 H new ATOM 0 HG SER A 44 -6.017 -8.350 -1.135 1.00 33.23 H new ATOM 536 N ALA A 45 -7.818 -6.036 -5.613 1.00 35.52 N ATOM 537 CA ALA A 45 -7.581 -5.614 -6.981 1.00 25.32 C ATOM 538 C ALA A 45 -7.083 -4.182 -7.056 1.00 74.42 C ATOM 539 O ALA A 45 -7.276 -3.396 -6.141 1.00 13.42 O ATOM 540 CB ALA A 45 -8.835 -5.755 -7.792 1.00 1.04 C ATOM 0 H ALA A 45 -8.192 -5.304 -5.009 1.00 35.52 H new ATOM 0 HA ALA A 45 -6.804 -6.260 -7.389 1.00 25.32 H new ATOM 0 HB1 ALA A 45 -8.644 -5.435 -8.816 1.00 1.04 H new ATOM 0 HB2 ALA A 45 -9.154 -6.797 -7.791 1.00 1.04 H new ATOM 0 HB3 ALA A 45 -9.620 -5.135 -7.359 1.00 1.04 H new ATOM 546 N THR A 46 -6.465 -3.862 -8.146 1.00 43.25 N ATOM 547 CA THR A 46 -5.943 -2.549 -8.384 1.00 35.52 C ATOM 548 C THR A 46 -6.587 -1.928 -9.607 1.00 54.11 C ATOM 549 O THR A 46 -6.698 -2.572 -10.653 1.00 54.51 O ATOM 550 CB THR A 46 -4.413 -2.591 -8.568 1.00 3.10 C ATOM 551 OG1 THR A 46 -3.823 -3.066 -7.375 1.00 33.22 O ATOM 552 CG2 THR A 46 -3.845 -1.213 -8.885 1.00 1.11 C ATOM 0 H THR A 46 -6.304 -4.516 -8.912 1.00 43.25 H new ATOM 0 HA THR A 46 -6.176 -1.937 -7.512 1.00 35.52 H new ATOM 0 HB THR A 46 -4.189 -3.251 -9.406 1.00 3.10 H new ATOM 0 HG1 THR A 46 -3.171 -3.765 -7.589 1.00 33.22 H new ATOM 0 HG21 THR A 46 -2.764 -1.284 -9.008 1.00 1.11 H new ATOM 0 HG22 THR A 46 -4.291 -0.839 -9.807 1.00 1.11 H new ATOM 0 HG23 THR A 46 -4.073 -0.529 -8.068 1.00 1.11 H new ATOM 560 N LEU A 47 -7.023 -0.706 -9.455 1.00 22.05 N ATOM 561 CA LEU A 47 -7.583 0.063 -10.524 1.00 30.24 C ATOM 562 C LEU A 47 -6.543 1.054 -11.037 1.00 45.32 C ATOM 563 O LEU A 47 -6.258 2.046 -10.375 1.00 44.13 O ATOM 564 CB LEU A 47 -8.842 0.797 -10.036 1.00 52.22 C ATOM 565 CG LEU A 47 -9.489 1.770 -11.017 1.00 54.40 C ATOM 566 CD1 LEU A 47 -9.802 1.093 -12.338 1.00 25.02 C ATOM 567 CD2 LEU A 47 -10.749 2.373 -10.415 1.00 52.14 C ATOM 0 H LEU A 47 -6.996 -0.211 -8.564 1.00 22.05 H new ATOM 0 HA LEU A 47 -7.868 -0.599 -11.342 1.00 30.24 H new ATOM 0 HB2 LEU A 47 -9.585 0.050 -9.757 1.00 52.22 H new ATOM 0 HB3 LEU A 47 -8.586 1.346 -9.130 1.00 52.22 H new ATOM 0 HG LEU A 47 -8.777 2.572 -11.213 1.00 54.40 H new ATOM 0 HD11 LEU A 47 -10.262 1.812 -13.015 1.00 25.02 H new ATOM 0 HD12 LEU A 47 -8.880 0.716 -12.781 1.00 25.02 H new ATOM 0 HD13 LEU A 47 -10.489 0.264 -12.168 1.00 25.02 H new ATOM 0 HD21 LEU A 47 -11.198 3.065 -11.128 1.00 52.14 H new ATOM 0 HD22 LEU A 47 -11.458 1.578 -10.185 1.00 52.14 H new ATOM 0 HD23 LEU A 47 -10.495 2.909 -9.500 1.00 52.14 H new ATOM 579 N PRO A 48 -5.927 0.770 -12.188 1.00 32.42 N ATOM 580 CA PRO A 48 -4.942 1.652 -12.774 1.00 5.34 C ATOM 581 C PRO A 48 -5.596 2.725 -13.644 1.00 5.34 C ATOM 582 O PRO A 48 -6.595 2.464 -14.337 1.00 42.32 O ATOM 583 CB PRO A 48 -4.093 0.706 -13.623 1.00 25.54 C ATOM 584 CG PRO A 48 -5.026 -0.396 -14.035 1.00 14.10 C ATOM 585 CD PRO A 48 -6.139 -0.442 -13.009 1.00 62.44 C ATOM 0 HA PRO A 48 -4.367 2.199 -12.027 1.00 5.34 H new ATOM 0 HB2 PRO A 48 -3.681 1.219 -14.492 1.00 25.54 H new ATOM 0 HB3 PRO A 48 -3.249 0.316 -13.054 1.00 25.54 H new ATOM 0 HG2 PRO A 48 -5.427 -0.209 -15.031 1.00 14.10 H new ATOM 0 HG3 PRO A 48 -4.501 -1.350 -14.077 1.00 14.10 H new ATOM 0 HD2 PRO A 48 -7.120 -0.434 -13.485 1.00 62.44 H new ATOM 0 HD3 PRO A 48 -6.086 -1.347 -12.404 1.00 62.44 H new ATOM 593 N GLY A 49 -5.053 3.917 -13.606 1.00 5.41 N ATOM 594 CA GLY A 49 -5.602 4.996 -14.391 1.00 2.45 C ATOM 595 C GLY A 49 -6.570 5.822 -13.593 1.00 71.10 C ATOM 596 O GLY A 49 -7.244 6.709 -14.134 1.00 44.21 O ATOM 0 H GLY A 49 -4.238 4.164 -13.045 1.00 5.41 H new ATOM 0 HA2 GLY A 49 -4.794 5.631 -14.754 1.00 2.45 H new ATOM 0 HA3 GLY A 49 -6.106 4.589 -15.268 1.00 2.45 H new ATOM 600 N PHE A 50 -6.636 5.541 -12.310 1.00 54.00 N ATOM 601 CA PHE A 50 -7.490 6.238 -11.386 1.00 3.42 C ATOM 602 C PHE A 50 -6.769 6.303 -10.095 1.00 3.11 C ATOM 603 O PHE A 50 -6.071 5.370 -9.741 1.00 54.32 O ATOM 604 CB PHE A 50 -8.855 5.541 -11.196 1.00 41.13 C ATOM 605 CG PHE A 50 -9.756 5.567 -12.405 1.00 41.33 C ATOM 606 CD1 PHE A 50 -9.673 4.587 -13.382 1.00 13.35 C ATOM 607 CD2 PHE A 50 -10.680 6.584 -12.563 1.00 33.02 C ATOM 608 CE1 PHE A 50 -10.495 4.624 -14.488 1.00 33.22 C ATOM 609 CE2 PHE A 50 -11.505 6.626 -13.670 1.00 54.30 C ATOM 610 CZ PHE A 50 -11.413 5.643 -14.633 1.00 4.04 C ATOM 0 H PHE A 50 -6.082 4.803 -11.875 1.00 54.00 H new ATOM 0 HA PHE A 50 -7.709 7.231 -11.779 1.00 3.42 H new ATOM 0 HB2 PHE A 50 -8.680 4.503 -10.914 1.00 41.13 H new ATOM 0 HB3 PHE A 50 -9.375 6.014 -10.363 1.00 41.13 H new ATOM 0 HD1 PHE A 50 -8.957 3.786 -13.275 1.00 13.35 H new ATOM 0 HD2 PHE A 50 -10.757 7.355 -11.811 1.00 33.02 H new ATOM 0 HE1 PHE A 50 -10.420 3.854 -15.242 1.00 33.22 H new ATOM 0 HE2 PHE A 50 -12.221 7.427 -13.781 1.00 54.30 H new ATOM 0 HZ PHE A 50 -12.058 5.671 -15.499 1.00 4.04 H new ATOM 620 N GLN A 51 -6.912 7.372 -9.400 1.00 62.41 N ATOM 621 CA GLN A 51 -6.184 7.555 -8.190 1.00 72.04 C ATOM 622 C GLN A 51 -7.085 8.263 -7.217 1.00 1.54 C ATOM 623 O GLN A 51 -7.899 9.103 -7.626 1.00 43.44 O ATOM 624 CB GLN A 51 -4.938 8.369 -8.519 1.00 13.30 C ATOM 625 CG GLN A 51 -3.899 8.528 -7.421 1.00 5.34 C ATOM 626 CD GLN A 51 -2.691 9.295 -7.944 1.00 74.24 C ATOM 627 OE1 GLN A 51 -2.820 10.139 -8.835 1.00 31.01 O ATOM 628 NE2 GLN A 51 -1.526 9.017 -7.435 1.00 35.04 N ATOM 0 H GLN A 51 -7.532 8.143 -9.648 1.00 62.41 H new ATOM 0 HA GLN A 51 -5.869 6.613 -7.741 1.00 72.04 H new ATOM 0 HB2 GLN A 51 -4.452 7.909 -9.379 1.00 13.30 H new ATOM 0 HB3 GLN A 51 -5.257 9.364 -8.828 1.00 13.30 H new ATOM 0 HG2 GLN A 51 -4.334 9.056 -6.573 1.00 5.34 H new ATOM 0 HG3 GLN A 51 -3.588 7.548 -7.061 1.00 5.34 H new ATOM 0 HE21 GLN A 51 -1.445 8.315 -6.699 1.00 35.04 H new ATOM 0 HE22 GLN A 51 -0.694 9.501 -7.772 1.00 35.04 H new ATOM 637 N ARG A 52 -6.998 7.905 -5.957 1.00 52.54 N ATOM 638 CA ARG A 52 -7.839 8.520 -4.981 1.00 34.22 C ATOM 639 C ARG A 52 -7.142 9.718 -4.400 1.00 43.12 C ATOM 640 O ARG A 52 -6.013 9.619 -3.885 1.00 21.34 O ATOM 641 CB ARG A 52 -8.278 7.517 -3.884 1.00 54.03 C ATOM 642 CG ARG A 52 -9.279 8.101 -2.885 1.00 73.24 C ATOM 643 CD ARG A 52 -9.932 7.040 -1.978 1.00 31.14 C ATOM 644 NE ARG A 52 -8.990 6.328 -1.091 1.00 75.51 N ATOM 645 CZ ARG A 52 -9.354 5.721 0.076 1.00 4.15 C ATOM 646 NH1 ARG A 52 -10.567 5.906 0.573 1.00 42.43 N ATOM 647 NH2 ARG A 52 -8.489 4.964 0.747 1.00 61.34 N ATOM 0 H ARG A 52 -6.358 7.198 -5.595 1.00 52.54 H new ATOM 0 HA ARG A 52 -8.754 8.854 -5.470 1.00 34.22 H new ATOM 0 HB2 ARG A 52 -8.721 6.642 -4.360 1.00 54.03 H new ATOM 0 HB3 ARG A 52 -7.396 7.174 -3.343 1.00 54.03 H new ATOM 0 HG2 ARG A 52 -8.771 8.837 -2.262 1.00 73.24 H new ATOM 0 HG3 ARG A 52 -10.059 8.630 -3.432 1.00 73.24 H new ATOM 0 HD2 ARG A 52 -10.693 7.523 -1.365 1.00 31.14 H new ATOM 0 HD3 ARG A 52 -10.443 6.310 -2.605 1.00 31.14 H new ATOM 0 HE ARG A 52 -8.009 6.287 -1.367 1.00 75.51 H new ATOM 0 HH11 ARG A 52 -11.233 6.504 0.084 1.00 42.43 H new ATOM 0 HH12 ARG A 52 -10.836 5.451 1.445 1.00 42.43 H new ATOM 0 HH21 ARG A 52 -7.543 4.832 0.390 1.00 61.34 H new ATOM 0 HH22 ARG A 52 -8.773 4.515 1.618 1.00 61.34 H new ATOM 661 N PHE A 53 -7.816 10.827 -4.461 1.00 32.24 N ATOM 662 CA PHE A 53 -7.290 12.077 -3.978 1.00 2.45 C ATOM 663 C PHE A 53 -7.998 12.437 -2.722 1.00 73.22 C ATOM 664 O PHE A 53 -9.211 12.321 -2.632 1.00 31.12 O ATOM 665 CB PHE A 53 -7.469 13.217 -5.001 1.00 35.31 C ATOM 666 CG PHE A 53 -6.654 13.117 -6.273 1.00 21.53 C ATOM 667 CD1 PHE A 53 -5.808 12.052 -6.518 1.00 15.44 C ATOM 668 CD2 PHE A 53 -6.738 14.120 -7.217 1.00 23.54 C ATOM 669 CE1 PHE A 53 -5.070 11.991 -7.678 1.00 32.42 C ATOM 670 CE2 PHE A 53 -5.998 14.068 -8.380 1.00 2.21 C ATOM 671 CZ PHE A 53 -5.163 12.998 -8.611 1.00 53.35 C ATOM 0 H PHE A 53 -8.756 10.895 -4.851 1.00 32.24 H new ATOM 0 HA PHE A 53 -6.221 11.951 -3.806 1.00 2.45 H new ATOM 0 HB2 PHE A 53 -8.523 13.268 -5.274 1.00 35.31 H new ATOM 0 HB3 PHE A 53 -7.221 14.158 -4.510 1.00 35.31 H new ATOM 0 HD1 PHE A 53 -5.725 11.258 -5.790 1.00 15.44 H new ATOM 0 HD2 PHE A 53 -7.394 14.960 -7.042 1.00 23.54 H new ATOM 0 HE1 PHE A 53 -4.416 11.150 -7.857 1.00 32.42 H new ATOM 0 HE2 PHE A 53 -6.073 14.864 -9.107 1.00 2.21 H new ATOM 0 HZ PHE A 53 -4.583 12.949 -9.521 1.00 53.35 H new ATOM 681 N ARG A 54 -7.249 12.863 -1.765 1.00 44.42 N ATOM 682 CA ARG A 54 -7.767 13.157 -0.471 1.00 63.35 C ATOM 683 C ARG A 54 -7.793 14.640 -0.181 1.00 31.10 C ATOM 684 O ARG A 54 -7.166 15.451 -0.875 1.00 21.31 O ATOM 685 CB ARG A 54 -6.979 12.416 0.614 1.00 40.33 C ATOM 686 CG ARG A 54 -5.476 12.643 0.559 1.00 0.23 C ATOM 687 CD ARG A 54 -4.786 12.023 1.753 1.00 44.35 C ATOM 688 NE ARG A 54 -5.156 12.703 3.000 1.00 11.24 N ATOM 689 CZ ARG A 54 -5.226 12.132 4.205 1.00 23.10 C ATOM 690 NH1 ARG A 54 -4.975 10.837 4.351 1.00 61.51 N ATOM 691 NH2 ARG A 54 -5.542 12.867 5.265 1.00 21.34 N ATOM 0 H ARG A 54 -6.245 13.020 -1.859 1.00 44.42 H new ATOM 0 HA ARG A 54 -8.799 12.808 -0.461 1.00 63.35 H new ATOM 0 HB2 ARG A 54 -7.347 12.728 1.591 1.00 40.33 H new ATOM 0 HB3 ARG A 54 -7.177 11.348 0.525 1.00 40.33 H new ATOM 0 HG2 ARG A 54 -5.074 12.215 -0.359 1.00 0.23 H new ATOM 0 HG3 ARG A 54 -5.268 13.713 0.530 1.00 0.23 H new ATOM 0 HD2 ARG A 54 -5.051 10.968 1.820 1.00 44.35 H new ATOM 0 HD3 ARG A 54 -3.706 12.073 1.617 1.00 44.35 H new ATOM 0 HE ARG A 54 -5.379 13.697 2.941 1.00 11.24 H new ATOM 0 HH11 ARG A 54 -4.727 10.271 3.540 1.00 61.51 H new ATOM 0 HH12 ARG A 54 -5.030 10.408 5.275 1.00 61.51 H new ATOM 0 HH21 ARG A 54 -5.730 13.864 5.157 1.00 21.34 H new ATOM 0 HH22 ARG A 54 -5.597 12.435 6.187 1.00 21.34 H new ATOM 796 N TYR A 60 -14.346 14.655 -0.008 1.00 25.11 N ATOM 797 CA TYR A 60 -13.981 13.343 0.467 1.00 52.22 C ATOM 798 C TYR A 60 -12.808 12.857 -0.362 1.00 63.14 C ATOM 799 O TYR A 60 -12.453 13.506 -1.353 1.00 12.04 O ATOM 800 CB TYR A 60 -15.169 12.390 0.207 1.00 62.43 C ATOM 801 CG TYR A 60 -16.521 12.979 0.530 1.00 43.44 C ATOM 802 CD1 TYR A 60 -17.059 12.932 1.809 1.00 54.13 C ATOM 803 CD2 TYR A 60 -17.258 13.600 -0.472 1.00 10.41 C ATOM 804 CE1 TYR A 60 -18.299 13.489 2.073 1.00 5.45 C ATOM 805 CE2 TYR A 60 -18.479 14.155 -0.216 1.00 22.51 C ATOM 806 CZ TYR A 60 -19.000 14.102 1.049 1.00 5.44 C ATOM 807 OH TYR A 60 -20.230 14.664 1.292 1.00 34.30 O ATOM 0 HA TYR A 60 -13.729 13.371 1.527 1.00 52.22 H new ATOM 0 HB2 TYR A 60 -15.157 12.091 -0.841 1.00 62.43 H new ATOM 0 HB3 TYR A 60 -15.030 11.485 0.798 1.00 62.43 H new ATOM 0 HD1 TYR A 60 -16.505 12.457 2.605 1.00 54.13 H new ATOM 0 HD2 TYR A 60 -16.856 13.644 -1.474 1.00 10.41 H new ATOM 0 HE1 TYR A 60 -18.715 13.446 3.069 1.00 5.45 H new ATOM 0 HE2 TYR A 60 -19.033 14.635 -1.010 1.00 22.51 H new ATOM 0 HH TYR A 60 -20.705 14.790 0.444 1.00 34.30 H new ATOM 817 N PRO A 61 -12.160 11.743 0.021 1.00 71.31 N