USER MOD reduce.3.24.130724 H: found=0, std=0, add=1347, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1347 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 SER OG : rot 67:sc= 0.688 USER MOD Set 1.2: A 135 SER OG : rot -170:sc= -0.648 USER MOD Set 2.1: A 74 THR OG1 : rot 180:sc= 0.422 USER MOD Set 2.2: A 76 ASN : amide:sc= 0.52 K(o=0.94,f=-0.59!) USER MOD Set 3.1: A 34 MET CE :methyl -163:sc= -1.86 (180deg=-1.8) USER MOD Set 3.2: A 51 MET CE :methyl 177:sc= -1.94 (180deg=-2.09) USER MOD Set 4.1: A 46 SER OG : rot 92:sc= 1.62 USER MOD Set 4.2: A 49 MET CE :methyl -120:sc= -4.22! (180deg=-4.96!) USER MOD Set 5.1: A 22 LYS NZ :NH3+ -152:sc= -0.5 (180deg=-2.16!) USER MOD Set 5.2: A 23 THR OG1 : rot 180:sc= 0.591 USER MOD Single : A 1 MET CE :methyl -167:sc= -0.0453 (180deg=-0.306) USER MOD Single : A 1 MET N :NH3+ -127:sc= 0.0595 (180deg=-0.0248) USER MOD Single : A 3 SER OG : rot -38:sc= 0.486 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 ASN : amide:sc= -0.109 X(o=-0.11,f=-0.096) USER MOD Single : A 10 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 13 HIS : no HE2:sc= 0.769 K(o=0.77,f=-5.6!) USER MOD Single : A 25 LYS NZ :NH3+ -172:sc= 0.546 (180deg=0.394) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 GLN : amide:sc= -0.0178 X(o=-0.018,f=-0.5) USER MOD Single : A 42 LYS NZ :NH3+ 165:sc= -0.0395 (180deg=-0.259) USER MOD Single : A 45 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00444) USER MOD Single : A 48 TYR OH : rot 165:sc= 0 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ -171:sc= 1.3 (180deg=1.14) USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 THR OG1 : rot 100:sc= -1.01 USER MOD Single : A 112 MET CE :methyl -177:sc= -1.84 (180deg=-2.05) USER MOD Single : A 115 LYS NZ :NH3+ 164:sc= -0.0236 (180deg=-0.192) USER MOD Single : A 126 LYS NZ :NH3+ 166:sc= -2.11 (180deg=-2.62!) USER MOD Single : A 130 THR OG1 : rot 180:sc= 0 USER MOD Single : A 134 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 GLN : amide:sc= -0.214 K(o=-0.21,f=-5!) USER MOD Single : A 146 GLN :FLIP amide:sc= -0.232 F(o=-2.3!,f=-0.23) USER MOD Single : A 150 SER OG : rot 180:sc= 0 USER MOD Single : A 152 GLN : amide:sc= -0.223 X(o=-0.22,f=0) USER MOD Single : A 157 SER OG : rot 104:sc= 0.934 USER MOD Single : A 160 SER OG : rot 180:sc= 0 USER MOD Single : A 164 THR OG1 : rot -12:sc= -0.0656! USER MOD Single : A 168 MET CE :methyl 150:sc= -0.618 (180deg=-2.02!) USER MOD Single : A 169 GLN :FLIP amide:sc= 0 F(o=-1,f=0) USER MOD Single : A 171 THR OG1 : rot 180:sc= -0.404 