ATOM 818 CA PRO A 61 -11.163 11.127 -0.815 1.00 11.21 C ATOM 819 C PRO A 61 -11.859 10.460 -1.999 1.00 42.22 C ATOM 820 O PRO A 61 -12.431 9.368 -1.870 1.00 53.32 O ATOM 821 CB PRO A 61 -10.479 10.088 0.095 1.00 63.21 C ATOM 822 CG PRO A 61 -10.989 10.373 1.468 1.00 52.21 C ATOM 823 CD PRO A 61 -12.327 11.019 1.288 1.00 2.31 C ATOM 0 HA PRO A 61 -10.437 11.831 -1.223 1.00 11.21 H new ATOM 0 HB2 PRO A 61 -10.725 9.072 -0.213 1.00 63.21 H new ATOM 0 HB3 PRO A 61 -9.394 10.180 0.051 1.00 63.21 H new ATOM 0 HG2 PRO A 61 -11.074 9.456 2.050 1.00 52.21 H new ATOM 0 HG3 PRO A 61 -10.308 11.031 2.008 1.00 52.21 H new ATOM 0 HD2 PRO A 61 -13.129 10.283 1.233 1.00 2.31 H new ATOM 0 HD3 PRO A 61 -12.568 11.691 2.111 1.00 2.31 H new ATOM 831 N CYS A 62 -11.846 11.126 -3.120 1.00 65.22 N ATOM 832 CA CYS A 62 -12.604 10.696 -4.262 1.00 13.40 C ATOM 833 C CYS A 62 -11.717 10.079 -5.339 1.00 73.04 C ATOM 834 O CYS A 62 -10.497 10.304 -5.366 1.00 62.11 O ATOM 835 CB CYS A 62 -13.386 11.884 -4.814 1.00 42.12 C ATOM 836 SG CYS A 62 -12.351 13.267 -5.353 1.00 53.54 S ATOM 0 H CYS A 62 -11.310 11.981 -3.268 1.00 65.22 H new ATOM 0 HA CYS A 62 -13.296 9.915 -3.946 1.00 13.40 H new ATOM 0 HB2 CYS A 62 -13.990 11.547 -5.656 1.00 42.12 H new ATOM 0 HB3 CYS A 62 -14.076 12.238 -4.048 1.00 42.12 H new ATOM 0 HG CYS A 62 -13.106 14.223 -5.806 1.00 53.54 H new ATOM 842 N ILE A 63 -12.331 9.303 -6.213 1.00 61.32 N ATOM 843 CA ILE A 63 -11.637 8.640 -7.303 1.00 21.20 C ATOM 844 C ILE A 63 -11.728 9.485 -8.552 1.00 20.02 C ATOM 845 O ILE A 63 -12.825 9.873 -8.967 1.00 25.32 O ATOM 846 CB ILE A 63 -12.258 7.233 -7.590 1.00 1.22 C ATOM 847 CG1 ILE A 63 -12.169 6.353 -6.354 1.00 45.43 C ATOM 848 CG2 ILE A 63 -11.584 6.537 -8.780 1.00 5.15 C ATOM 849 CD1 ILE A 63 -10.753 6.073 -5.918 1.00 14.12 C ATOM 0 H ILE A 63 -13.333 9.113 -6.187 1.00 61.32 H new ATOM 0 HA ILE A 63 -10.594 8.510 -7.013 1.00 21.20 H new ATOM 0 HB ILE A 63 -13.305 7.389 -7.849 1.00 1.22 H new ATOM 0 HG12 ILE A 63 -12.705 6.834 -5.536 1.00 45.43 H new ATOM 0 HG13 ILE A 63 -12.673 5.408 -6.553 1.00 45.43 H new ATOM 0 HG21 ILE A 63 -12.047 5.564 -8.942 1.00 5.15 H new ATOM 0 HG22 ILE A 63 -11.702 7.149 -9.674 1.00 5.15 H new ATOM 0 HG23 ILE A 63 -10.523 6.403 -8.570 1.00 5.15 H new ATOM 0 HD11 ILE A 63 -10.764 5.440 -5.031 1.00 14.12 H new ATOM 0 HD12 ILE A 63 -10.219 5.564 -6.721 1.00 14.12 H new ATOM 0 HD13 ILE A 63 -10.251 7.012 -5.687 1.00 14.12 H new ATOM 861 N VAL A 64 -10.598 9.796 -9.124 1.00 74.41 N ATOM 862 CA VAL A 64 -10.551 10.538 -10.363 1.00 23.14 C ATOM 863 C VAL A 64 -9.580 9.865 -11.323 1.00 51.34 C ATOM 864 O VAL A 64 -8.608 9.230 -10.878 1.00 44.14 O ATOM 865 CB VAL A 64 -10.135 12.030 -10.157 1.00 30.31 C ATOM 866 CG1 VAL A 64 -11.139 12.763 -9.288 1.00 10.12 C ATOM 867 CG2 VAL A 64 -8.743 12.135 -9.560 1.00 12.45 C ATOM 0 H VAL A 64 -9.683 9.545 -8.749 1.00 74.41 H new ATOM 0 HA VAL A 64 -11.559 10.539 -10.778 1.00 23.14 H new ATOM 0 HB VAL A 64 -10.122 12.503 -11.139 1.00 30.31 H new ATOM 0 HG11 VAL A 64 -10.823 13.799 -9.162 1.00 10.12 H new ATOM 0 HG12 VAL A 64 -12.119 12.738 -9.764 1.00 10.12 H new ATOM 0 HG13 VAL A 64 -11.197 12.280 -8.313 1.00 10.12 H new ATOM 0 HG21 VAL A 64 -8.482 13.185 -9.429 1.00 12.45 H new ATOM 0 HG22 VAL A 64 -8.723 11.632 -8.593 1.00 12.45 H new ATOM 0 HG23 VAL A 64 -8.024 11.663 -10.229 1.00 12.45 H new ATOM 877 N PRO A 65 -9.855 9.925 -12.636 1.00 63.22 N ATOM 878 CA PRO A 65 -8.949 9.394 -13.659 1.00 24.31 C ATOM 879 C PRO A 65 -7.575 10.072 -13.637 1.00 10.32 C ATOM 880 O PRO A 65 -7.427 11.228 -14.027 1.00 10.12 O ATOM 881 CB PRO A 65 -9.672 9.686 -14.984 1.00 20.54 C ATOM 882 CG PRO A 65 -10.676 10.733 -14.642 1.00 61.14 C ATOM 883 CD PRO A 65 -11.089 10.459 -13.237 1.00 54.40 C ATOM 0 HA PRO A 65 -8.745 8.335 -13.500 1.00 24.31 H new ATOM 0 HB2 PRO A 65 -8.976 10.038 -15.746 1.00 20.54 H new ATOM 0 HB3 PRO A 65 -10.152 8.791 -15.379 1.00 20.54 H new ATOM 0 HG2 PRO A 65 -10.247 11.731 -14.736 1.00 61.14 H new ATOM 0 HG3 PRO A 65 -11.531 10.689 -15.316 1.00 61.14 H new ATOM 0 HD2 PRO A 65 -11.428 11.363 -12.731 1.00 54.40 H new ATOM 0 HD3 PRO A 65 -11.907 9.741 -13.188 1.00 54.40 H new ATOM 891 N SER A 66 -6.611 9.368 -13.125 1.00 54.53 N ATOM 892 CA SER A 66 -5.255 9.819 -13.065 1.00 3.52 C ATOM 893 C SER A 66 -4.385 8.770 -13.724 1.00 51.22 C ATOM 894 O SER A 66 -4.197 7.692 -13.169 1.00 71.54 O ATOM 895 CB SER A 66 -4.838 10.035 -11.601 1.00 65.11 C ATOM 896 OG SER A 66 -3.492 10.481 -11.485 1.00 31.42 O ATOM 0 H SER A 66 -6.751 8.439 -12.727 1.00 54.53 H new ATOM 0 HA SER A 66 -5.143 10.770 -13.586 1.00 3.52 H new ATOM 0 HB2 SER A 66 -5.502 10.766 -11.140 1.00 65.11 H new ATOM 0 HB3 SER A 66 -4.959 9.103 -11.049 1.00 65.11 H new ATOM 0 HG SER A 66 -3.215 10.444 -10.546 1.00 31.42 H new ATOM 902 N GLU A 67 -3.869 9.070 -14.905 1.00 51.43 N ATOM 903 CA GLU A 67 -3.059 8.111 -15.665 1.00 74.20 C ATOM 904 C GLU A 67 -1.794 7.705 -14.903 1.00 73.53 C ATOM 905 O GLU A 67 -1.269 6.606 -15.087 1.00 44.01 O ATOM 906 CB GLU A 67 -2.682 8.671 -17.034 1.00 65.35 C ATOM 907 CG GLU A 67 -1.883 9.959 -16.970 1.00 4.30 C ATOM 908 CD GLU A 67 -1.413 10.406 -18.314 1.00 43.03 C ATOM 909 OE1 GLU A 67 -2.149 11.164 -18.994 1.00 51.21 O ATOM 910 OE2 GLU A 67 -0.292 10.006 -18.719 1.00 2.40 O ATOM 0 H GLU A 67 -3.993 9.972 -15.366 1.00 51.43 H new ATOM 0 HA GLU A 67 -3.673 7.221 -15.805 1.00 74.20 H new ATOM 0 HB2 GLU A 67 -2.104 7.922 -17.576 1.00 65.35 H new ATOM 0 HB3 GLU A 67 -3.592 8.847 -17.607 1.00 65.35 H new ATOM 0 HG2 GLU A 67 -2.497 10.742 -16.524 1.00 4.30 H new ATOM 0 HG3 GLU A 67 -1.023 9.817 -16.316 1.00 4.30 H new ATOM 917 N LYS A 68 -1.323 8.588 -14.049 1.00 52.11 N ATOM 918 CA LYS A 68 -0.135 8.340 -13.277 1.00 51.21 C ATOM 919 C LYS A 68 -0.465 7.683 -11.942 1.00 4.12 C ATOM 920 O LYS A 68 0.412 7.518 -11.094 1.00 52.01 O ATOM 921 CB LYS A 68 0.628 9.648 -13.054 1.00 60.43 C ATOM 922 CG LYS A 68 1.090 10.303 -14.347 1.00 71.32 C ATOM 923 CD LYS A 68 1.921 11.548 -14.096 1.00 70.04 C ATOM 924 CE LYS A 68 1.137 12.627 -13.358 1.00 42.32 C ATOM 925 NZ LYS A 68 1.934 13.863 -13.168 1.00 74.51 N ATOM 0 H LYS A 68 -1.755 9.495 -13.874 1.00 52.11 H new ATOM 0 HA LYS A 68 0.495 7.650 -13.838 1.00 51.21 H new ATOM 0 HB2 LYS A 68 -0.010 10.344 -12.510 1.00 60.43 H new ATOM 0 HB3 LYS A 68 1.496 9.452 -12.424 1.00 60.43 H new ATOM 0 HG2 LYS A 68 1.676 9.588 -14.925 1.00 71.32 H new ATOM 0 HG3 LYS A 68 0.221 10.564 -14.950 1.00 71.32 H new ATOM 0 HD2 LYS A 68 2.804 11.282 -13.515 1.00 70.04 H new ATOM 0 HD3 LYS A 68 2.274 11.945 -15.048 1.00 70.04 H new ATOM 0 HE2 LYS A 68 0.231 12.862 -13.916 1.00 42.32 H new ATOM 0 HE3 LYS A 68 0.823 12.246 -12.386 1.00 42.32 H new ATOM 0 HZ1 LYS A 68 1.363 14.570 -12.662 1.00 74.51 H new ATOM 0 HZ2 LYS A 68 2.786 13.645 -12.613 1.00 74.51 H new ATOM 0 HZ3 LYS A 68 2.213 14.242 -14.095 1.00 74.51 H new ATOM 939 N GLY A 69 -1.712 7.292 -11.753 1.00 43.31 N ATOM 940 CA GLY A 69 -2.093 6.704 -10.500 1.00 14.43 C ATOM 941 C GLY A 69 -2.828 5.389 -10.633 1.00 1.23 C ATOM 942 O GLY A 69 -3.212 4.975 -11.739 1.00 13.50 O ATOM 0 H GLY A 69 -2.460 7.372 -12.442 1.00 43.31 H new ATOM 0 HA2 GLY A 69 -1.198 6.549 -9.897 1.00 14.43 H new ATOM 0 HA3 GLY A 69 -2.725 7.408 -9.958 1.00 14.43 H new ATOM 946 N GLU A 70 -3.027 4.751 -9.506 1.00 13.24 N ATOM 947 CA GLU A 70 -3.687 3.479 -9.403 1.00 43.22 C ATOM 948 C GLU A 70 -4.220 3.322 -7.973 1.00 33.34 C ATOM 949 O GLU A 70 -3.593 3.785 -7.009 1.00 14.23 O ATOM 950 CB GLU A 70 -2.714 2.337 -9.749 1.00 62.33 C ATOM 951 CG GLU A 70 -1.497 2.267 -8.842 1.00 21.45 C ATOM 952 CD GLU A 70 -0.542 1.175 -9.215 1.00 25.24 C ATOM 953 OE1 GLU A 70 0.321 1.400 -10.070 1.00 73.53 O ATOM 954 OE2 GLU A 70 -0.622 0.087 -8.628 1.00 14.43 O ATOM 0 H GLU A 70 -2.722 5.119 -8.605 1.00 13.24 H new ATOM 0 HA GLU A 70 -4.515 3.433 -10.110 1.00 43.22 H new ATOM 0 HB2 GLU A 70 -3.249 1.389 -9.696 1.00 62.33 H new ATOM 0 HB3 GLU A 70 -2.380 2.457 -10.780 1.00 62.33 H new ATOM 0 HG2 GLU A 70 -0.975 3.223 -8.872 1.00 21.45 H new ATOM 0 HG3 GLU A 70 -1.827 2.116 -7.814 1.00 21.45 H new ATOM 961 N VAL A 71 -5.361 2.714 -7.836 1.00 54.02 N ATOM 962 CA VAL A 71 -5.968 2.515 -6.541 1.00 62.22 C ATOM 963 C VAL A 71 -6.014 1.042 -6.220 1.00 3.25 C ATOM 964 O VAL A 71 -6.558 0.258 -6.978 1.00 23.34 O ATOM 965 CB VAL A 71 -7.409 3.103 -6.481 1.00 42.35 C ATOM 966 CG1 VAL A 71 -8.031 2.898 -5.106 1.00 63.03 C ATOM 967 CG2 VAL A 71 -7.401 4.574 -6.835 1.00 10.31 C ATOM 0 H VAL A 71 -5.902 2.340 -8.615 1.00 54.02 H new ATOM 0 HA VAL A 71 -5.358 3.040 -5.806 1.00 62.22 H new ATOM 0 HB VAL A 71 -8.015 2.569 -7.213 1.00 42.35 H new ATOM 0 HG11 VAL A 71 -9.036 3.319 -5.095 1.00 63.03 H new ATOM 0 HG12 VAL A 71 -8.081 1.832 -4.885 1.00 63.03 H new ATOM 0 HG13 VAL A 71 -7.421 3.396 -4.353 1.00 63.03 H new ATOM 0 HG21 VAL A 71 -8.417 4.965 -6.787 1.00 10.31 H new ATOM 0 HG22 VAL A 71 -6.770 5.115 -6.129 1.00 10.31 H new ATOM 0 HG23 VAL A 71 -7.010 4.703 -7.844 1.00 10.31 H new ATOM 977 N HIS A 72 -5.426 0.670 -5.117 1.00 12.33 N ATOM 978 CA HIS A 72 -5.450 -0.710 -4.681 1.00 52.22 C ATOM 979 C HIS A 72 -6.582 -0.868 -3.710 1.00 60.31 C ATOM 980 O HIS A 72 -6.582 -0.244 -2.650 1.00 62.24 O ATOM 981 CB HIS A 72 -4.122 -1.112 -4.010 1.00 74.52 C ATOM 982 CG HIS A 72 -2.928 -1.041 -4.911 1.00 22.24 C ATOM 983 ND1 HIS A 72 -2.186 -2.136 -5.268 1.00 12.32 N ATOM 984 CD2 HIS A 72 -2.327 0.015 -5.500 1.00 23.01 C ATOM 985 CE1 HIS A 72 -1.196 -1.764 -6.027 1.00 21.24 C ATOM 986 NE2 HIS A 72 -1.251 -0.466 -6.188 1.00 45.43 N ATOM 0 H HIS A 72 -4.920 1.302 -4.497 1.00 12.33 H new ATOM 0 HA HIS A 72 -5.587 -1.360 -5.546 1.00 52.22 H new ATOM 0 HB2 HIS A 72 -3.952 -0.464 -3.150 1.00 74.52 H new ATOM 0 HB3 HIS A 72 -4.215 -2.129 -3.629 1.00 74.52 H new ATOM 0 HD1 HIS A 72 -2.380 -3.096 -4.983 1.00 12.32 H new ATOM 0 HD2 HIS A 72 -2.639 1.047 -5.438 1.00 23.01 H new ATOM 0 HE1 HIS A 72 -0.451 -2.419 -6.454 1.00 21.24 H new ATOM 995 N GLY A 73 -7.538 -1.658 -4.060 1.00 63.54 N ATOM 996 CA GLY A 73 -8.666 -1.827 -3.222 1.00 31.13 C ATOM 997 C GLY A 73 -9.234 -3.193 -3.341 1.00 34.31 C ATOM 998 O GLY A 73 -8.541 -4.134 -3.721 1.00 4.41 O ATOM 0 H GLY A 73 -7.557 -2.198 -4.925 1.00 63.54 H new ATOM 0 HA2 GLY A 73 -8.382 -1.639 -2.186 1.00 31.13 H new ATOM 0 HA3 GLY A 73 -9.427 -1.092 -3.483 1.00 31.13 H new ATOM 1002 N LYS A 74 -10.479 -3.320 -3.040 1.00 30.12 N ATOM 1003 CA LYS A 74 -11.123 -4.593 -3.082 1.00 12.23 C ATOM 1004 C LYS A 74 -12.304 -4.616 -3.990 1.00 30.32 C ATOM 1005 O LYS A 74 -12.987 -3.604 -4.190 1.00 4.04 O ATOM 1006 CB LYS A 74 -11.493 -5.124 -1.692 1.00 1.41 C ATOM 1007 CG LYS A 74 -10.388 -5.921 -0.991 1.00 13.53 C ATOM 1008 CD LYS A 74 -9.166 -5.116 -0.648 1.00 41.24 C ATOM 1009 CE LYS A 74 -9.438 -4.127 0.483 1.00 11.42 C ATOM 1010 NZ LYS A 74 -8.234 -3.352 0.857 1.00 44.25 N ATOM 0 H LYS A 74 -11.082 -2.547 -2.758 1.00 30.12 H new ATOM 0 HA LYS A 74 -10.378 -5.271 -3.499 1.00 12.23 H new ATOM 0 HB2 LYS A 74 -11.770 -4.281 -1.059 1.00 1.41 H new ATOM 0 HB3 LYS A 74 -12.375 -5.757 -1.784 1.00 1.41 H new ATOM 0 HG2 LYS A 74 -10.793 -6.353 -0.076 1.00 13.53 H new ATOM 0 HG3 LYS A 74 -10.093 -6.752 -1.632 1.00 13.53 H new ATOM 0 HD2 LYS A 74 -8.358 -5.788 -0.357 1.00 41.24 H new ATOM 0 HD3 LYS A 74 -8.828 -4.574 -1.531 1.00 41.24 H new ATOM 0 HE2 LYS A 74 -10.229 -3.441 0.179 1.00 11.42 H new ATOM 0 HE3 LYS A 74 -9.804 -4.669 1.355 1.00 11.42 H new ATOM 0 HZ1 LYS A 74 -8.470 -2.695 1.628 1.00 44.25 H new ATOM 0 HZ2 LYS A 74 -7.487 -4.003 1.173 1.00 44.25 H new ATOM 0 HZ3 LYS A 74 -7.898 -2.813 0.033 1.00 44.25 H new ATOM 1024 N VAL A 75 -12.521 -5.765 -4.541 1.00 73.04 N ATOM 1025 CA VAL A 75 -13.629 -6.023 -5.418 1.00 63.01 C ATOM 1026 C VAL A 75 -14.649 -6.943 -4.772 1.00 62.13 C ATOM 1027 O VAL A 75 -14.307 -8.006 -4.259 1.00 65.12 O ATOM 1028 CB VAL A 75 -13.144 -6.653 -6.751 1.00 63.42 C ATOM 1029 CG1 VAL A 75 -14.310 -7.220 -7.556 1.00 71.00 C ATOM 1030 CG2 VAL A 75 -12.391 -5.618 -7.568 1.00 61.14 C ATOM 0 H VAL A 75 -11.920 -6.576 -4.393 1.00 73.04 H new ATOM 0 HA VAL A 75 -14.104 -5.063 -5.622 1.00 63.01 H new ATOM 0 HB VAL A 75 -12.474 -7.479 -6.513 1.00 63.42 H new ATOM 0 HG11 VAL A 75 -13.935 -7.653 -8.483 1.00 71.00 H new ATOM 0 HG12 VAL A 75 -14.814 -7.991 -6.973 1.00 71.00 H new ATOM 0 HG13 VAL A 75 -15.015 -6.421 -7.788 1.00 71.00 H new ATOM 0 HG21 VAL A 75 -12.054 -6.067 -8.502 1.00 61.14 H new ATOM 0 HG22 VAL A 75 -13.050 -4.778 -7.787 1.00 61.14 H new ATOM 0 HG23 VAL A 75 -11.528 -5.265 -7.003 1.00 61.14 H new ATOM 1040 N LEU A 76 -15.889 -6.507 -4.815 1.00 62.23 N ATOM 1041 CA LEU A 76 -17.016 -7.269 -4.351 1.00 15.41 C ATOM 1042 C LEU A 76 -17.608 -7.968 -5.556 1.00 40.54 C ATOM 1043 O LEU A 76 -18.188 -7.319 -6.432 1.00 54.05 O ATOM 1044 CB LEU A 76 -18.096 -6.343 -3.764 1.00 1.23 C ATOM 1045 CG LEU A 76 -17.699 -5.441 -2.595 1.00 15.13 C ATOM 1046 CD1 LEU A 76 -18.888 -4.607 -2.155 1.00 13.30 C ATOM 1047 CD2 LEU A 76 -17.171 -6.258 -1.439 1.00 53.22 C ATOM 0 H LEU A 76 -16.142 -5.590 -5.183 1.00 62.23 H new ATOM 0 HA LEU A 76 -16.693 -7.969 -3.580 1.00 15.41 H new ATOM 0 HB2 LEU A 76 -18.466 -5.707 -4.568 1.00 1.23 H new ATOM 0 HB3 LEU A 76 -18.931 -6.964 -3.440 1.00 1.23 H new ATOM 0 HG LEU A 76 -16.903 -4.775 -2.928 1.00 15.13 H new ATOM 0 HD11 LEU A 76 -18.596 -3.968 -1.322 1.00 13.30 H new ATOM 0 HD12 LEU A 76 -19.226 -3.988 -2.986 1.00 13.30 H new ATOM 0 HD13 LEU A 76 -19.698 -5.265 -1.840 1.00 13.30 H new ATOM 0 HD21 LEU A 76 -16.895 -5.594 -0.620 1.00 53.22 H new ATOM 0 HD22 LEU A 76 -17.942 -6.951 -1.101 1.00 53.22 H new ATOM 0 HD23 LEU A 76 -16.294 -6.820 -1.761 1.00 53.22 H new ATOM 1059 N MET A 77 -17.437 -9.246 -5.632 1.00 73.42 N ATOM 1060 CA MET A 77 -17.953 -10.005 -6.750 1.00 14.20 C ATOM 1061 C MET A 77 -19.068 -10.905 -6.331 1.00 61.14 C ATOM 1062 O MET A 77 -19.088 -11.408 -5.203 1.00 5.51 O ATOM 1063 CB MET A 77 -16.863 -10.788 -7.471 1.00 64.24 C ATOM 1064 CG MET A 77 -16.028 -11.687 -6.597 1.00 33.25 C ATOM 1065 SD MET A 77 -14.858 -12.670 -7.560 1.00 61.30 S ATOM 1066 CE MET A 77 -14.008 -11.380 -8.455 1.00 22.01 C ATOM 0 H MET A 77 -16.942 -9.801 -4.934 1.00 73.42 H new ATOM 0 HA MET A 77 -18.351 -9.280 -7.460 1.00 14.20 H new ATOM 0 HB2 MET A 77 -17.328 -11.395 -8.248 1.00 64.24 H new ATOM 0 HB3 MET A 77 -16.202 -10.081 -7.972 1.00 64.24 H new ATOM 0 HG2 MET A 77 -15.483 -11.083 -5.871 1.00 33.25 H new ATOM 0 HG3 MET A 77 -16.681 -12.352 -6.032 1.00 33.25 H new ATOM 0 HE1 MET A 77 -12.969 -11.669 -8.611 1.00 22.01 H new ATOM 0 HE2 MET A 77 -14.491 -11.228 -9.420 1.00 22.01 H new ATOM 0 HE3 MET A 77 -14.045 -10.454 -7.881 1.00 22.01 H new ATOM 1076 N GLY A 78 -20.001 -11.116 -7.222 1.00 72.03 N ATOM 1077 CA GLY A 78 -21.131 -11.905 -6.879 1.00 71.30 C ATOM 1078 C GLY A 78 -22.244 -11.056 -6.330 1.00 24.13 C ATOM 1079 O GLY A 78 -23.166 -11.566 -5.690 1.00 32.23 O ATOM 0 H GLY A 78 -19.993 -10.754 -8.175 1.00 72.03 H new ATOM 0 HA2 GLY A 78 -21.482 -12.444 -7.759 1.00 71.30 H new ATOM 0 HA3 GLY A 78 -20.844 -12.654 -6.141 1.00 71.30 H new ATOM 1083 N VAL A 79 -22.168 -9.755 -6.569 1.00 21.12 N ATOM 1084 CA VAL A 79 -23.189 -8.857 -6.094 1.00 14.40 C ATOM 1085 C VAL A 79 -24.382 -8.907 -7.051 1.00 41.14 C ATOM 1086 O VAL A 79 -24.211 -8.872 -8.290 1.00 40.50 O ATOM 1087 CB VAL A 79 -22.665 -7.379 -5.914 1.00 44.32 C ATOM 1088 CG1 VAL A 79 -22.329 -6.708 -7.220 1.00 54.34 C ATOM 1089 CG2 VAL A 79 -23.627 -6.542 -5.119 1.00 71.14 C ATOM 0 H VAL A 79 -21.411 -9.308 -7.087 1.00 21.12 H new ATOM 0 HA VAL A 79 -23.497 -9.187 -5.102 1.00 14.40 H new ATOM 0 HB VAL A 79 -21.734 -7.461 -5.352 1.00 44.32 H new ATOM 0 HG11 VAL A 79 -21.975 -5.695 -7.028 1.00 54.34 H new ATOM 0 HG12 VAL A 79 -21.550 -7.274 -7.730 1.00 54.34 H new ATOM 0 HG13 VAL A 79 -23.219 -6.668 -7.848 1.00 54.34 H new ATOM 0 HG21 VAL A 79 -23.231 -5.532 -5.016 1.00 71.14 H new ATOM 0 HG22 VAL A 79 -24.588 -6.505 -5.633 1.00 71.14 H new ATOM 0 HG23 VAL A 79 -23.761 -6.981 -4.130 1.00 71.14 H new ATOM 1099 N THR A 80 -25.559 -9.039 -6.503 1.00 64.21 N ATOM 1100 CA THR A 80 -26.746 -9.123 -7.265 1.00 11.11 C ATOM 1101 C THR A 80 -27.097 -7.714 -7.778 1.00 72.12 C ATOM 1102 O THR A 80 -26.622 -6.707 -7.222 1.00 34.14 O ATOM 1103 CB THR A 80 -27.854 -9.628 -6.348 1.00 72.21 C ATOM 1104 OG1 THR A 80 -27.293 -10.593 -5.445 1.00 43.43 O ATOM 1105 CG2 THR A 80 -28.915 -10.310 -7.144 1.00 64.33 C ATOM 0 H THR A 80 -25.708 -9.091 -5.495 1.00 64.21 H new ATOM 0 HA THR A 80 -26.626 -9.798 -8.113 1.00 11.11 H new ATOM 0 HB THR A 80 -28.284 -8.782 -5.812 1.00 72.21 H new ATOM 0 HG1 THR A 80 -27.153 -10.178 -4.568 1.00 43.43 H new ATOM 0 HG21 THR A 80 -29.699 -10.665 -6.476 1.00 64.33 H new ATOM 0 HG22 THR A 80 -29.340 -9.608 -7.861 1.00 64.33 H new ATOM 0 HG23 THR A 80 -28.482 -11.156 -7.678 1.00 64.33 H new ATOM 1113 N SER A 81 -27.907 -7.638 -8.813 1.00 73.21 N ATOM 1114 CA SER A 81 -28.289 -6.367 -9.408 1.00 65.32 C ATOM 1115 C SER A 81 -29.002 -5.427 -8.398 1.00 73.20 C ATOM 1116 O SER A 81 -28.922 -4.201 -8.521 1.00 71.22 O ATOM 1117 CB SER A 81 -29.161 -6.626 -10.631 1.00 12.21 C ATOM 1118 OG SER A 81 -28.455 -7.454 -11.552 1.00 53.22 O ATOM 0 H SER A 81 -28.321 -8.452 -9.268 1.00 73.21 H new ATOM 0 HA SER A 81 -27.380 -5.848 -9.712 1.00 65.32 H new ATOM 0 HB2 SER A 81 -30.092 -7.108 -10.332 1.00 12.21 H new ATOM 0 HB3 SER A 81 -29.429 -5.682 -11.106 1.00 12.21 H new ATOM 0 HG SER A 81 -27.490 -7.339 -11.422 1.00 53.22 H new ATOM 1124 N ASP A 82 -29.650 -6.005 -7.387 1.00 21.12 N ATOM 1125 CA ASP A 82 -30.374 -5.213 -6.376 1.00 61.31 C ATOM 1126 C ASP A 82 -29.399 -4.468 -5.474 1.00 3.53 C ATOM 1127 O ASP A 82 -29.561 -3.293 -5.212 1.00 12.03 O ATOM 1128 CB ASP A 82 -31.283 -6.094 -5.518 1.00 64.03 C ATOM 1129 CG ASP A 82 -32.275 -6.892 -6.320 1.00 45.11 C ATOM 1130 OD1 ASP A 82 -33.303 -6.335 -6.753 1.00 45.11 O ATOM 1131 OD2 ASP A 82 -32.039 -8.106 -6.528 1.00 4.22 O ATOM 0 H ASP A 82 -29.692 -7.014 -7.241 1.00 21.12 H new ATOM 0 HA ASP A 82 -30.992 -4.494 -6.914 1.00 61.31 H new ATOM 0 HB2 ASP A 82 -30.667 -6.777 -4.933 1.00 64.03 H new ATOM 0 HB3 ASP A 82 -31.822 -5.465 -4.810 1.00 64.03 H new ATOM 1136 N GLU A 83 -28.396 -5.159 -4.993 1.00 14.23 N ATOM 1137 CA GLU A 83 -27.366 -4.526 -4.183 1.00 64.53 C ATOM 1138 C GLU A 83 -26.538 -3.579 -5.069 1.00 74.24 C ATOM 1139 O GLU A 83 -26.003 -2.588 -4.603 1.00 74.22 O ATOM 1140 CB GLU A 83 -26.433 -5.558 -3.511 1.00 74.24 C ATOM 1141 CG GLU A 83 -27.091 -6.618 -2.615 1.00 71.42 C ATOM 1142 CD GLU A 83 -27.790 -7.717 -3.375 1.00 53.42 C ATOM 1143 OE1 GLU A 83 -28.948 -7.542 -3.765 1.00 23.43 O ATOM 1144 OE2 GLU A 83 -27.180 -8.787 -3.582 1.00 72.41 O ATOM 0 H GLU A 83 -28.264 -6.159 -5.144 1.00 14.23 H new ATOM 0 HA GLU A 83 -27.861 -3.970 -3.387 1.00 64.53 H new ATOM 0 HB2 GLU A 83 -25.880 -6.074 -4.295 1.00 74.24 H new ATOM 0 HB3 GLU A 83 -25.703 -5.014 -2.911 1.00 74.24 H new ATOM 0 HG2 GLU A 83 -26.328 -7.062 -1.975 1.00 71.42 H new ATOM 0 HG3 GLU A 83 -27.812 -6.128 -1.960 1.00 71.42 H new ATOM 1151 N LEU A 84 -26.446 -3.901 -6.356 1.00 2.45 N ATOM 1152 CA LEU A 84 -25.747 -3.048 -7.312 1.00 14.41 C ATOM 1153 C LEU A 84 -26.438 -1.685 -7.414 1.00 14.50 C ATOM 1154 O LEU A 84 -25.788 -0.630 -7.306 1.00 20.21 O ATOM 1155 CB LEU A 84 -25.722 -3.682 -8.695 1.00 65.44 C ATOM 1156 CG LEU A 84 -25.020 -2.863 -9.772 1.00 71.14 C ATOM 1157 CD1 LEU A 84 -23.524 -2.806 -9.552 1.00 24.40 C ATOM 1158 CD2 LEU A 84 -25.354 -3.358 -11.142 1.00 22.32 C ATOM 0 H LEU A 84 -26.847 -4.747 -6.761 1.00 2.45 H new ATOM 0 HA LEU A 84 -24.725 -2.924 -6.954 1.00 14.41 H new ATOM 0 HB2 LEU A 84 -25.233 -4.653 -8.623 1.00 65.44 H new ATOM 0 HB3 LEU A 84 -26.749 -3.865 -9.012 1.00 65.44 H new ATOM 0 HG LEU A 84 -25.394 -1.842 -9.692 1.00 71.14 H new ATOM 0 HD11 LEU A 84 -23.062 -2.213 -10.342 1.00 24.40 H new ATOM 0 HD12 LEU A 84 -23.316 -2.348 -8.585 1.00 24.40 H new ATOM 0 HD13 LEU A 84 -23.115 -3.816 -9.571 1.00 24.40 H new ATOM 0 HD21 LEU A 84 -24.836 -2.751 -11.885 1.00 22.32 H new ATOM 0 HD22 LEU A 84 -25.040 -4.397 -11.240 1.00 22.32 H new ATOM 0 HD23 LEU A 84 -26.430 -3.287 -11.302 1.00 22.32 H new ATOM 1170 N GLU A 85 -27.761 -1.707 -7.628 1.00 61.12 N ATOM 1171 CA GLU A 85 -28.538 -0.475 -7.734 1.00 55.24 C ATOM 1172 C GLU A 85 -28.531 0.249 -6.403 1.00 25.13 C ATOM 1173 O GLU A 85 -28.580 1.455 -6.354 1.00 22.32 O ATOM 1174 CB GLU A 85 -29.972 -0.735 -8.222 1.00 31.42 C ATOM 1175 CG GLU A 85 -30.768 -1.659 -7.338 1.00 0.33 C ATOM 1176 CD GLU A 85 -32.174 -1.860 -7.798 1.00 55.11 C ATOM 1177 OE1 GLU A 85 -32.392 -2.582 -8.787 1.00 53.04 O ATOM 1178 OE2 GLU A 85 -33.094 -1.327 -7.157 1.00 13.54 O ATOM 0 H GLU A 85 -28.308 -2.562 -7.730 1.00 61.12 H new ATOM 0 HA GLU A 85 -28.068 0.159 -8.485 1.00 55.24 H new ATOM 0 HB2 GLU A 85 -30.496 0.218 -8.298 1.00 31.42 H new ATOM 0 HB3 GLU A 85 -29.931 -1.157 -9.226 1.00 31.42 H new ATOM 0 HG2 GLU A 85 -30.267 -2.626 -7.293 1.00 0.33 H new ATOM 0 HG3 GLU A 85 -30.780 -1.258 -6.324 1.00 0.33 H new ATOM 1185 N ASN A 86 -28.430 -0.524 -5.334 1.00 70.00 N ATOM 1186 CA ASN A 86 -28.314 -0.013 -3.981 1.00 70.30 C ATOM 1187 C ASN A 86 -27.090 0.857 -3.863 1.00 23.22 C ATOM 1188 O ASN A 86 -27.153 1.972 -3.376 1.00 14.32 O ATOM 1189 CB ASN A 86 -28.224 -1.196 -3.029 1.00 44.41 C ATOM 1190 CG ASN A 86 -27.843 -0.859 -1.634 1.00 13.30 C ATOM 1191 OD1 ASN A 86 -26.689 -0.905 -1.289 1.00 31.35 O ATOM 1192 ND2 ASN A 86 -28.782 -0.492 -0.842 1.00 52.12 N ATOM 0 H ASN A 86 -28.426 -1.543 -5.385 1.00 70.00 H new ATOM 0 