USER MOD Single : A 172 THR OG1 : rot 180:sc= 0.636 USER MOD Single : A 173 SER OG : rot 180:sc= 0 USER MOD Single : A 180 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -31.009 -7.795 -14.792 1.00 33.65 N ATOM 2 CA MET A 1 -31.969 -8.860 -14.423 1.00 33.45 C ATOM 3 C MET A 1 -31.416 -10.220 -14.810 1.00 33.18 C ATOM 4 O MET A 1 -30.538 -10.311 -15.669 1.00 33.13 O ATOM 5 CB MET A 1 -33.320 -8.646 -15.116 1.00 33.33 C ATOM 6 CG MET A 1 -33.998 -7.332 -14.760 1.00 33.70 C ATOM 7 SD MET A 1 -34.221 -7.116 -12.983 1.00 34.05 S ATOM 8 CE MET A 1 -35.314 -8.484 -12.606 1.00 34.32 C ATOM 0 H1 MET A 1 -30.814 -7.200 -13.961 1.00 33.65 H new ATOM 0 H2 MET A 1 -30.123 -8.226 -15.125 1.00 33.65 H new ATOM 0 H3 MET A 1 -31.415 -7.209 -15.550 1.00 33.65 H new ATOM 0 HA MET A 1 -32.118 -8.818 -13.344 1.00 33.45 H new ATOM 0 HB2 MET A 1 -33.173 -8.686 -16.195 1.00 33.33 H new ATOM 0 HB3 MET A 1 -33.985 -9.469 -14.854 1.00 33.33 H new ATOM 0 HG2 MET A 1 -33.404 -6.505 -15.150 1.00 33.70 H new ATOM 0 HG3 MET A 1 -34.970 -7.286 -15.251 1.00 33.70 H new ATOM 0 HE1 MET A 1 -35.726 -8.355 -11.605 1.00 34.32 H new ATOM 0 HE2 MET A 1 -36.126 -8.512 -13.332 1.00 34.32 H new ATOM 0 HE3 MET A 1 -34.755 -9.419 -12.651 1.00 34.32 H new ATOM 20 N GLY A 2 -31.935 -11.272 -14.188 1.00 33.09 N ATOM 21 CA GLY A 2 -31.497 -12.620 -14.500 1.00 32.90 C ATOM 22 C GLY A 2 -32.092 -13.127 -15.799 1.00 32.89 C ATOM 23 O GLY A 2 -32.864 -14.088 -15.805 1.00 32.86 O ATOM 0 H GLY A 2 -32.656 -11.215 -13.469 1.00 33.09 H new ATOM 0 HA2 GLY A 2 -30.409 -12.641 -14.568 1.00 32.90 H new ATOM 0 HA3 GLY A 2 -31.779 -13.289 -13.687 1.00 32.90 H new ATOM 27 N SER A 3 -31.743 -12.472 -16.896 1.00 32.98 N ATOM 28 CA SER A 3 -32.266 -12.825 -18.207 1.00 33.04 C ATOM 29 C SER A 3 -31.345 -12.288 -19.304 1.00 32.62 C ATOM 30 O SER A 3 -31.683 -12.322 -20.489 1.00 32.63 O ATOM 31 CB SER A 3 -33.684 -12.255 -18.365 1.00 33.70 C ATOM 32 OG SER A 3 -34.307 -12.701 -19.561 1.00 34.12 O ATOM 0 H SER A 3 -31.093 -11.686 -16.903 1.00 32.98 H new ATOM 0 HA SER A 3 -32.309 -13.910 -18.298 1.00 33.04 H new ATOM 0 HB2 SER A 3 -34.291 -12.550 -17.509 1.00 33.70 H new ATOM 0 HB3 SER A 3 -33.639 -11.166 -18.364 1.00 33.70 H new ATOM 0 HG SER A 3 -33.643 -12.742 -20.280 1.00 34.12 H new ATOM 38 N ALA A 4 -30.176 -11.800 -18.904 1.00 32.32 N ATOM 39 CA ALA A 4 -29.245 -11.185 -19.836 1.00 31.97 C ATOM 40 C ALA A 4 -27.910 -11.915 -19.825 1.00 31.64 C ATOM 41 O ALA A 4 -27.079 -11.698 -18.942 1.00 31.19 O ATOM 42 CB ALA A 4 -29.051 -9.713 -19.494 1.00 31.74 