HA ASN A 86 -29.184 0.594 -3.730 1.00 70.30 H new ATOM 0 HB2 ASN A 86 -29.189 -1.703 -3.013 1.00 44.41 H new ATOM 0 HB3 ASN A 86 -27.498 -1.906 -3.425 1.00 44.41 H new ATOM 0 HD21 ASN A 86 -28.564 -0.226 0.118 1.00 52.12 H new ATOM 0 HD22 ASN A 86 -29.747 -0.466 -1.172 1.00 52.12 H new ATOM 1199 N LEU A 87 -25.992 0.346 -4.361 1.00 20.34 N ATOM 1200 CA LEU A 87 -24.732 1.047 -4.347 1.00 2.40 C ATOM 1201 C LEU A 87 -24.790 2.304 -5.203 1.00 25.50 C ATOM 1202 O LEU A 87 -24.222 3.326 -4.849 1.00 4.13 O ATOM 1203 CB LEU A 87 -23.609 0.118 -4.794 1.00 3.14 C ATOM 1204 CG LEU A 87 -23.373 -1.095 -3.891 1.00 71.31 C ATOM 1205 CD1 LEU A 87 -22.309 -2.001 -4.482 1.00 24.01 C ATOM 1206 CD2 LEU A 87 -22.959 -0.648 -2.489 1.00 11.44 C ATOM 0 H LEU A 87 -25.947 -0.577 -4.792 1.00 20.34 H new ATOM 0 HA LEU A 87 -24.525 1.365 -3.325 1.00 2.40 H new ATOM 0 HB2 LEU A 87 -23.830 -0.236 -5.801 1.00 3.14 H new ATOM 0 HB3 LEU A 87 -22.685 0.693 -4.853 1.00 3.14 H new ATOM 0 HG LEU A 87 -24.307 -1.652 -3.820 1.00 71.31 H new ATOM 0 HD11 LEU A 87 -22.155 -2.858 -3.826 1.00 24.01 H new ATOM 0 HD12 LEU A 87 -22.631 -2.349 -5.463 1.00 24.01 H new ATOM 0 HD13 LEU A 87 -21.375 -1.448 -4.582 1.00 24.01 H new ATOM 0 HD21 LEU A 87 -22.796 -1.524 -1.861 1.00 11.44 H new ATOM 0 HD22 LEU A 87 -22.038 -0.068 -2.549 1.00 11.44 H new ATOM 0 HD23 LEU A 87 -23.748 -0.033 -2.055 1.00 11.44 H new ATOM 1218 N ASP A 88 -25.495 2.231 -6.316 1.00 3.11 N ATOM 1219 CA ASP A 88 -25.649 3.402 -7.190 1.00 4.43 C ATOM 1220 C ASP A 88 -26.603 4.404 -6.558 1.00 22.34 C ATOM 1221 O ASP A 88 -26.482 5.594 -6.751 1.00 12.23 O ATOM 1222 CB ASP A 88 -26.137 2.991 -8.577 1.00 11.41 C ATOM 1223 CG ASP A 88 -26.227 4.142 -9.570 1.00 72.31 C ATOM 1224 OD1 ASP A 88 -25.234 4.429 -10.260 1.00 53.24 O ATOM 1225 OD2 ASP A 88 -27.309 4.745 -9.704 1.00 44.30 O ATOM 0 H ASP A 88 -25.969 1.389 -6.643 1.00 3.11 H new ATOM 0 HA ASP A 88 -24.674 3.874 -7.308 1.00 4.43 H new ATOM 0 HB2 ASP A 88 -25.465 2.232 -8.977 1.00 11.41 H new ATOM 0 HB3 ASP A 88 -27.120 2.529 -8.483 1.00 11.41 H new ATOM 1230 N ALA A 89 -27.545 3.910 -5.801 1.00 75.13 N ATOM 1231 CA ALA A 89 -28.485 4.749 -5.092 1.00 61.55 C ATOM 1232 C ALA A 89 -27.785 5.486 -3.957 1.00 71.12 C ATOM 1233 O ALA A 89 -27.949 6.697 -3.788 1.00 24.44 O ATOM 1234 CB ALA A 89 -29.622 3.905 -4.550 1.00 22.24 C ATOM 0 H ALA A 89 -27.686 2.910 -5.655 1.00 75.13 H new ATOM 0 HA ALA A 89 -28.891 5.487 -5.783 1.00 61.55 H new ATOM 0 HB1 ALA A 89 -30.327 4.543 -4.017 1.00 22.24 H new ATOM 0 HB2 ALA A 89 -30.133 3.410 -5.376 1.00 22.24 H new ATOM 0 HB3 ALA A 89 -29.224 3.154 -3.867 1.00 22.24 H new ATOM 1240 N VAL A 90 -26.996 4.753 -3.197 1.00 4.44 N ATOM 1241 CA VAL A 90 -26.290 5.315 -2.072 1.00 30.22 C ATOM 1242 C VAL A 90 -25.107 6.239 -2.514 1.00 3.02 C ATOM 1243 O VAL A 90 -25.017 7.386 -2.065 1.00 63.33 O ATOM 1244 CB VAL A 90 -25.854 4.203 -1.030 1.00 43.43 C ATOM 1245 CG1 VAL A 90 -24.884 3.204 -1.615 1.00 1.45 C ATOM 1246 CG2 VAL A 90 -25.325 4.802 0.259 1.00 62.13 C ATOM 0 H VAL A 90 -26.829 3.757 -3.344 1.00 4.44 H new ATOM 0 HA VAL A 90 -26.991 5.964 -1.547 1.00 30.22 H new ATOM 0 HB VAL A 90 -26.761 3.652 -0.783 1.00 43.43 H new ATOM 0 HG11 VAL A 90 -24.620 2.466 -0.857 1.00 1.45 H new ATOM 0 HG12 VAL A 90 -25.347 2.702 -2.464 1.00 1.45 H new ATOM 0 HG13 VAL A 90 -23.984 3.722 -1.946 1.00 1.45 H new ATOM 0 HG21 VAL A 90 -25.039 4.002 0.942 1.00 62.13 H new ATOM 0 HG22 VAL A 90 -24.455 5.422 0.042 1.00 62.13 H new ATOM 0 HG23 VAL A 90 -26.100 5.413 0.721 1.00 62.13 H new ATOM 1256 N GLU A 91 -24.237 5.752 -3.406 1.00 14.40 N ATOM 1257 CA GLU A 91 -23.075 6.547 -3.888 1.00 32.53 C ATOM 1258 C GLU A 91 -23.466 7.590 -4.930 1.00 43.51 C ATOM 1259 O GLU A 91 -22.849 8.657 -5.013 1.00 35.44 O ATOM 1260 CB GLU A 91 -21.966 5.646 -4.461 1.00 22.15 C ATOM 1261 CG GLU A 91 -21.295 4.746 -3.442 1.00 3.30 C ATOM 1262 CD GLU A 91 -20.575 5.531 -2.362 1.00 51.21 C ATOM 1263 OE1 GLU A 91 -21.230 5.988 -1.417 1.00 71.44 O ATOM 1264 OE2 GLU A 91 -19.343 5.706 -2.453 1.00 22.44 O ATOM 0 H GLU A 91 -24.304 4.819 -3.813 1.00 14.40 H new ATOM 0 HA GLU A 91 -22.695 7.070 -3.010 1.00 32.53 H new ATOM 0 HB2 GLU A 91 -22.391 5.026 -5.250 1.00 22.15 H new ATOM 0 HB3 GLU A 91 -21.207 6.276 -4.925 1.00 22.15 H new ATOM 0 HG2 GLU A 91 -22.044 4.102 -2.981 1.00 3.30 H new ATOM 0 HG3 GLU A 91 -20.583 4.095 -3.949 1.00 3.30 H new ATOM 1271 N GLY A 92 -24.503 7.287 -5.699 1.00 32.52 N ATOM 1272 CA GLY A 92 -24.955 8.134 -6.819 1.00 63.13 C ATOM 1273 C GLY A 92 -25.297 9.554 -6.438 1.00 50.23 C ATOM 1274 O GLY A 92 -25.395 10.427 -7.301 1.00 52.45 O ATOM 0 H GLY A 92 -25.064 6.445 -5.571 1.00 32.52 H new ATOM 0 HA2 GLY A 92 -24.174 8.154 -7.579 1.00 63.13 H new ATOM 0 HA3 GLY A 92 -25.832 7.673 -7.274 1.00 63.13 H new ATOM 1278 N ASN A 93 -25.500 9.784 -5.158 1.00 12.13 N ATOM 1279 CA ASN A 93 -25.792 11.109 -4.650 1.00 21.14 C ATOM 1280 C ASN A 93 -24.646 12.064 -4.958 1.00 11.32 C ATOM 1281 O ASN A 93 -24.876 13.228 -5.290 1.00 51.42 O ATOM 1282 CB ASN A 93 -26.036 11.090 -3.131 1.00 41.24 C ATOM 1283 CG ASN A 93 -27.227 10.249 -2.708 1.00 52.23 C ATOM 1284 OD1 ASN A 93 -28.199 10.098 -3.447 1.00 21.43 O ATOM 1285 ND2 ASN A 93 -27.169 9.713 -1.514 1.00 2.24 N ATOM 0 H ASN A 93 -25.467 9.059 -4.441 1.00 12.13 H new ATOM 0 HA ASN A 93 -26.700 11.452 -5.146 1.00 21.14 H new ATOM 0 HB2 ASN A 93 -25.142 10.712 -2.634 1.00 41.24 H new ATOM 0 HB3 ASN A 93 -26.185 12.113 -2.784 1.00 41.24 H new ATOM 0 HD21 ASN A 93 -27.946 9.149 -1.170 1.00 2.24 H new ATOM 0 HD22 ASN A 93 -26.347 9.860 -0.929 1.00 2.24 H new ATOM 1292 N GLU A 94 -23.410 11.569 -4.877 1.00 12.41 N ATOM 1293 CA GLU A 94 -22.243 12.431 -5.084 1.00 1.45 C ATOM 1294 C GLU A 94 -21.224 11.815 -6.065 1.00 35.10 C ATOM 1295 O GLU A 94 -20.279 12.474 -6.473 1.00 45.23 O ATOM 1296 CB GLU A 94 -21.574 12.721 -3.734 1.00 22.11 C ATOM 1297 CG GLU A 94 -22.525 13.325 -2.707 1.00 30.01 C ATOM 1298 CD GLU A 94 -21.894 13.532 -1.365 1.00 13.33 C ATOM 1299 OE1 GLU A 94 -21.534 12.535 -0.715 1.00 2.22 O ATOM 1300 OE2 GLU A 94 -21.746 14.697 -0.932 1.00 52.13 O ATOM 0 H GLU A 94 -23.192 10.594 -4.673 1.00 12.41 H new ATOM 0 HA GLU A 94 -22.593 13.361 -5.533 1.00 1.45 H new ATOM 0 HB2 GLU A 94 -21.160 11.795 -3.335 1.00 22.11 H new ATOM 0 HB3 GLU A 94 -20.738 13.403 -3.890 1.00 22.11 H new ATOM 0 HG2 GLU A 94 -22.891 14.281 -3.080 1.00 30.01 H new ATOM 0 HG3 GLU A 94 -23.391 12.673 -2.597 1.00 30.01 H new ATOM 1307 N TYR A 95 -21.417 10.557 -6.427 1.00 41.12 N ATOM 1308 CA TYR A 95 -20.509 9.862 -7.346 1.00 34.43 C ATOM 1309 C TYR A 95 -21.272 9.261 -8.520 1.00 12.41 C ATOM 1310 O TYR A 95 -22.502 9.225 -8.507 1.00 35.23 O ATOM 1311 CB TYR A 95 -19.699 8.772 -6.621 1.00 23.42 C ATOM 1312 CG TYR A 95 -18.698 9.301 -5.611 1.00 2.15 C ATOM 1313 CD1 TYR A 95 -19.094 9.690 -4.336 1.00 0.42 C ATOM 1314 CD2 TYR A 95 -17.355 9.407 -5.935 1.00 41.42 C ATOM 1315 CE1 TYR A 95 -18.178 10.171 -3.423 1.00 51.32 C ATOM 1316 CE2 TYR A 95 -16.435 9.882 -5.028 1.00 71.10 C ATOM 1317 CZ TYR A 95 -16.851 10.266 -3.773 1.00 72.22 C ATOM 1318 OH TYR A 95 -15.934 10.738 -2.865 1.00 40.10 O ATOM 0 H TYR A 95 -22.197 9.987 -6.100 1.00 41.12 H new ATOM 0 HA TYR A 95 -19.809 10.603 -7.731 1.00 34.43 H new ATOM 0 HB2 TYR A 95 -20.391 8.101 -6.111 1.00 23.42 H new ATOM 0 HB3 TYR A 95 -19.167 8.177 -7.364 1.00 23.42 H new ATOM 0 HD1 TYR A 95 -20.134 9.614 -4.056 1.00 0.42 H new ATOM 0 HD2 TYR A 95 -17.023 9.111 -6.919 1.00 41.42 H new ATOM 0 HE1 TYR A 95 -18.502 10.472 -2.437 1.00 51.32 H new ATOM 0 HE2 TYR A 95 -15.392 9.953 -5.299 1.00 71.10 H new ATOM 0 HH TYR A 95 -15.175 10.120 -2.816 1.00 40.10 H new ATOM 1328 N GLU A 96 -20.550 8.836 -9.541 1.00 21.50 N ATOM 1329 CA GLU A 96 -21.154 8.216 -10.707 1.00 12.14 C ATOM 1330 C GLU A 96 -20.541 6.835 -10.923 1.00 13.45 C ATOM 1331 O GLU A 96 -19.365 6.623 -10.623 1.00 2.32 O ATOM 1332 CB GLU A 96 -20.910 9.100 -11.932 1.00 40.20 C ATOM 1333 CG GLU A 96 -21.519 8.585 -13.222 1.00 23.01 C ATOM 1334 CD GLU A 96 -21.228 9.484 -14.391 1.00 21.25 C ATOM 1335 OE1 GLU A 96 -21.971 10.461 -14.596 1.00 11.13 O ATOM 1336 OE2 GLU A 96 -20.258 9.223 -15.139 1.00 43.44 O ATOM 0 H GLU A 96 -19.534 8.910 -9.586 1.00 21.50 H new ATOM 0 HA GLU A 96 -22.228 8.106 -10.554 1.00 12.14 H new ATOM 0 HB2 GLU A 96 -21.309 10.094 -11.730 1.00 40.20 H new ATOM 0 HB3 GLU A 96 -19.835 9.211 -12.074 1.00 40.20 H new ATOM 0 HG2 GLU A 96 -21.133 7.587 -13.430 1.00 23.01 H new ATOM 0 HG3 GLU A 96 -22.598 8.491 -13.099 1.00 23.01 H new ATOM 1343 N ARG A 97 -21.341 5.904 -11.416 1.00 52.41 N ATOM 1344 CA ARG A 97 -20.882 4.549 -11.664 1.00 52.22 C ATOM 1345 C ARG A 97 -20.316 4.418 -13.071 1.00 1.31 C ATOM 1346 O ARG A 97 -20.967 4.795 -14.052 1.00 3.21 O ATOM 1347 CB ARG A 97 -22.020 3.531 -11.538 1.00 2.54 C ATOM 1348 CG ARG A 97 -21.536 2.094 -11.731 1.00 14.41 C ATOM 1349 CD ARG A 97 -22.669 1.116 -11.970 1.00 15.23 C ATOM 1350 NE ARG A 97 -23.617 0.996 -10.865 1.00 13.12 N ATOM 1351 CZ ARG A 97 -24.850 0.502 -11.027 1.00 71.43 C ATOM 1352 NH1 ARG A 97 -25.290 0.195 -12.240 1.00 41.24 N ATOM 1353 NH2 ARG A 97 -25.638 0.313 -9.988 1.00 54.01 N ATOM 0 H ARG A 97 -22.320 6.065 -11.654 1.00 52.41 H new ATOM 0 HA ARG A 97 -20.116 4.345 -10.916 1.00 52.22 H new ATOM 0 HB2 ARG A 97 -22.484 3.627 -10.556 1.00 2.54 H new ATOM 0 HB3 ARG A 97 -22.789 3.756 -12.277 1.00 2.54 H new ATOM 0 HG2 ARG A 97 -20.848 2.058 -12.576 1.00 14.41 H new ATOM 0 HG3 ARG A 97 -20.975 1.784 -10.850 1.00 14.41 H new ATOM 0 HD2 ARG A 97 -23.212 1.422 -12.864 1.00 15.23 H new ATOM 0 HD3 ARG A 97 -22.245 0.133 -12.175 1.00 15.23 H new ATOM 0 HE ARG A 97 -23.328 1.300 -9.935 1.00 13.12 H new ATOM 0 HH11 ARG A 97 -24.688 0.335 -13.051 1.00 41.24 H new ATOM 0 HH12 ARG A 97 -26.230 -0.181 -12.361 1.00 41.24 H new ATOM 0 HH21 ARG A 97 -25.310 0.544 -9.050 1.00 54.01 H new ATOM 0 HH22 ARG A 97 -26.576 -0.064 -10.121 1.00 54.01 H new ATOM 1367 N VAL A 98 -19.132 3.885 -13.160 1.00 41.31 N ATOM 1368 CA VAL A 98 -18.506 3.565 -14.424 1.00 63.42 C ATOM 1369 C VAL A 98 -17.930 2.210 -14.411 1.00 24.33 C ATOM 1370 O VAL A 98 -17.718 1.612 -13.346 1.00 61.41 O ATOM 1371 CB VAL A 98 -17.449 4.557 -14.911 1.00 33.25 C ATOM 1372 CG1 VAL A 98 -18.099 5.827 -15.369 1.00 70.12 C ATOM 1373 CG2 VAL A 98 -16.404 4.813 -13.834 1.00 20.02 C ATOM 0 H VAL A 98 -18.560 3.654 -12.348 1.00 41.31 H new ATOM 0 HA VAL A 98 -19.327 3.629 -15.138 1.00 63.42 H new ATOM 0 HB VAL A 98 -16.929 4.122 -15.765 1.00 33.25 H new ATOM 0 HG11 VAL A 98 -17.334 6.524 -15.713 1.00 70.12 H new ATOM 0 HG12 VAL A 98 -18.786 5.610 -16.187 1.00 70.12 H new ATOM 0 HG13 VAL A 98 -18.650 6.273 -14.541 1.00 70.12 H new ATOM 0 HG21 VAL A 98 -15.664 5.522 -14.206 1.00 20.02 H new ATOM 0 HG22 VAL A 98 -16.888 5.225 -12.948 1.00 20.02 H new ATOM 0 HG23 VAL A 98 -15.911 3.876 -13.576 1.00 20.02 H new ATOM 1383 N THR A 99 -17.680 1.720 -15.562 1.00 71.11 N ATOM 1384 CA THR A 99 -17.146 0.403 -15.705 1.00 65.43 C ATOM 1385 C THR A 99 -15.649 0.523 -16.036 1.00 31.33 C ATOM 1386 O THR A 99 -15.251 1.224 -16.980 1.00 41.01 O ATOM 1387 CB THR A 99 -17.956 -0.458 -16.749 1.00 32.20 C ATOM 1388 OG1 THR A 99 -17.550 -1.833 -16.721 1.00 42.34 O ATOM 1389 CG2 THR A 99 -17.834 0.077 -18.170 1.00 51.34 C ATOM 0 H THR A 99 -17.836 2.213 -16.441 1.00 71.11 H new ATOM 0 HA THR A 99 -17.250 -0.145 -14.768 1.00 65.43 H new ATOM 0 HB THR A 99 -19.001 -0.384 -16.449 1.00 32.20 H new ATOM 0 HG1 THR A 99 -17.815 -2.269 -17.557 1.00 42.34 H new ATOM 0 HG21 THR A 99 -18.411 -0.553 -18.847 1.00 51.34 H new ATOM 0 HG22 THR A 99 -18.217 1.097 -18.209 1.00 51.34 H new ATOM 0 HG23 THR A 99 -16.787 0.071 -18.472 1.00 51.34 H new ATOM 1397 N VAL A 100 -14.832 -0.101 -15.238 1.00 12.34 N ATOM 1398 CA VAL A 100 -13.394 0.036 -15.353 1.00 61.42 C ATOM 1399 C VAL A 100 -12.703 -1.318 -15.322 1.00 43.35 C ATOM 1400 O VAL A 100 -13.312 -2.333 -14.947 1.00 62.43 O ATOM 1401 CB VAL A 100 -12.824 0.927 -14.211 1.00 35.33 C ATOM 1402 CG1 VAL A 100 -13.351 2.360 -14.308 1.00 63.33 C ATOM 1403 CG2 VAL A 100 -13.173 0.328 -12.853 1.00 2.03 C ATOM 0 H VAL A 100 -15.135 -0.721 -14.487 1.00 12.34 H new ATOM 0 HA VAL A 100 -13.196 0.512 -16.314 1.00 61.42 H new ATOM 0 HB VAL A 100 -11.740 0.960 -14.319 1.00 35.33 H new ATOM 0 HG11 VAL A 100 -12.934 2.957 -13.496 1.00 63.33 H new ATOM 0 HG12 VAL A 100 -13.056 2.792 -15.264 1.00 63.33 H new ATOM 0 HG13 VAL A 100 -14.438 2.354 -14.232 1.00 63.33 H new ATOM 0 HG21 VAL A 100 -12.769 0.960 -12.062 1.00 2.03 H new ATOM 0 HG22 VAL A 100 -14.256 0.266 -12.750 1.00 2.03 H new ATOM 0 HG23 VAL A 100 -12.743 -0.671 -12.775 1.00 2.03 H new ATOM 1413 N GLY A 101 -11.457 -1.332 -15.715 1.00 61.51 N ATOM 1414 CA GLY A 101 -10.688 -2.539 -15.705 1.00 5.01 C ATOM 1415 C GLY A 101 -9.736 -2.562 -14.539 1.00 41.34 C ATOM 1416 O GLY A 101 -8.929 -1.647 -14.368 1.00 53.21 O ATOM 0 H GLY A 101 -10.953 -0.510 -16.048 1.00 61.51 H new ATOM 0 HA2 GLY A 101 -11.355 -3.399 -15.651 1.00 5.01 H new ATOM 0 HA3 GLY A 101 -10.130 -2.626 -16.637 1.00 5.01 H new ATOM 1420 N ILE A 102 -9.837 -3.583 -13.733 1.00 5.13 N ATOM 1421 CA ILE A 102 -8.988 -3.730 -12.576 1.00 22.22 C ATOM 1422 C ILE A 102 -8.143 -4.974 -12.703 1.00 65.30 C ATOM 1423 O ILE A 102 -8.409 -5.825 -13.560 1.00 55.02 O ATOM 1424 CB ILE A 102 -9.797 -3.697 -11.221 1.00 40.10 C ATOM 1425 CG1 ILE A 102 -10.921 -4.738 -11.147 1.00 11.20 C ATOM 1426 CG2 ILE A 102 -10.370 -2.333 -10.972 1.00 23.33 C ATOM 1427 CD1 ILE A 102 -10.499 -6.147 -10.864 1.00 70.52 C ATOM 0 H ILE A 102 -10.510 -4.339 -13.857 1.00 5.13 H new ATOM 0 HA ILE A 102 -8.323 -2.867 -12.542 1.00 22.22 H new ATOM 0 HB ILE A 102 -9.073 -3.949 -10.446 1.00 40.10 H new ATOM 0 HG12 ILE A 102 -11.624 -4.429 -10.373 1.00 11.20 H new ATOM 0 HG13 ILE A 102 -11.462 -4.726 -12.093 1.00 11.20 H new ATOM 0 HG21 ILE A 102 -10.923 -2.336 -10.033 1.00 23.33 H new ATOM 0 HG22 ILE A 102 -9.562 -1.604 -10.915 1.00 23.33 H new ATOM 0 HG23 ILE A 102 -11.042 -2.066 -11.787 1.00 23.33 H new ATOM 0 HD11 ILE A 102 -11.378 -6.791 -10.835 1.00 70.52 H new ATOM 0 HD12 ILE A 102 -9.824 -6.489 -11.648 1.00 70.52 H new ATOM 0 HD13 ILE A 102 -9.988 -6.188 -9.902 1.00 70.52 H new ATOM 1439 N VAL A 103 -7.129 -5.082 -11.896 1.00 23.01 N ATOM 1440 CA VAL A 103 -6.259 -6.227 -11.933 1.00 30.12 C ATOM 1441 C VAL A 103 -6.123 -6.807 -10.537 1.00 2.21 C ATOM 1442 O VAL A 103 -5.792 -6.095 -9.594 1.00 54.53 O ATOM 1443 CB VAL A 103 -4.861 -5.869 -12.511 1.00 53.14 C ATOM 1444 CG1 VAL A 103 -3.942 -7.071 -12.528 1.00 24.00 C ATOM 1445 CG2 VAL A 103 -4.977 -5.281 -13.910 1.00 10.32 C ATOM 0 H VAL A 103 -6.880 -4.384 -11.195 1.00 23.01 H new ATOM 0 HA VAL A 103 -6.702 -6.971 -12.595 1.00 30.12 H new ATOM 0 HB VAL A 103 -4.427 -5.117 -11.853 1.00 53.14 H new ATOM 0 HG11 VAL A 103 -2.974 -6.783 -12.938 1.00 24.00 H new ATOM 0 HG12 VAL A 103 -3.809 -7.442 -11.512 1.00 24.00 H new ATOM 0 HG13 VAL A 103 -4.380 -7.855 -13.146 1.00 24.00 H new ATOM 0 HG21 VAL A 103 -3.983 -5.041 -14.287 1.00 10.32 H new ATOM 0 HG22 VAL A 103 -5.451 -6.006 -14.571 1.00 10.32 H new ATOM 0 HG23 VAL A 103 -5.581 -4.374 -13.875 1.00 10.32 H new ATOM 1455 N ARG A 104 -6.404 -8.079 -10.424 1.00 62.30 N ATOM 1456 CA ARG A 104 -6.369 -8.820 -9.172 1.00 44.22 C ATOM 1457 C ARG A 104 -4.953 -8.897 -8.595 1.00 61.34 C ATOM 1458 O ARG A 104 -4.022 -9.309 -9.277 1.00 1.23 O ATOM 1459 CB ARG A 104 -6.919 -10.231 -9.404 1.00 32.12 C ATOM 1460 CG ARG A 104 -8.406 -10.291 -9.732 1.00 74.30 C ATOM 1461 CD ARG A 104 -8.857 -11.713 -10.101 1.00 43.41 C ATOM 1462 NE ARG A 104 -8.535 -12.718 -9.066 1.00 10.15 N ATOM 1463 CZ ARG A 104 -9.194 -13.883 -8.887 1.00 33.31 C ATOM 1464 NH1 ARG A 104 -10.249 -14.198 -9.645 1.00 5.42 N ATOM 1465 NH2 ARG A 104 -8.783 -14.731 -7.962 1.00 52.43 N ATOM 0 H ARG A 104 -6.673 -8.654 -11.222 1.00 62.30 H new ATOM 0 HA ARG A 104 -6.988 -8.292 -8.447 1.00 44.22 H new ATOM 0 HB2 ARG A 104 -6.362 -10.693 -10.219 1.00 32.12 H new ATOM 0 HB3 ARG A 104 -6.734 -10.829 -8.512 1.00 32.12 H new ATOM 0 HG2 ARG A 104 -8.981 -9.939 -8.875 1.00 74.30 H new ATOM 0 HG3 ARG A 104 -8.622 -9.616 -10.560 1.00 74.30 H new ATOM 0 HD2 ARG A 104 -9.933 -11.712 -10.273 1.00 43.41 H new ATOM 0 HD3 ARG A 104 -8.384 -12.004 -11.039 1.00 43.41 H new ATOM 0 HE ARG A 104 -7.756 -12.516 -8.439 1.00 10.15 H new ATOM 0 HH11 ARG A 104 -10.566 -13.555 -10.370 1.00 5.42 H new ATOM 0 HH12 ARG A 104 -10.737 -15.082 -9.498 1.00 5.42 H new ATOM 0 HH21 ARG A 104 -7.972 -14.505 -7.387 1.00 52.43 H new ATOM 0 HH22 ARG A 104 -9.277 -15.612 -7.822 1.00 52.43 H new ATOM 1479 N GLU A 105 -4.819 -8.531 -7.334 1.00 13.10 N ATOM 1480 CA GLU A 105 -3.529 -8.530 -6.620 1.00 24.41 C ATOM 1481 C GLU A 105 -3.060 -9.954 -6.339 1.00 32.41 C ATOM 1482 O GLU A 105 -1.879 -10.190 -6.065 1.00 4.14 O ATOM 1483 CB GLU A 105 -3.684 -7.812 -5.272 1.00 60.02 C ATOM 1484 CG GLU A 105 -4.069 -6.349 -5.351 1.00 53.34 C ATOM 1485 CD GLU A 105 -2.970 -5.483 -5.889 1.00 3.23 C ATOM 1486 OE1 GLU A 105 -2.760 -5.461 -7.103 1.00 43.13 O ATOM 1487 OE2 GLU A 105 -2.295 -4.789 -5.085 1.00 42.22 O ATOM 0 H GLU A 105 -5.603 -8.221 -6.759 1.00 13.10 H new ATOM 0 HA GLU A 105 -2.800 -8.021 -7.251 1.00 24.41 H new ATOM 0 HB2 GLU A 105 -4.438 -8.337 -4.686 1.00 60.02 H new ATOM 0 HB3 GLU A 105 -2.743 -7.893 -4.727 1.00 60.02 H new ATOM 0 HG2 GLU A 105 -4.950 -6.244 -5.984 1.00 53.34 H new ATOM 0 HG3 GLU A 105 -4.347 -5.998 -4.357 1.00 53.34 H new ATOM 1494 N ASP A 106 -3.984 -10.893 -6.404 1.00 23.00 N ATOM 1495 CA ASP A 106 -3.700 -12.269 -6.031 1.00 41.44 C ATOM 1496 C ASP A 106 -2.945 -13.025 -7.132 1.00 31.11 C ATOM 1497 O ASP A 106 -2.013 -13.766 -6.841 1.00 25.42 O ATOM 1498 CB ASP A 106 -4.990 -13.016 -5.637 1.00 42.24 C ATOM 1499 CG ASP A 106 -5.885 -13.360 -6.808 1.00 74.21 C ATOM 1500 OD1 ASP A 106 -6.191 -12.472 -7.628 1.00 41.33 O ATOM 1501 OD2 ASP A 106 -6.297 -14.529 -6.924 1.00 24.40 O ATOM 0 H ASP A 106 -4.942 -10.729 -6.713 1.00 23.00 H new ATOM 0 HA ASP A 106 -3.046 -12.232 -5.160 1.00 41.44 H new ATOM 0 HB2 ASP A 106 -4.721 -13.935 -5.117 1.00 42.24 H new ATOM 0 HB3 ASP A 106 -5.551 -12.403 -4.932 1.00 42.24 H new ATOM 1506 N ASN A 107 -3.330 -12.832 -8.392 1.00 30.13 N ATOM 1507 CA ASN A 107 -2.639 -13.540 -9.487 1.00 73.31 C ATOM 1508 C ASN A 107 -2.502 -12.699 -10.755 1.00 21.03 C ATOM 1509 O ASN A 107 -2.212 -13.226 -11.825 1.00 53.01 O ATOM 1510 CB ASN A 107 -3.251 -14.937 -9.812 1.00 13.12 C ATOM 1511 CG ASN A 107 -4.666 -14.955 -10.405 1.00 12.22 C ATOM 1512 OD1 ASN A 107 -4.965 -15.805 -11.240 1.00 22.45 O ATOM 1513 ND2 ASN A 107 -5.563 -14.112 -9.940 1.00 72.12 N ATOM 0 H ASN A 107 -4.089 -12.215 -8.682 1.00 30.13 H new ATOM 0 HA ASN A 107 -1.635 -13.715 -9.101 1.00 73.31 H new ATOM 0 HB2 ASN A 107 -2.585 -15.445 -10.509 1.00 13.12 H new ATOM 0 HB3 ASN A 107 -3.261 -15.525 -8.894 1.00 13.12 H new ATOM 0 HD21 ASN A 107 -6.526 -14.157 -10.273 1.00 72.12 H new ATOM 0 HD22 ASN A 107 -5.295 -13.413 -9.247 1.00 72.12 H new ATOM 1520 N SER A 108 -2.691 -11.392 -10.618 1.00 54.01 N ATOM 1521 CA SER A 108 -2.494 -10.414 -11.711 1.00 74.32 C ATOM 1522 C SER A 108 -3.522 -10.535 -12.853 1.00 34.50 C ATOM 1523 O SER A 108 -3.335 -9.953 -13.918 1.00 31.40 O ATOM 1524 CB SER A 108 -1.065 -10.484 -12.255 1.00 11.11 C ATOM 1525 OG SER A 108 -0.116 -10.265 -11.218 1.00 0.24 O ATOM 0 H SER A 108 -2.988 -10.965 -9.741 1.00 54.01 H new ATOM 0 HA SER A 108 -2.661 -9.434 -11.264 1.00 74.32 H new ATOM 0 HB2 SER A 108 -0.893 -11.459 -12.711 1.00 11.11 H new ATOM 0 HB3 SER A 108 -0.933 -9.738 -13.038 1.00 11.11 H new ATOM 0 HG SER A 108 0.627 -10.897 -11.315 1.00 0.24 H new ATOM 1531 N GLU A 109 -4.607 -11.249 -12.627 1.00 42.22 N ATOM 1532 CA GLU A 109 -5.658 -11.358 -13.634 1.00 1.14 C ATOM 1533 C GLU A 109 -6.479 -10.087 -13.698 1.00 61.31 C ATOM 1534 O GLU A 109 -6.709 -9.439 -12.686 1.00 4.15 O ATOM 1535 CB GLU A 109 -6.561 -12.544 -13.368 1.00 21.50 C ATOM 1536 CG GLU A 109 -5.885 -13.879 -13.542 1.00 32.44 C ATOM 1537 CD GLU A 109 -5.404 -14.089 -14.955 1.00 1.13 C ATOM 1538 OE1 GLU A 109 -6.238 -14.361 -15.842 1.00 22.31 O ATOM 1539 OE2 GLU A 109 -4.189 -13.986 -15.207 1.00 25.30 O ATOM 0 H GLU A 109 -4.789 -11.761 -11.764 1.00 42.22 H new ATOM 0 HA GLU A 109 -5.169 -11.511 -14.596 1.00 1.14 H new ATOM 0 HB2 GLU A 109 -6.947 -12.473 -12.351 1.00 21.50 H new ATOM 0 HB3 GLU A 109 -7.419 -12.492 -14.039 1.00 21.50 H new ATOM 0 HG2 GLU A 109 -5.040 -13.949 -12.857 1.00 32.44 H new ATOM 0 HG3 GLU A 109 -6.580 -14.675 -13.274 1.00 32.44 H new ATOM 1546 N LYS A 110 -6.923 -9.754 -14.864 1.00 40.11 N ATOM 1547 CA LYS A 110 -7.677 -8.538 -15.077 1.00 31.11 C ATOM 1548 C LYS A 110 -9.163 -8.841 -15.052 1.00 73.11 C ATOM 1549 O LYS A 110 -9.585 -9.927 -15.438 1.00 3.45 O ATOM 1550 CB LYS A 110 -7.312 -7.898 -16.419 1.00 51.52 C ATOM 1551 CG LYS A 110 -7.598 -8.776 -17.628 1.00 53.23 C ATOM 1552 CD LYS A 110 -7.249 -8.088 -18.945 1.00 24.41 C ATOM 1553 CE LYS A 110 -8.106 -6.846 -19.179 1.00 33.04 C ATOM 1554 NZ LYS A 110 -7.777 -6.177 -20.454 1.00 53.21 N ATOM 0 H LYS A 110 -6.779 -10.311 -15.706 1.00 40.11 H new ATOM 0 HA LYS A 110 -7.430 -7.840 -14.277 1.00 31.11 H new ATOM 0 HB2 LYS A 110 -7.863 -6.963 -16.525 1.00 51.52 H new ATOM 0 HB3 LYS A 110 -6.252 -7.644 -16.411 1.00 51.52 H new ATOM 0 HG2 LYS A 110 -7.029 -9.702 -17.543 1.00 53.23 H new ATOM 0 HG3 LYS A 110 -8.653 -9.050 -17.633 1.00 53.23 H new ATOM 0 HD2 LYS A 110 -6.196 -7.808 -18.941 1.00 24.41 H new ATOM 0 HD3 LYS A 110 -7.389 -8.787 -19.769 1.00 24.41 H new ATOM 0 