C ATOM 0 H ALA A 4 -29.852 -11.820 -17.937 1.00 32.32 H new ATOM 0 HA ALA A 4 -29.664 -11.258 -20.840 1.00 31.97 H new ATOM 0 HB1 ALA A 4 -28.352 -9.265 -20.200 1.00 31.74 H new ATOM 0 HB2 ALA A 4 -30.009 -9.196 -19.554 1.00 31.74 H new ATOM 0 HB3 ALA A 4 -28.654 -9.624 -18.483 1.00 31.74 H new ATOM 48 N THR A 5 -27.716 -12.790 -20.797 1.00 31.95 N ATOM 49 CA THR A 5 -26.491 -13.563 -20.900 1.00 31.80 C ATOM 50 C THR A 5 -25.310 -12.677 -21.296 1.00 31.31 C ATOM 51 O THR A 5 -25.294 -12.087 -22.375 1.00 31.16 O ATOM 52 CB THR A 5 -26.644 -14.701 -21.927 1.00 32.30 C ATOM 53 OG1 THR A 5 -27.787 -15.498 -21.595 1.00 32.53 O ATOM 54 CG2 THR A 5 -25.403 -15.583 -21.963 1.00 32.74 C ATOM 0 H THR A 5 -28.397 -12.983 -21.531 1.00 31.95 H new ATOM 0 HA THR A 5 -26.295 -13.992 -19.917 1.00 31.80 H new ATOM 0 HB THR A 5 -26.775 -14.254 -22.912 1.00 32.30 H new ATOM 0 HG1 THR A 5 -27.884 -16.220 -22.250 1.00 32.53 H new ATOM 0 HG21 THR A 5 -25.542 -16.377 -22.697 1.00 32.74 H new ATOM 0 HG22 THR A 5 -24.537 -14.981 -22.238 1.00 32.74 H new ATOM 0 HG23 THR A 5 -25.241 -16.023 -20.979 1.00 32.74 H new ATOM 62 N VAL A 6 -24.331 -12.583 -20.409 1.00 31.15 N ATOM 63 CA VAL A 6 -23.124 -11.822 -20.679 1.00 30.77 C ATOM 64 C VAL A 6 -22.018 -12.769 -21.128 1.00 30.24 C ATOM 65 O VAL A 6 -21.650 -13.693 -20.400 1.00 30.59 O ATOM 66 CB VAL A 6 -22.656 -11.039 -19.430 1.00 31.07 C ATOM 67 CG1 VAL A 6 -21.436 -10.186 -19.746 1.00 31.29 C ATOM 68 CG2 VAL A 6 -23.786 -10.179 -18.882 1.00 31.20 C ATOM 0 H VAL A 6 -24.351 -13.028 -19.491 1.00 31.15 H new ATOM 0 HA VAL A 6 -23.346 -11.102 -21.466 1.00 30.77 H new ATOM 0 HB VAL A 6 -22.372 -11.762 -18.665 1.00 31.07 H new ATOM 0 HG11 VAL A 6 -21.128 -9.646 -18.851 1.00 31.29 H new ATOM 0 HG12 VAL A 6 -20.621 -10.827 -20.082 1.00 31.29 H new ATOM 0 HG13 VAL A 6 -21.684 -9.473 -20.532 1.00 31.29 H new ATOM 0 HG21 VAL A 6 -23.437 -9.636 -18.004 1.00 31.20 H new ATOM 0 HG22 VAL A 6 -24.105 -9.469 -19.645 1.00 31.20 H new ATOM 0 HG23 VAL A 6 -24.626 -10.816 -18.605 1.00 31.20 H new ATOM 78 N ASN A 7 -21.506 -12.557 -22.331 1.00 29.46 N ATOM 79 CA ASN A 7 -20.460 -13.418 -22.869 1.00 28.96 C ATOM 80 C ASN A 7 -19.085 -12.806 -22.648 1.00 28.50 C ATOM 81 O ASN A 7 -18.928 -11.583 -22.657 1.00 28.42 O ATOM 82 CB ASN A 7 -20.679 -13.701 -24.362 1.00 28.74 C ATOM 83 CG ASN A 7 -20.834 -12.436 -25.189 1.00 28.54 C ATOM 84 OD1 ASN A 7 -19.855 -11.836 -25.630 1.00 28.57 O ATOM 85 ND2 ASN A 7 -22.072 -12.031 -25.422 1.00 28.41 N ATOM 0 H ASN A 7 -21.795 -11.801 -22.952 1.00 29.46 H new