HE2 LYS A 110 -9.159 -7.127 -19.179 1.00 33.04 H new ATOM 0 HE3 LYS A 110 -7.963 -6.147 -18.355 1.00 33.04 H new ATOM 0 HZ1 LYS A 110 -8.382 -5.339 -20.573 1.00 53.21 H new ATOM 0 HZ2 LYS A 110 -6.779 -5.885 -20.445 1.00 53.21 H new ATOM 0 HZ3 LYS A 110 -7.938 -6.835 -21.243 1.00 53.21 H new ATOM 1568 N MET A 111 -9.932 -7.907 -14.592 1.00 72.03 N ATOM 1569 CA MET A 111 -11.382 -8.036 -14.537 1.00 11.00 C ATOM 1570 C MET A 111 -12.022 -6.732 -14.783 1.00 14.21 C ATOM 1571 O MET A 111 -11.391 -5.677 -14.673 1.00 74.11 O ATOM 1572 CB MET A 111 -11.925 -8.560 -13.225 1.00 4.33 C ATOM 1573 CG MET A 111 -11.450 -9.913 -12.823 1.00 61.11 C ATOM 1574 SD MET A 111 -12.298 -10.523 -11.358 1.00 73.41 S ATOM 1575 CE MET A 111 -12.211 -9.096 -10.307 1.00 52.23 C ATOM 0 H MET A 111 -9.583 -7.017 -14.236 1.00 72.03 H new ATOM 0 HA MET A 111 -11.618 -8.768 -15.309 1.00 11.00 H new ATOM 0 HB2 MET A 111 -11.663 -7.854 -12.437 1.00 4.33 H new ATOM 0 HB3 MET A 111 -13.013 -8.580 -13.286 1.00 4.33 H new ATOM 0 HG2 MET A 111 -11.604 -10.610 -13.647 1.00 61.11 H new ATOM 0 HG3 MET A 111 -10.377 -9.878 -12.632 1.00 61.11 H new ATOM 0 HE1 MET A 111 -12.394 -9.393 -9.274 1.00 52.23 H new ATOM 0 HE2 MET A 111 -11.221 -8.647 -10.385 1.00 52.23 H new ATOM 0 HE3 MET A 111 -12.964 -8.371 -10.615 1.00 52.23 H new ATOM 1585 N ALA A 112 -13.257 -6.803 -15.087 1.00 1.32 N ATOM 1586 CA ALA A 112 -14.052 -5.641 -15.377 1.00 2.21 C ATOM 1587 C ALA A 112 -15.008 -5.424 -14.240 1.00 30.02 C ATOM 1588 O ALA A 112 -15.784 -6.324 -13.891 1.00 73.50 O ATOM 1589 CB ALA A 112 -14.805 -5.814 -16.677 1.00 75.42 C ATOM 0 H ALA A 112 -13.771 -7.682 -15.147 1.00 1.32 H new ATOM 0 HA ALA A 112 -13.403 -4.772 -15.488 1.00 2.21 H new ATOM 0 HB1 ALA A 112 -15.399 -4.922 -16.875 1.00 75.42 H new ATOM 0 HB2 ALA A 112 -14.096 -5.965 -17.491 1.00 75.42 H new ATOM 0 HB3 ALA A 112 -15.463 -6.680 -16.604 1.00 75.42 H new ATOM 1595 N VAL A 113 -14.955 -4.265 -13.645 1.00 44.03 N ATOM 1596 CA VAL A 113 -15.782 -3.987 -12.496 1.00 34.10 C ATOM 1597 C VAL A 113 -16.469 -2.647 -12.621 1.00 54.42 C ATOM 1598 O VAL A 113 -16.159 -1.847 -13.515 1.00 64.24 O ATOM 1599 CB VAL A 113 -14.964 -3.995 -11.174 1.00 25.21 C ATOM 1600 CG1 VAL A 113 -14.316 -5.343 -10.925 1.00 2.23 C ATOM 1601 CG2 VAL A 113 -13.920 -2.895 -11.187 1.00 54.41 C ATOM 0 H VAL A 113 -14.350 -3.496 -13.933 1.00 44.03 H new ATOM 0 HA VAL A 113 -16.526 -4.783 -12.463 1.00 34.10 H new ATOM 0 HB VAL A 113 -15.659 -3.808 -10.355 1.00 25.21 H new ATOM 0 HG11 VAL A 113 -13.753 -5.309 -9.992 1.00 2.23 H new ATOM 0 HG12 VAL A 113 -15.087 -6.110 -10.856 1.00 2.23 H new ATOM 0 HG13 VAL A 113 -13.641 -5.580 -11.748 1.00 2.23 H new ATOM 0 HG21 VAL A 113 -13.357 -2.916 -10.254 1.00 54.41 H new ATOM 0 HG22 VAL A 113 -13.240 -3.049 -12.024 1.00 54.41 H new ATOM 0 HG23 VAL A 113 -14.412 -1.928 -11.292 1.00 54.41 H new ATOM 1611 N LYS A 114 -17.392 -2.409 -11.735 1.00 34.34 N ATOM 1612 CA LYS A 114 -18.082 -1.156 -11.665 1.00 44.51 C ATOM 1613 C LYS A 114 -17.514 -0.380 -10.487 1.00 52.13 C ATOM 1614 O LYS A 114 -17.318 -0.945 -9.411 1.00 4.51 O ATOM 1615 CB LYS A 114 -19.589 -1.389 -11.444 1.00 62.55 C ATOM 1616 CG LYS A 114 -20.245 -2.338 -12.445 1.00 42.31 C ATOM 1617 CD LYS A 114 -20.083 -1.861 -13.876 1.00 73.03 C ATOM 1618 CE LYS A 114 -20.729 -2.837 -14.847 1.00 21.12 C ATOM 1619 NZ LYS A 114 -20.528 -2.440 -16.255 1.00 45.33 N ATOM 0 H LYS A 114 -17.689 -3.087 -11.034 1.00 34.34 H new ATOM 0 HA LYS A 114 -17.951 -0.604 -12.596 1.00 44.51 H new ATOM 0 HB2 LYS A 114 -19.737 -1.784 -10.439 1.00 62.55 H new ATOM 0 HB3 LYS A 114 -20.101 -0.428 -11.487 1.00 62.55 H new ATOM 0 HG2 LYS A 114 -19.807 -3.331 -12.343 1.00 42.31 H new ATOM 0 HG3 LYS A 114 -21.306 -2.432 -12.213 1.00 42.31 H new ATOM 0 HD2 LYS A 114 -20.535 -0.876 -13.989 1.00 73.03 H new ATOM 0 HD3 LYS A 114 -19.024 -1.755 -14.111 1.00 73.03 H new ATOM 0 HE2 LYS A 114 -20.313 -3.832 -14.689 1.00 21.12 H new ATOM 0 HE3 LYS A 114 -21.797 -2.901 -14.638 1.00 21.12 H new ATOM 0 HZ1 LYS A 114 -21.042 -3.096 -16.877 1.00 45.33 H new ATOM 0 HZ2 LYS A 114 -20.887 -1.474 -16.398 1.00 45.33 H new ATOM 0 HZ3 LYS A 114 -19.514 -2.470 -16.483 1.00 45.33 H new ATOM 1633 N THR A 115 -17.227 0.870 -10.681 1.00 25.35 N ATOM 1634 CA THR A 115 -16.714 1.687 -9.615 1.00 51.23 C ATOM 1635 C THR A 115 -17.427 3.027 -9.638 1.00 41.34 C ATOM 1636 O THR A 115 -18.180 3.316 -10.576 1.00 73.43 O ATOM 1637 CB THR A 115 -15.170 1.908 -9.736 1.00 40.44 C ATOM 1638 OG1 THR A 115 -14.668 2.579 -8.564 1.00 75.23 O ATOM 1639 CG2 THR A 115 -14.849 2.768 -10.951 1.00 41.52 C ATOM 0 H THR A 115 -17.339 1.353 -11.572 1.00 25.35 H new ATOM 0 HA THR A 115 -16.895 1.172 -8.672 1.00 51.23 H new ATOM 0 HB THR A 115 -14.700 0.930 -9.838 1.00 40.44 H new ATOM 0 HG1 THR A 115 -13.739 2.852 -8.716 1.00 75.23 H new ATOM 0 HG21 THR A 115 -13.771 2.912 -11.020 1.00 41.52 H new ATOM 0 HG22 THR A 115 -15.208 2.272 -11.853 1.00 41.52 H new ATOM 0 HG23 THR A 115 -15.339 3.737 -10.851 1.00 41.52 H new ATOM 1647 N TYR A 116 -17.205 3.817 -8.626 1.00 31.42 N ATOM 1648 CA TYR A 116 -17.801 5.116 -8.518 1.00 12.01 C ATOM 1649 C TYR A 116 -16.697 6.155 -8.416 1.00 55.33 C ATOM 1650 O TYR A 116 -15.798 6.033 -7.579 1.00 41.13 O ATOM 1651 CB TYR A 116 -18.753 5.151 -7.310 1.00 54.55 C ATOM 1652 CG TYR A 116 -19.876 4.138 -7.434 1.00 44.10 C ATOM 1653 CD1 TYR A 116 -19.685 2.809 -7.057 1.00 53.31 C ATOM 1654 CD2 TYR A 116 -21.106 4.498 -7.958 1.00 51.32 C ATOM 1655 CE1 TYR A 116 -20.695 1.873 -7.198 1.00 10.14 C ATOM 1656 CE2 TYR A 116 -22.117 3.567 -8.109 1.00 74.54 C ATOM 1657 CZ TYR A 116 -21.909 2.258 -7.727 1.00 70.15 C ATOM 1658 OH TYR A 116 -22.914 1.320 -7.901 1.00 72.03 O ATOM 0 H TYR A 116 -16.597 3.573 -7.844 1.00 31.42 H new ATOM 0 HA TYR A 116 -18.397 5.343 -9.402 1.00 12.01 H new ATOM 0 HB2 TYR A 116 -18.188 4.954 -6.399 1.00 54.55 H new ATOM 0 HB3 TYR A 116 -19.177 6.150 -7.213 1.00 54.55 H new ATOM 0 HD1 TYR A 116 -18.733 2.505 -6.648 1.00 53.31 H new ATOM 0 HD2 TYR A 116 -21.278 5.522 -8.253 1.00 51.32 H new ATOM 0 HE1 TYR A 116 -20.533 0.849 -6.896 1.00 10.14 H new ATOM 0 HE2 TYR A 116 -23.068 3.864 -8.525 1.00 74.54 H new ATOM 0 HH TYR A 116 -22.598 0.442 -7.601 1.00 72.03 H new ATOM 1668 N MET A 117 -16.738 7.138 -9.289 1.00 61.42 N ATOM 1669 CA MET A 117 -15.708 8.157 -9.350 1.00 4.31 C ATOM 1670 C MET A 117 -16.345 9.550 -9.363 1.00 51.24 C ATOM 1671 O MET A 117 -17.534 9.693 -9.686 1.00 3.35 O ATOM 1672 CB MET A 117 -14.744 7.952 -10.553 1.00 53.14 C ATOM 1673 CG MET A 117 -15.217 8.464 -11.904 1.00 63.34 C ATOM 1674 SD MET A 117 -16.797 7.825 -12.418 1.00 74.44 S ATOM 1675 CE MET A 117 -16.857 8.487 -14.070 1.00 61.31 C ATOM 0 H MET A 117 -17.483 7.255 -9.976 1.00 61.42 H new ATOM 0 HA MET A 117 -15.095 8.066 -8.454 1.00 4.31 H new ATOM 0 HB2 MET A 117 -13.798 8.439 -10.317 1.00 53.14 H new ATOM 0 HB3 MET A 117 -14.539 6.886 -10.646 1.00 53.14 H new ATOM 0 HG2 MET A 117 -15.273 9.552 -11.868 1.00 63.34 H new ATOM 0 HG3 MET A 117 -14.472 8.208 -12.657 1.00 63.34 H new ATOM 0 HE1 MET A 117 -17.868 8.387 -14.466 1.00 61.31 H new ATOM 0 HE2 MET A 117 -16.578 9.540 -14.050 1.00 61.31 H new ATOM 0 HE3 MET A 117 -16.162 7.940 -14.707 1.00 61.31 H new ATOM 1685 N TRP A 118 -15.575 10.548 -8.970 1.00 62.22 N ATOM 1686 CA TRP A 118 -16.051 11.922 -8.842 1.00 61.11 C ATOM 1687 C TRP A 118 -16.384 12.494 -10.236 1.00 62.32 C ATOM 1688 O TRP A 118 -15.575 12.388 -11.175 1.00 4.11 O ATOM 1689 CB TRP A 118 -14.960 12.743 -8.152 1.00 31.04 C ATOM 1690 CG TRP A 118 -15.369 14.111 -7.734 1.00 25.41 C ATOM 1691 CD1 TRP A 118 -14.894 15.289 -8.201 1.00 24.10 C ATOM 1692 CD2 TRP A 118 -16.342 14.435 -6.749 1.00 21.22 C ATOM 1693 NE1 TRP A 118 -15.512 16.326 -7.574 1.00 10.01 N ATOM 1694 CE2 TRP A 118 -16.407 15.832 -6.674 1.00 74.20 C ATOM 1695 CE3 TRP A 118 -17.164 13.676 -5.924 1.00 60.30 C ATOM 1696 CZ2 TRP A 118 -17.265 16.492 -5.806 1.00 44.34 C ATOM 1697 CZ3 TRP A 118 -18.014 14.322 -5.063 1.00 25.32 C ATOM 1698 CH2 TRP A 118 -18.064 15.720 -5.007 1.00 52.43 C ATOM 0 H TRP A 118 -14.591 10.431 -8.727 1.00 62.22 H new ATOM 0 HA TRP A 118 -16.962 11.960 -8.245 1.00 61.11 H new ATOM 0 HB2 TRP A 118 -14.619 12.198 -7.272 1.00 31.04 H new ATOM 0 HB3 TRP A 118 -14.108 12.826 -8.826 1.00 31.04 H new ATOM 0 HD1 TRP A 118 -14.134 15.391 -8.962 1.00 24.10 H new ATOM 0 HE1 TRP A 118 -15.334 17.315 -7.750 1.00 10.01 H new ATOM 0 HE3 TRP A 118 -17.134 12.597 -5.960 1.00 60.30 H new ATOM 0 HZ2 TRP A 118 -17.301 17.571 -5.763 1.00 44.34 H new ATOM 0 HZ3 TRP A 118 -18.656 13.742 -4.417 1.00 25.32 H new ATOM 0 HH2 TRP A 118 -18.746 16.198 -4.320 1.00 52.43 H new ATOM 1709 N ILE A 119 -17.569 13.092 -10.366 1.00 5.12 N ATOM 1710 CA ILE A 119 -18.069 13.525 -11.674 1.00 25.13 C ATOM 1711 C ILE A 119 -17.344 14.764 -12.188 1.00 71.52 C ATOM 1712 O ILE A 119 -16.927 14.801 -13.347 1.00 12.11 O ATOM 1713 CB ILE A 119 -19.630 13.801 -11.702 1.00 32.53 C ATOM 1714 CG1 ILE A 119 -20.463 12.591 -11.263 1.00 34.42 C ATOM 1715 CG2 ILE A 119 -20.076 14.213 -13.086 1.00 33.34 C ATOM 1716 CD1 ILE A 119 -20.382 12.250 -9.803 1.00 70.34 C ATOM 0 H ILE A 119 -18.198 13.287 -9.587 1.00 5.12 H new ATOM 0 HA ILE A 119 -17.864 12.680 -12.331 1.00 25.13 H new ATOM 0 HB ILE A 119 -19.801 14.607 -10.988 1.00 32.53 H new ATOM 0 HG12 ILE A 119 -21.506 12.777 -11.518 1.00 34.42 H new ATOM 0 HG13 ILE A 119 -20.144 11.723 -11.840 1.00 34.42 H new ATOM 0 HG21 ILE A 119 -21.150 14.397 -13.082 1.00 33.34 H new ATOM 0 HG22 ILE A 119 -19.553 15.123 -13.381 1.00 33.34 H new ATOM 0 HG23 ILE A 119 -19.847 13.417 -13.794 1.00 33.34 H new ATOM 0 HD11 ILE A 119 -21.006 11.381 -9.597 1.00 70.34 H new ATOM 0 HD12 ILE A 119 -19.349 12.025 -9.539 1.00 70.34 H new ATOM 0 HD13 ILE A 119 -20.732 13.096 -9.212 1.00 70.34 H new ATOM 1728 N ASN A 120 -17.135 15.747 -11.323 1.00 44.03 N ATOM 1729 CA ASN A 120 -16.478 16.994 -11.749 1.00 14.24 C ATOM 1730 C ASN A 120 -15.041 16.708 -12.102 1.00 30.55 C ATOM 1731 O ASN A 120 -14.528 17.185 -13.110 1.00 4.31 O ATOM 1732 CB ASN A 120 -16.543 18.075 -10.657 1.00 50.20 C ATOM 1733 CG ASN A 120 -15.911 19.402 -11.100 1.00 51.13 C ATOM 1734 OD1 ASN A 120 -15.939 19.757 -12.272 1.00 24.22 O ATOM 1735 ND2 ASN A 120 -15.321 20.112 -10.177 1.00 20.53 N ATOM 0 H ASN A 120 -17.402 15.717 -10.339 1.00 44.03 H new ATOM 0 HA ASN A 120 -17.008 17.375 -12.622 1.00 14.24 H new ATOM 0 HB2 ASN A 120 -17.584 18.247 -10.383 1.00 50.20 H new ATOM 0 HB3 ASN A 120 -16.033 17.715 -9.764 1.00 50.20 H new ATOM 0 HD21 ASN A 120 -14.865 20.991 -10.423 1.00 20.53 H new ATOM 0 HD22 ASN A 120 -15.316 19.788 -9.210 1.00 20.53 H new ATOM 1742 N LYS A 121 -14.407 15.906 -11.241 1.00 21.24 N ATOM 1743 CA LYS A 121 -13.012 15.417 -11.365 1.00 24.11 C ATOM 