ATOM 0 HA ASN A 7 -20.511 -14.365 -22.332 1.00 28.96 H new ATOM 0 HB2 ASN A 7 -19.837 -14.278 -24.744 1.00 28.74 H new ATOM 0 HB3 ASN A 7 -21.569 -14.319 -24.482 1.00 28.74 H new ATOM 0 HD21 ASN A 7 -22.238 -11.196 -25.984 1.00 28.41 H new ATOM 0 HD22 ASN A 7 -22.860 -12.554 -25.040 1.00 28.41 H new ATOM 92 N GLY A 8 -18.096 -13.665 -22.445 1.00 28.28 N ATOM 93 CA GLY A 8 -16.742 -13.207 -22.231 1.00 27.93 C ATOM 94 C GLY A 8 -15.738 -14.335 -22.352 1.00 27.61 C ATOM 95 O GLY A 8 -15.931 -15.409 -21.779 1.00 27.61 O ATOM 0 H GLY A 8 -18.211 -14.678 -22.425 1.00 28.28 H new ATOM 0 HA2 GLY A 8 -16.503 -12.429 -22.956 1.00 27.93 H new ATOM 0 HA3 GLY A 8 -16.664 -12.756 -21.242 1.00 27.93 H new ATOM 99 N PRO A 9 -14.661 -14.124 -23.113 1.00 27.42 N ATOM 100 CA PRO A 9 -13.601 -15.109 -23.293 1.00 27.20 C ATOM 101 C PRO A 9 -12.542 -15.013 -22.199 1.00 26.67 C ATOM 102 O PRO A 9 -12.611 -14.147 -21.324 1.00 26.59 O ATOM 103 CB PRO A 9 -13.015 -14.704 -24.643 1.00 27.23 C ATOM 104 CG PRO A 9 -13.160 -13.221 -24.681 1.00 27.37 C ATOM 105 CD PRO A 9 -14.391 -12.888 -23.868 1.00 27.51 C ATOM 0 HA PRO A 9 -13.961 -16.137 -23.248 1.00 27.20 H new ATOM 0 HB2 PRO A 9 -11.970 -15.003 -24.728 1.00 27.23 H new ATOM 0 HB3 PRO A 9 -13.550 -15.177 -25.466 1.00 27.23 H new ATOM 0 HG2 PRO A 9 -12.278 -12.734 -24.266 1.00 27.37 H new ATOM 0 HG3 PRO A 9 -13.266 -12.868 -25.707 1.00 27.37 H new ATOM 0 HD2 PRO A 9 -14.214 -12.044 -23.202 1.00 27.51 H new ATOM 0 HD3 PRO A 9 -15.232 -12.619 -24.508 1.00 27.51 H new ATOM 113 N HIS A 10 -11.562 -15.905 -22.245 1.00 26.41 N ATOM 114 CA HIS A 10 -10.472 -15.879 -21.281 1.00 25.98 C ATOM 115 C HIS A 10 -9.364 -14.964 -21.784 1.00 25.20 C ATOM 116 O HIS A 10 -8.356 -15.422 -22.328 1.00 24.97 O ATOM 117 CB HIS A 10 -9.921 -17.286 -21.017 1.00 26.32 C ATOM 118 CG HIS A 10 -10.929 -18.238 -20.443 1.00 26.28 C ATOM 119 ND1 HIS A 10 -11.380 -18.166 -19.143 1.00 26.46 N ATOM 120 CD2 HIS A 10 -11.569 -19.290 -21.002 1.00 26.19 C ATOM 121 CE1 HIS A 10 -12.251 -19.132 -18.928 1.00 26.48 C ATOM 122 NE2 HIS A 10 -12.384 -19.831 -20.039 1.00 26.32 N ATOM 0 H HIS A 10 -11.500 -16.652 -22.936 1.00 26.41 H new ATOM 0 HA HIS A 10 -10.861 -15.495 -20.338 1.00 25.98 H new ATOM 0 HB2 HIS A 10 -9.539 -17.697 -21.952 1.00 26.32 H new ATOM 0 HB3 HIS A 10 -9.076 -17.212 -20.333 1.00 26.32 H new ATOM 0 HD2 HIS A 10 -11.459 -19.640 -22.018 1.00 26.19 H new ATOM 0 HE1 HIS A 10 -12.769 -19.320 -17.999 1.00 26.48 H new ATOM 0 HE2 HIS A 10 -12.992 -20.640 -20.162 1.00 26.32 H new ATOM 131 N ASP A 11 -9.565 -13.671 -21.601 1.00 24.90 N ATOM 132 CA ASP A 11 -8.655 -12.658 -22.122 1.00 24.25 C ATOM 133 C ASP A 11 -7.333 -12.647 -21.363 1.00 23.73 C ATOM 134 O ASP A 11 -7.285 -12.910 -20.159 1.00 23.90 O ATOM 135 CB ASP A 11 -9.315 -11.280 -22.035 1.00 24.28 C ATOM 136 CG ASP A 11 -8.393 -10.169 -22.495 1.00 24.24 C ATOM 137 OD1 ASP A 11 -7.657 -10.371 -23.484 1.00 24.51 O1- ATOM 138 OD2 ASP A 11 -8.397 -9.089 -21.865 1.00 24.02 O ATOM 0 H ASP A 11 -10.361 -13.291 -21.089 1.00 24.90 H new ATOM 0 HA ASP A 11 -8.440 -12.901 -23.163 1.00 24.25 H new ATOM 0 HB2 ASP A 11 -10.219 -11.274 -22.644 1.00 24.28 H new ATOM 0 HB3 ASP A 11 -9.622 -11.091 -21.006 1.00 24.28 H new ATOM 143 N GLY A 12 -6.259 -12.359 -22.085 1.00 23.19 N ATOM 144 CA GLY A 12 -4.946 -12.329 -21.488 1.00 22.76 C ATOM 145 C GLY A 12 -4.057 -11.281 -22.120 1.00 21.82 C ATOM 146 O GLY A 12 -2.848 -11.489 -22.257 1.00 21.65 O ATOM 0 H GLY A 12 -6.278 -12.144 -23.082 1.00 23.19 H new ATOM 0 HA2 GLY A 12 -5.038 -12.129 -20.420 1.00 22.76 H new ATOM 0 HA3 GLY A 12 -4.479 -13.309 -21.590 1.00 22.76 H new ATOM 150 N HIS A 13 -4.651 -10.161 -22.523 1.00 21.31 N ATOM 151 CA HIS A 13 -3.885 -9.048 -23.070 1.00 20.46 C ATOM 152 C HIS A 13 -4.459 -7.726 -22.567 1.00 19.83 C ATOM 153 O HIS A 13 -5.639 -7.431 -22.759 1.00 19.78 O ATOM 154 CB HIS A 13 -3.837 -9.102 -24.614 1.00 20.39 C ATOM 155 CG HIS A 13 -5.026 -8.530 -25.341 1.00 20.50 C ATOM 156 ND1 HIS A 13 -6.311 -9.005 -25.201 1.00 20.49 N ATOM 157 CD2 HIS A 13 -5.103 -7.516 -26.237 1.00 20.77 C ATOM 158 CE1 HIS A 13 -7.123 -8.316 -25.979 1.00 20.74 C ATOM 159 NE2 HIS A 13 -6.418 -7.403 -26.619 1.00 20.92 N ATOM 0 H HIS A 13 -5.658 -10.001 -22.481 1.00 21.31 H new ATOM 0 HA HIS A 13 -2.855 -9.128 -22.722 1.00 20.46 H new ATOM 0 HB2 HIS A 13 -2.945 -8.571 -24.947 1.00 20.39 H new ATOM 0 HB3 HIS A 13 -3.720 -10.143 -24.916 1.00 20.39 H new ATOM 0 HD1 HIS A 13 -6.592 -9.772 -24.590 1.00 20.49 H new ATOM 0 HD2 HIS A 13 -4.281 -6.908 -26.587 1.00 20.77 H new ATOM 0 HE1 HIS A 13 -8.187 -8.473 -26.076 1.00 20.74 H new ATOM 168 N ASP A 14 -3.631 -6.949 -21.895 1.00 19.48 N ATOM 169 CA ASP A 14 -4.086 -5.705 -21.299 1.00 18.98 C ATOM 170 C ASP A 14 -3.288 -4.527 -21.828 1.00 18.18 C ATOM 171 O ASP A 14 -2.068 -4.612 -21.960 1.00 18.03 O ATOM 172 CB ASP A 14 -3.975 -5.757 -19.772 1.00 19.31 C ATOM 173 CG ASP A 14 -4.981 -6.698 -19.140 1.00 19.60 C ATOM 174 OD1 ASP A 14 -4.745 -7.923 -19.136 1.00 19.65 O1- ATOM 175 OD2 ASP A 14 -6.013 -6.208 -18.635 1.00 19.89 O ATOM 0 H ASP A 14 -2.643 -7.155 -21.748 1.00 