1744 C LYS A 121 -11.975 16.535 -11.625 1.00 23.43 C ATOM 1745 O LYS A 121 -10.840 16.259 -12.001 1.00 30.12 O ATOM 1746 CB LYS A 121 -12.900 14.234 -12.388 1.00 53.10 C ATOM 1747 CG LYS A 121 -13.247 14.559 -13.843 1.00 71.54 C ATOM 1748 CD LYS A 121 -13.203 13.323 -14.742 1.00 63.14 C ATOM 1749 CE LYS A 121 -14.315 12.313 -14.417 1.00 44.14 C ATOM 1750 NZ LYS A 121 -15.669 12.849 -14.714 1.00 12.52 N ATOM 0 H LYS A 121 -14.864 15.559 -10.398 1.00 21.24 H new ATOM 0 HA LYS A 121 -12.748 15.021 -10.385 1.00 24.11 H new ATOM 0 HB2 LYS A 121 -11.880 13.851 -12.357 1.00 53.10 H new ATOM 0 HB3 LYS A 121 -13.553 13.429 -12.052 1.00 53.10 H new ATOM 0 HG2 LYS A 121 -14.242 15.001 -13.886 1.00 71.54 H new ATOM 0 HG3 LYS A 121 -12.549 15.306 -14.222 1.00 71.54 H new ATOM 0 HD2 LYS A 121 -13.292 13.633 -15.783 1.00 63.14 H new ATOM 0 HD3 LYS A 121 -12.233 12.836 -14.636 1.00 63.14 H new ATOM 0 HE2 LYS A 121 -14.154 11.401 -14.992 1.00 44.14 H new ATOM 0 HE3 LYS A 121 -14.258 12.040 -13.363 1.00 44.14 H new ATOM 0 HZ1 LYS A 121 -16.327 12.060 -14.876 1.00 12.52 H new ATOM 0 HZ2 LYS A 121 -16.001 13.418 -13.909 1.00 12.52 H new ATOM 0 HZ3 LYS A 121 -15.627 13.445 -15.565 1.00 12.52 H new ATOM 1764 N ALA A 122 -12.352 17.779 -11.346 1.00 63.21 N ATOM 1765 CA ALA A 122 -11.471 18.912 -11.583 1.00 1.30 C ATOM 1766 C ALA A 122 -11.324 19.807 -10.347 1.00 25.41 C ATOM 1767 O ALA A 122 -10.634 20.818 -10.401 1.00 35.03 O ATOM 1768 CB ALA A 122 -11.974 19.724 -12.767 1.00 33.21 C ATOM 0 H ALA A 122 -13.262 18.026 -10.956 1.00 63.21 H new ATOM 0 HA ALA A 122 -10.482 18.513 -11.808 1.00 1.30 H new ATOM 0 HB1 ALA A 122 -11.308 20.570 -12.937 1.00 33.21 H new ATOM 0 HB2 ALA A 122 -11.996 19.095 -13.657 1.00 33.21 H new ATOM 0 HB3 ALA A 122 -12.979 20.090 -12.557 1.00 33.21 H new ATOM 1774 N ASP A 123 -11.967 19.432 -9.239 1.00 61.55 N ATOM 1775 CA ASP A 123 -11.904 20.225 -7.987 1.00 21.51 C ATOM 1776 C ASP A 123 -10.480 20.373 -7.490 1.00 35.13 C ATOM 1777 O ASP A 123 -9.818 19.383 -7.207 1.00 64.24 O ATOM 1778 CB ASP A 123 -12.758 19.607 -6.861 1.00 10.14 C ATOM 1779 CG ASP A 123 -14.230 19.651 -7.128 1.00 43.32 C ATOM 1780 OD1 ASP A 123 -14.720 18.825 -7.905 1.00 63.42 O ATOM 1781 OD2 ASP A 123 -14.924 20.509 -6.548 1.00 20.30 O ATOM 0 H ASP A 123 -12.538 18.589 -9.173 1.00 61.55 H new ATOM 0 HA ASP A 123 -12.306 21.206 -8.238 1.00 21.51 H new ATOM 0 HB2 ASP A 123 -12.455 18.570 -6.715 1.00 10.14 H new ATOM 0 HB3 ASP A 123 -12.551 20.134 -5.929 1.00 10.14 H new ATOM 1786 N PRO A 124 -9.994 21.624 -7.346 1.00 42.13 N ATOM 1787 CA PRO A 124 -8.632 21.894 -6.852 1.00 13.21 C ATOM 1788 C PRO A 124 -8.480 21.490 -5.387 1.00 5.13 C ATOM 1789 O PRO A 124 -7.365 21.324 -4.881 1.00 22.54 O ATOM 1790 CB PRO A 124 -8.485 23.413 -7.011 1.00 11.03 C ATOM 1791 CG PRO A 124 -9.880 23.939 -7.046 1.00 3.42 C ATOM 1792 CD PRO A 124 -10.725 22.868 -7.665 1.00 54.44 C ATOM 0 HA PRO A 124 -7.873 21.329 -7.394 1.00 13.21 H new ATOM 0 HB2 PRO A 124 -7.923 23.843 -6.182 1.00 11.03 H new ATOM 0 HB3 PRO A 124 -7.947 23.663 -7.925 1.00 11.03 H new ATOM 0 HG2 PRO A 124 -10.230 24.177 -6.041 1.00 3.42 H new ATOM 0 HG3 PRO A 124 -9.933 24.859 -7.628 1.00 3.42 H new ATOM 0 HD2 PRO A 124 -11.732 22.860 -7.248 1.00 54.44 H new ATOM 0 HD3 PRO A 124 -10.827 23.009 -8.741 1.00 54.44 H new ATOM 1800 N ASP A 125 -9.623 21.333 -4.722 1.00 22.01 N ATOM 1801 CA ASP A 125 -9.696 20.900 -3.330 1.00 1.21 C ATOM 1802 C ASP A 125 -8.985 19.590 -3.142 1.00 71.43 C ATOM 1803 O ASP A 125 -8.273 19.388 -2.155 1.00 33.04 O ATOM 1804 CB ASP A 125 -11.148 20.714 -2.898 1.00 63.42 C ATOM 1805 CG ASP A 125 -11.942 21.976 -2.829 1.00 41.50 C ATOM 1806 OD1 ASP A 125 -12.221 22.578 -3.881 1.00 23.13 O ATOM 1807 OD2 ASP A 125 -12.331 22.375 -1.721 1.00 42.42 O ATOM 0 H ASP A 125 -10.536 21.506 -5.142 1.00 22.01 H new ATOM 0 HA ASP A 125 -9.221 21.673 -2.725 1.00 1.21 H new ATOM 0 HB2 ASP A 125 -11.636 20.031 -3.594 1.00 63.42 H new ATOM 0 HB3 ASP A 125 -11.164 20.236 -1.918 1.00 63.42 H new ATOM 1812 N MET A 126 -9.164 18.701 -4.084 1.00 64.13 N ATOM 1813 CA MET A 126 -8.557 17.421 -3.995 1.00 72.23 C ATOM 1814 C MET A 126 -7.257 17.323 -4.772 1.00 53.53 C ATOM 1815 O MET A 126 -7.209 16.967 -5.932 1.00 3.20 O ATOM 1816 CB MET A 126 -9.559 16.227 -4.180 1.00 45.24 C ATOM 1817 CG MET A 126 -10.499 16.264 -5.408 1.00 32.31 C ATOM 1818 SD MET A 126 -9.714 16.063 -7.016 1.00 55.10 S ATOM 1819 CE MET A 126 -11.142 16.173 -8.079 1.00 54.23 C ATOM 0 H MET A 126 -9.729 18.851 -4.920 1.00 64.13 H new ATOM 0 HA MET A 126 -8.243 17.306 -2.957 1.00 72.23 H new ATOM 0 HB2 MET A 126 -8.978 15.306 -4.229 1.00 45.24 H new ATOM 0 HB3 MET A 126 -10.178 16.166 -3.285 1.00 45.24 H new ATOM 0 HG2 MET A 126 -11.246 15.479 -5.291 1.00 32.31 H new ATOM 0 HG3 MET A 126 -11.032 17.215 -5.403 1.00 32.31 H new ATOM 0 HE1 MET A 126 -10.833 16.050 -9.117 1.00 54.23 H new ATOM 0 HE2 MET A 126 -11.852 15.389 -7.816 1.00 54.23 H new ATOM 0 HE3 MET A 126 -11.614 17.147 -7.954 1.00 54.23 H new ATOM 2066 N LYS A 140 5.420 -1.627 -8.521 1.00 44.34 N ATOM 2067 CA LYS A 140 6.339 -1.479 -9.649 1.00 54.32 C ATOM 2068 C LYS A 140 7.421 -2.551 -9.577 1.00 70.43 C ATOM 2069 O LYS A 140 7.840 -3.095 -10.596 1.00 61.13 O ATOM 2070 CB LYS A 140 6.968 -0.064 -9.624 1.00 25.34 C ATOM 2071 CG LYS A 140 8.001 0.238 -10.724 1.00 21.41 C ATOM 2072 CD LYS A 140 8.439 1.705 -10.650 1.00 52.12 C ATOM 2073 CE LYS A 140 9.439 2.085 -11.745 1.00 32.00 C ATOM 2074 NZ LYS A 140 10.746 1.410 -11.598 1.00 63.53 N ATOM 0 HA LYS A 140 5.793 -1.602 -10.584 1.00 54.32 H new ATOM 0 HB2 LYS A 140 6.165 0.670 -9.697 1.00 25.34 H new ATOM 0 HB3 LYS A 140 7.446 0.082 -8.655 1.00 25.34 H new ATOM 0 HG2 LYS A 140 8.867 -0.414 -10.609 1.00 21.41 H new ATOM 0 HG3 LYS A 140 7.572 0.028 -11.704 1.00 21.41 H new ATOM 0 HD2 LYS A 140 7.561 2.345 -10.729 1.00 52.12 H new ATOM 0 HD3 LYS A 140 8.886 1.897 -9.675 1.00 52.12 H new ATOM 0 HE2 LYS A 140 9.015 1.835 -12.718 1.00 32.00 H new ATOM 0 HE3 LYS A 140 9.591 3.164 -11.731 1.00 32.00 H new ATOM 0 HZ1 LYS A 140 11.024 0.990 -12.508 1.00 63.53 H new ATOM 0 HZ2 LYS A 140 11.463 2.103 -11.303 1.00 63.53 H new ATOM 0 HZ3 LYS A 140 10.672 0.662 -10.879 1.00 63.53 H new ATOM 2088 N LYS A 141 7.820 -2.887 -8.355 1.00 4.44 N ATOM 2089 CA LYS A 141 8.884 -3.857 -8.107 1.00 3.43 C ATOM 2090 C LYS A 141 8.665 -5.201 -8.768 1.00 21.11 C ATOM 2091 O LYS A 141 9.603 -5.753 -9.296 1.00 32.45 O ATOM 2092 CB LYS A 141 9.178 -4.036 -6.618 1.00 10.20 C ATOM 2093 CG LYS A 141 9.913 -2.878 -5.958 1.00 32.21 C ATOM 2094 CD LYS A 141 11.302 -2.669 -6.579 1.00 34.11 C ATOM 2095 CE LYS A 141 12.154 -3.929 -6.472 1.00 71.10 C ATOM 2096 NZ LYS A 141 13.478 -3.772 -7.104 1.00 23.43 N ATOM 0 H LYS A 141 7.415 -2.494 -7.506 1.00 4.44 H new ATOM 0 HA LYS A 141 9.761 -3.417 -8.581 1.00 3.43 H new ATOM 0 HB2 LYS A 141 8.235 -4.192 -6.094 1.00 10.20 H new ATOM 0 HB3 LYS A 141 9.769 -4.942 -6.487 1.00 10.20 H new ATOM 0 HG2 LYS A 141 9.325 -1.966 -6.062 1.00 32.21 H new ATOM 0 HG3 LYS A 141 10.016 -3.071 -4.890 1.00 32.21 H new ATOM 0 HD2 LYS A 141 11.195 -2.388 -7.627 1.00 34.11 H new ATOM 0 HD3 LYS A 141 11.806 -1.843 -6.077 1.00 34.11 H new ATOM 0 HE2 LYS A 141 12.285 -4.187 -5.421 1.00 71.10 H new ATOM 0 HE3 LYS A 141 11.628 -4.760 -6.941 1.00 71.10 H new ATOM 0 HZ1 LYS A 141 13.728 -4.646 -7.609 1.00 23.43 H new ATOM 0 HZ2 LYS A 141 13.450 -2.980 -7.777 1.00 23.43 H new ATOM 0 HZ3 LYS A 141 14.191 -3.579 -6.372 1.00 23.43 H new ATOM 2110 N LYS A 142 7.430 -5.710 -8.766 1.00 45.13 N ATOM 2111 CA LYS A 142 7.134 -7.037 -9.377 1.00 70.13 C ATOM 2112 C LYS A 142 7.597 -7.044 -10.823 1.00 12.13 C ATOM 2113 O LYS A 142 8.235 -7.995 -11.319 1.00 3.42 O ATOM 2114 CB LYS A 142 5.627 -7.295 -9.398 1.00 71.31 C ATOM 2115 CG LYS A 142 5.261 -8.708 -9.869 1.00 12.30 C ATOM 2116 CD LYS A 142 3.754 -8.907 -10.015 1.00 73.22 C ATOM 2117 CE LYS A 142 3.179 -8.000 -11.091 1.00 33.50 C ATOM 2118 NZ LYS A 142 1.737 -8.219 -11.297 1.00 1.21 N ATOM 0 H LYS A 142 6.620 -5.242 -8.358 1.00 45.13 H new ATOM 0 HA LYS A 142 7.645 -7.798 -8.787 1.00 70.13 H new ATOM 0 HB2 LYS A 142 5.224 -7.137 -8.398 1.00 71.31 H new ATOM 0 HB3 LYS A 142 5.149 -6.566 -10.053 1.00 71.31 H new ATOM 0 HG2 LYS A 142 5.744 -8.904 -10.826 1.00 12.30 H new ATOM 0 HG3 LYS A 142 5.653 -9.436 -9.159 1.00 12.30 H new ATOM 0 HD2 LYS A 142 3.545 -9.947 -10.263 1.00 73.22 H new ATOM 0 HD3 LYS A 142 3.264 -8.702 -9.063 1.00 73.22 H new ATOM 0 HE2 LYS A 142 3.350 -6.959 -10.815 1.00 33.50 H new ATOM 0 HE3 LYS A 142 3.708 -8.172 -12.029 1.00 33.50 H new ATOM 0 HZ1 LYS A 142 1.489 -7.994 -12.282 1.00 1.21 H new ATOM 0 HZ2 LYS A 142 1.505 -9.214 -11.100 1.00 1.21 H new ATOM 0 HZ3 LYS A 142 1.197 -7.604 -10.655 1.00 1.21 H new ATOM 2132 N PHE A 143 7.297 -5.960 -11.473 1.00 11.35 N ATOM 2133 CA PHE A 143 7.556 -5.796 -12.854 1.00 44.24 C ATOM 2134 C PHE A 143 9.054 -5.582 -13.062 1.00 61.14 C ATOM 2135 O PHE A 143 9.645 -6.080 -14.024 1.00 23.05 O ATOM 2136 CB PHE A 143 6.742 -4.600 -13.341 1.00 52.53 C ATOM 2137 CG PHE A 143 6.596 -4.514 -14.809 1.00 74.05 C ATOM 2138 CD1 PHE A 143 5.759 -5.393 -15.451 1.00 22.43 C ATOM 2139 CD2 PHE A 143 7.280 -3.566 -15.547 1.00 51.22 C ATOM 2140 CE1 PHE A 143 5.593 -5.337 -16.819 1.00 74.23 C ATOM 2141 CE2 PHE A 143 7.123 -3.498 -16.916 1.00 1.42 C ATOM 2142 CZ PHE A 143 6.276 -4.387 -17.554 1.00 73.12 C ATOM 0 H PHE A 143 6.855 -5.150 -11.038 1.00 11.35 H new ATOM 0 HA PHE A 143 7.267 -6.679 -13.424 1.00 44.24 H new ATOM 0 HB2 PHE A 143 5.750 -4.645 -12.892 1.00 52.53 H new ATOM 0 HB3 PHE A 143 7.213 -3.685 -12.981 1.00 52.53 H new ATOM 0 HD1 PHE A 143 5.225 -6.137 -14.878 1.00 22.43 H new ATOM 0 HD2 PHE A 143 7.942 -2.874 -15.048 1.00 51.22 H new ATOM 0 HE1 PHE A 143 4.932 -6.033 -17.314 1.00 74.23 H new ATOM 0 HE2 PHE A 143 7.659 -2.754 -17.487 1.00 1.42 H new ATOM 0 HZ PHE A 143 6.149 -4.338 -18.625 1.00 73.12 H new ATOM 2152 N ILE A 144 9.674 -4.893 -12.115 1.00 12.35 N ATOM 2153 CA ILE A 144 11.091 -4.598 -12.197 1.00 40.32 C ATOM 2154 C ILE A 144 11.914 -5.842 -11.953 1.00 5.14 C ATOM 2155 O ILE A 144 12.895 -6.036 -12.598 1.00 44.44 O ATOM 2156 CB ILE A 144 11.550 -3.493 -11.210 1.00 42.41 C ATOM 2157 CG1 ILE A 144 10.664 -2.258 -11.342 1.00 64.55 C ATOM 2158 CG2 ILE A 144 13.011 -3.111 -11.473 1.00 62.31 C ATOM 2159 CD1 ILE A 144 10.565 -1.711 -12.742 1.00 41.23 C ATOM 0 H ILE A 144 9.214 -4.529 -11.281 1.00 12.35 H new ATOM 0 HA ILE A 144 11.253 -4.226 -13.209 1.00 40.32 H new ATOM 0 HB ILE A 144 11.463 -3.885 -10.197 1.00 42.41 H new ATOM 0 HG12 ILE A 144 9.663 -2.505 -10.990 1.00 64.55 H new ATOM 0 HG13 ILE A 144 11.049 -1.477 -10.686 1.00 64.55 H new ATOM 0 HG21 ILE A 144 13.316 -2.335 -10.771 1.00 62.31 H new ATOM 0 HG22 ILE A 144 13.645 -3.988 -11.342 1.00 62.31 H new ATOM 0 HG23 ILE A 144 13.112 -2.739 -12.492 1.00 62.31 H new ATOM 0 HD11 ILE A 144 9.917 -0.835 -12.745 1.00 41.23 H new ATOM 0 HD12 ILE A 144 11.558 -1.429 -13.094 1.00 41.23 H new ATOM 0 HD13 ILE A 144 10.149 -2.473 -13.402 1.00 41.23 H new ATOM 2171 N GLU A 145 11.488 -6.685 -11.023 1.00 73.31 N ATOM 2172 CA GLU A 145 12.209 -7.932 -10.717 1.00 14.22 C ATOM 2173 C GLU A 145 12.291 -8.815 -11.951 1.00 1.31 C ATOM 2174 O GLU A 145 13.280 -9.529 -12.165 1.00 1.43 O ATOM 2175 CB GLU A 145 11.541 -8.689 -9.569 1.00 20.10 C ATOM 2176 CG GLU A 145 11.478 -7.909 -8.270 1.00 71.21 C ATOM 2177 CD GLU A 145 12.832 -7.466 -7.794 1.00 44.52 C ATOM 2178 OE1 GLU A 145 13.522 -8.253 -7.113 1.00 55.32 O ATOM 2179 OE2 GLU A 145 13.232 -6.328 -8.090 1.00 15.51 O ATOM 0 H GLU A 145 10.649 -6.537 -10.463 1.00 73.31 H new ATOM 0 HA GLU A 145 13.219 -7.666 -10.406 1.00 14.22 H new ATOM 0 HB2 GLU A 145 10.528 -8.961 -9.867 1.00 20.10 H new ATOM 0 HB3 GLU A 145 12.083 -9.619 -9.397 1.00 20.10 H new ATOM 0 HG2 GLU A 145 10.841 -7.035 -8.406 1.00 71.21 H new ATOM 0 HG3 GLU A 145 11.012 -8.526 -7.502 1.00 71.21 H new ATOM 2186 N THR A 146 11.264 -8.726 -12.768 1.00 35.35 N ATOM 2187 CA THR A 146 11.193 -9.449 -14.001 1.00 63.42 C ATOM 2188 C THR A 146 12.223 -8.849 -14.996 1.00 3.31 C ATOM 2189 O THR A 146 13.018 -9.564 -15.605 1.00 41.31 O ATOM 2190 CB THR A 146 9.758 -9.339 -14.568 1.00 22.31 C ATOM 2191 OG1 THR A 146 8.808 -9.741 -13.539 1.00 24.21 O ATOM 2192 CG2 THR A 146 9.585 -10.240 -15.779 1.00 74.41 C ATOM 0 H THR A 146 10.449 -8.140 -12.585 1.00 35.35 H new ATOM 0 HA THR A 146 11.428 -10.501 -13.842 1.00 63.42 H new ATOM 0 HB THR A 146 9.580 -8.307 -14.871 1.00 22.31 H new ATOM 0 HG1 THR A 146 8.701 -9.014 -12.891 1.00 24.21 H new ATOM 0 HG21 THR A 146 8.568 -10.146 -16.160 1.00 74.41 H new ATOM 0 HG22 THR A 146 10.292 -9.947 -16.555 1.00 74.41 H new ATOM 0 HG23 THR A 146 9.770 -11.275 -15.492 1.00 74.41 H new ATOM 2200 N PHE A 147 12.226 -7.531 -15.099 1.00 54.31 N ATOM 2201 CA PHE A 147 13.163 -6.800 -15.954 1.00 64.15 C ATOM 2202 C PHE A 147 14.591 -6.799 -15.458 1.00 61.12 C ATOM 2203 O PHE A 147 15.523 -6.674 -16.253 1.00 62.21 O ATOM 2204 CB PHE A 147 12.676 -5.404 -16.307 1.00 45.02 C ATOM 2205 CG PHE A 147 11.702 -5.428 -17.429 1.00 34.12 C ATOM 2206 CD1 PHE A 147 12.168 -5.377 -18.726 1.00 32.05 C ATOM 2207 CD2 PHE A 147 10.342 -5.525 -17.212 1.00 63.23 C ATOM 2208 CE1 PHE A 147 11.311 -5.417 -19.789 1.00 55.24 C ATOM 2209 CE2 PHE A 147 9.468 -5.567 -18.279 1.00 31.35 C ATOM 2210 CZ PHE A 147 9.952 -5.514 -19.571 1.00 35.12 C ATOM 0 H PHE A 147 11.577 -6.929 -14.592 1.00 54.31 H new ATOM 0 HA PHE A 147 13.184 -7.372 -16.881 1.00 64.15 H new ATOM 0 HB2 PHE A 147 12.212 -4.949 -15.432 1.00 45.02 H new ATOM 0 HB3 PHE A 147 13.527 -4.779 -16.578 1.00 45.02 H new ATOM 0 HD1 PHE A 147 13.231 -5.304 -18.905 1.00 32.05 H new ATOM 0 HD2 PHE A 147 9.960 -5.568 -16.203 1.00 63.23 H new ATOM 0 HE1 PHE A 147 11.696 -5.373 -20.797 1.00 55.24 H new ATOM 0 HE2 PHE A 147 8.405 -5.641 -18.103 1.00 31.35 H new ATOM 0 HZ PHE A 147 9.270 -5.548 -20.407 1.00 35.12 H new ATOM 2220 N LYS A 148 14.757 -6.893 -14.162 1.00 61.43 N ATOM 2221 CA LYS A 148 16.055 -6.945 -13.525 1.00 40.22 C ATOM 2222 C LYS A 148 16.819 -8.155 -14.110 1.00 61.43 C ATOM 2223 O LYS A 148 18.011 -8.084 -14.384 1.00 13.12 O ATOM 2224 CB LYS A 148 15.854 -7.099 -11.988 1.00 52.23 C ATOM 2225 CG LYS A 148 17.083 -6.841 -11.082 1.00 11.43 C ATOM 2226 CD LYS A 148 18.216 -7.836 -11.266 1.00 21.15 C ATOM 2227 CE LYS A 148 19.350 -7.551 -10.292 1.00 32.12 C ATOM 2228 NZ LYS A 148 20.473 -8.501 -10.445 1.00 33.03 N ATOM 0 H LYS A 148 13.979 -6.937 -13.504 1.00 61.43 H new ATOM 0 HA LYS A 148 16.627 -6.035 -13.706 1.00 40.22 H new ATOM 0 HB2 LYS A 148 15.060 -6.418 -11.682 1.00 52.23 H new ATOM 0 HB3 LYS A 148 15.498 -8.111 -11.794 1.00 52.23 H new ATOM 0 HG2 LYS A 148 17.461 -5.838 -11.279 1.00 11.43 H new ATOM 0 HG3 LYS A 148 16.762 -6.862 -10.040 1.00 11.43 H new ATOM 0 HD2 LYS A 148 17.845 -8.849 -11.112 1.00 21.15 H new ATOM 0 HD3 LYS A 148 18.588 -7.785 -12.289 1.00 21.15 H new ATOM 0 HE2 LYS A 148 19.713 -6.535 -10.447 1.00 32.12 H new ATOM 0 HE3 LYS A 148 18.971 -7.601 -9.271 1.00 32.12 H new ATOM 0 HZ1 LYS A 148 21.088 -8.450 -9.608 1.00 33.03 H new ATOM 0 HZ2 LYS A 148 20.100 -9.467 -10.542 1.00 33.03 H new ATOM 0 HZ3 LYS A 148 21.022 -8.255 -11.293 1.00 33.03 H new ATOM 2242 N LYS A 149 16.084 -9.245 -14.349 1.00 30.21 N ATOM 2243 CA LYS A 149 16.655 -10.462 -14.919 1.00 23.42 C ATOM 2244 C LYS A 149 17.000 -10.251 -16.389 1.00 44.41 C ATOM 2245 O LYS A 149 17.917 -10.865 -16.926 1.00 52.32 O ATOM 2246 CB LYS A 149 15.679 -11.619 -14.777 1.00 73.01 C ATOM 2247 CG LYS A 149 15.363 -11.994 -13.339 1.00 51.43 C ATOM 2248 CD LYS A 149 14.320 -13.100 -13.270 1.00 1.22 C ATOM 2249 CE LYS A 149 14.769 -14.356 -14.006 1.00 50.13 C ATOM 2250 NZ LYS A 149 13.759 -15.427 -13.944 1.00 70.33 N ATOM 0 H LYS A 149 15.085 -9.306 -14.154 1.00 30.21 H new ATOM 0 HA LYS A 149 17.569 -10.701 -14.375 1.00 23.42 H new ATOM 0 HB2 LYS A 149 14.750 -11.361 -15.286 1.00 73.01 H new ATOM 0 HB3 LYS A 149 16.090 -12.491 -15.286 1.00 73.01 H new ATOM 0 HG2 LYS A 149 16.274 -12.320 -12.838 1.00 51.43 H new ATOM 0 HG3 LYS A 149 15.001 -11.116 -12.804 1.00 51.43 H new ATOM 0 HD2 LYS A 149 14.119 -13.344 -12.227 1.00 1.22 H new ATOM 0 HD3 LYS A 149 13.384 -12.743 -13.700 1.00 1.22 H new ATOM 0 HE2 LYS A 149 14.973 -14.111 -15.048 1.00 50.13 H new ATOM 0 HE3 LYS A 149 15.703 -14.714 -13.574 1.00 50.13 H new ATOM 0 HZ1 LYS A 149 14.106 -16.262 -14.458 1.00 70.33 H new ATOM 0 HZ2 LYS A 149 13.582 -15.680 -12.951 1.00 70.33 H new ATOM 0 HZ3 LYS A 149 12.875 -15.096 -14.380 1.00 70.33 H new ATOM 2264 N ILE A 150 16.260 -9.371 -17.027 1.00 51.12 N ATOM 2265 CA ILE A 150 16.494 -9.027 -18.411 1.00 14.23 C ATOM 2266 C ILE A 150 17.768 -8.173 -18.518 1.00 74.30 C ATOM 2267 O ILE A 150 18.506 -8.248 -19.501 1.00 61.10 O ATOM 2268 CB ILE A 150 15.241 -8.345 -19.053 1.00 62.22 C ATOM 2269 CG1 ILE A 150 14.048 -9.316 -18.929 1.00 71.33 C ATOM 2270 CG2 ILE A 150 15.498 -7.998 -20.519 1.00 2.51 C ATOM 2271 CD1 ILE A 150 12.735 -8.783 -19.445 1.00 44.43 C ATOM 0 H ILE A 150 15.479 -8.874 -16.600 1.00 51.12 H new ATOM 0 HA ILE A 150 16.656 -9.937 -18.988 1.00 14.23 H new ATOM 0 HB ILE A 150 15.023 -7.413 -18.532 1.00 62.22 H new ATOM 0 HG12 ILE A 150 14.288 -10.233 -19.468 1.00 71.33 H new ATOM 0 HG13 ILE A 150 13.926 -9.586 -17.880 1.00 71.33 H new ATOM 0 HG21 ILE A 150 14.612 -7.525 -20.942 1.00 2.51 H new ATOM 0 HG22 ILE A 150 16.343 -7.313 -20.588 1.00 2.51 H new ATOM 0 HG23 ILE A 150 15.723 -8.908 -21.074 1.00 2.51 H new ATOM 0 HD11 ILE A 150 11.959 -9.538 -19.314 1.00 44.43 H new ATOM 0 HD12 ILE A 150 12.464 -7.884 -18.891 1.00 44.43 H new ATOM 0 HD13 ILE A 150 12.831 -8.541 -20.504 1.00 44.43 H new ATOM 2283 N MET A 151 18.032 -7.392 -17.473 1.00 55.11 N ATOM 2284 CA MET A 151 19.276 -6.615 -17.371 1.00 64.14 C ATOM 2285 C MET A 151 20.455 -7.585 -17.312 1.00 30.25 C ATOM 2286 O MET A 151 21.489 -7.377 -17.959 1.00 61.23 O ATOM 2287 CB MET A 151 19.271 -5.746 -16.102 1.00 44.25 C ATOM 2288 CG MET A 151 18.151 -4.728 -16.037 1.00 20.31 C ATOM 2289 SD MET A 151 18.128 -3.826 -14.470 1.00 62.45 S ATOM 2290 CE MET A 151 16.717 -2.758 -14.724 1.00 12.45 C ATOM 0 H MET A 151 17.402 -7.277 -16.679 1.00 55.11 H new ATOM 0 HA MET A 151 19.361 -5.961 -18.239 1.00 64.14 H new ATOM 0 HB2 MET A 151 19.202 -6.398 -15.232 1.00 44.25 H new ATOM 0 HB3 MET A 151 20.224 -5.222 -16.033 1.00 44.25 H new ATOM 0 HG2 MET A 151 18.259 -4.020 -16.859 1.00 20.31 H new ATOM 0 HG3 MET A 151 17.196 -5.234 -16.176 1.00 20.31 H new ATOM 0 HE1 MET A 151 16.569 -2.135 -13.842 1.00 12.45 H new ATOM 0 HE2 MET A 151 16.893 -2.123 -15.592 1.00 12.45 H new ATOM 0 HE3 MET A 151 15.827 -3.365 -14.893 1.00 12.45 H new ATOM 2300 N GLU A 152 20.261 -8.671 -16.547 1.00 10.34 N ATOM 2301 CA GLU A 152 21.254 -9.739 -16.404 1.00 2.04 C ATOM 2302 C GLU A 152 21.521 -10.393 -17.763 1.00 24.03 C ATOM 2303 O GLU A 152 22.648 -10.787 -18.064 1.00 74.54 O ATOM 2304 CB GLU A 152 20.744 -10.825 -15.449 1.00 60.43 C ATOM 2305 CG GLU A 152 20.368 -10.359 -14.048 1.00 34.22 C ATOM 2306 CD GLU A 152 21.511 -9.749 -13.293 1.00 70.43 C ATOM 2307 OE1 GLU A 152 22.479 -10.479 -12.964 1.00 61.31 O ATOM 2308 OE2 GLU A 152 21.464 -8.556 -12.998 1.00 55.21 O ATOM 0 H GLU A 152 19.408 -8.830 -16.011 1.00 10.34 H new ATOM 0 HA GLU A 152 22.167 -9.295 -16.008 1.00 2.04 H new ATOM 0 HB2 GLU A 152 19.871 -11.297 -15.900 1.00 60.43 H new ATOM 0 HB3 GLU A 152 21.512 -11.593 -15.361 1.00 60.43 H new ATOM 0 HG2 GLU A 152 19.561 -9.630 -14.121 1.00 34.22 H new ATOM 0 HG3 GLU A 152 19.981 -11.207 -13.483 1.00 34.22 H new ATOM 2315 N CYS A 153 20.466 -10.500 -18.569 1.00 61.31 N ATOM 2316 CA CYS A 153 20.536 -11.102 -19.898 1.00 53.15 C ATOM 2317 C CYS A 153 21.370 -10.254 -20.850 1.00 22.35 C ATOM 2318 O CYS A 153 22.013 -10.777 -21.760 1.00 64.34 O ATOM 2319 CB CYS A 153 19.135 -11.305 -20.466 1.00 34.23 C ATOM 2320 SG CYS A 153 18.086 -12.377 -19.464 1.00 61.21 S ATOM 0 H CYS A 153 19.535 -10.170 -18.317 1.00 61.31 H new ATOM 0 HA CYS A 153 21.022 -12.072 -19.797 1.00 53.15 H new ATOM 0 HB2 CYS A 153 18.651 -10.334 -20.569 1.00 34.23 H new ATOM 0 HB3 CYS A 153 19.218 -11.728 -21.467 1.00 34.23 H new ATOM 0 HG CYS A 153 18.000 -11.897 -18.259 1.00 61.21 H new ATOM 2326 N LYS A 154 21.351 -8.941 -20.639 1.00 22.30 N ATOM 2327 CA LYS A 154 22.145 -8.025 -21.454 1.00 22.43 C ATOM 2328 C LYS A 154 23.610 -8.211 -21.094 1.00 64.23 C ATOM 2329 O LYS A 154 24.507 -7.974 -21.910 1.00 62.20 O ATOM 2330 CB LYS A 154 21.715 -6.572 -21.207 1.00 50.53 C ATOM 2331 CG LYS A 154 20.226 -6.316 -21.434 1.00 64.15 C ATOM 2332 CD LYS A 154 19.798 -6.644 -22.857 1.00 53.13 C ATOM 2333 CE LYS A 154 18.298 -6.451 -23.039 1.00 13.32 C ATOM 2334 NZ LYS A 154 17.867 -6.738 -24.430 1.00 63.21 N ATOM 0 H LYS A 154 20.796 -8.488 -19.913 1.00 22.30 H new ATOM 0 HA LYS A 154 21.990 -8.243 -22.511 1.00 22.43 H new ATOM 0 HB2 LYS A 154 21.968 -6.298 -20.183 1.00 50.53 H new ATOM 0 HB3 LYS A 154 22.289 -5.918 -21.863 1.00 50.53 H new ATOM 0 HG2 LYS A 154 19.645 -6.916 -20.734 1.00 64.15 H new ATOM 0 HG3 LYS A 154 20.002 -5.271 -21.220 1.00 64.15 H new ATOM 0 HD2 LYS A 154 20.337 -6.007 -23.558 1.00 53.13 H new ATOM 0 HD3 LYS A 154 20.066 -7.674 -23.092 1.00 53.13 H new ATOM 0 HE2 LYS A 154 17.762 -7.105 -22.351 1.00 13.32 H new ATOM 0 HE3 LYS A 154 18.030 -5.427 -22.780 1.00 13.32 H new ATOM 0 HZ1 LYS A 154 16.840 -6.595 -24.512 1.00 63.21 H new ATOM 0 HZ2 LYS A 154 18.359 -6.097 -25.085 1.00 63.21 H new ATOM 0 HZ3 LYS A 154 18.099 -7.723 -24.669 1.00 63.21 H new