19.48 H new ATOM 0 HA ASP A 14 -5.133 -5.574 -21.572 1.00 18.98 H new ATOM 0 HB2 ASP A 14 -2.968 -6.071 -19.496 1.00 19.31 H new ATOM 0 HB3 ASP A 14 -4.118 -4.755 -19.368 1.00 19.31 H new ATOM 180 N PRO A 15 -3.962 -3.416 -22.154 1.00 17.80 N ATOM 181 CA PRO A 15 -3.286 -2.183 -22.559 1.00 17.14 C ATOM 182 C PRO A 15 -2.552 -1.535 -21.389 1.00 16.68 C ATOM 183 O PRO A 15 -2.985 -1.638 -20.240 1.00 16.69 O ATOM 184 CB PRO A 15 -4.429 -1.286 -23.047 1.00 17.09 C ATOM 185 CG PRO A 15 -5.644 -1.801 -22.355 1.00 17.72 C ATOM 186 CD PRO A 15 -5.430 -3.279 -22.175 1.00 18.12 C ATOM 0 HA PRO A 15 -2.525 -2.358 -23.319 1.00 17.14 H new ATOM 0 HB2 PRO A 15 -4.245 -0.241 -22.797 1.00 17.09 H new ATOM 0 HB3 PRO A 15 -4.539 -1.340 -24.130 1.00 17.09 H new ATOM 0 HG2 PRO A 15 -5.782 -1.308 -21.393 1.00 17.72 H new ATOM 0 HG3 PRO A 15 -6.540 -1.606 -22.945 1.00 17.72 H new ATOM 0 HD2 PRO A 15 -5.880 -3.640 -21.250 1.00 18.12 H new ATOM 0 HD3 PRO A 15 -5.875 -3.851 -22.990 1.00 18.12 H new ATOM 194 N ALA A 16 -1.437 -0.882 -21.676 1.00 16.42 N ATOM 195 CA ALA A 16 -0.648 -0.234 -20.639 1.00 16.13 C ATOM 196 C ALA A 16 -1.012 1.241 -20.510 1.00 15.32 C ATOM 197 O ALA A 16 -1.214 1.752 -19.406 1.00 15.30 O ATOM 198 CB ALA A 16 0.837 -0.388 -20.929 1.00 16.58 C ATOM 0 H ALA A 16 -1.058 -0.786 -22.618 1.00 16.42 H new ATOM 0 HA ALA A 16 -0.874 -0.721 -19.691 1.00 16.13 H new ATOM 0 HB1 ALA A 16 1.414 0.102 -20.144 1.00 16.58 H new ATOM 0 HB2 ALA A 16 1.094 -1.447 -20.961 1.00 16.58 H new ATOM 0 HB3 ALA A 16 1.069 0.070 -21.890 1.00 16.58 H new ATOM 204 N ALA A 17 -1.115 1.915 -21.644 1.00 14.80 N ATOM 205 CA ALA A 17 -1.375 3.346 -21.658 1.00 14.13 C ATOM 206 C ALA A 17 -2.870 3.636 -21.594 1.00 13.59 C ATOM 207 O ALA A 17 -3.497 3.963 -22.602 1.00 13.72 O ATOM 208 CB ALA A 17 -0.756 3.982 -22.893 1.00 14.36 C ATOM 0 H ALA A 17 -1.022 1.494 -22.568 1.00 14.80 H new ATOM 0 HA ALA A 17 -0.915 3.783 -20.772 1.00 14.13 H new ATOM 0 HB1 ALA A 17 -0.958 5.053 -22.891 1.00 14.36 H new ATOM 0 HB2 ALA A 17 0.321 3.816 -22.887 1.00 14.36 H new ATOM 0 HB3 ALA A 17 -1.187 3.533 -23.788 1.00 14.36 H new ATOM 214 N GLY A 18 -3.440 3.487 -20.410 1.00 13.17 N ATOM 215 CA GLY A 18 -4.832 3.830 -20.208 1.00 12.81 C ATOM 216 C GLY A 18 -4.973 5.165 -19.508 1.00 12.32 C ATOM 217 O GLY A 18 -5.046 6.209 -20.153 1.00 12.26 O ATOM 0 H GLY A 18 -2.962 3.133 -19.581 1.00 13.17 H new ATOM 0 HA2 GLY A 18 -5.343 3.865 -21.170 1.00 12.81 H new ATOM 0 HA3 GLY A 18 -5.318 3.054 -19.617 1.00 12.81 H new ATOM 221 N ALA A 19 -4.985 5.129 -18.184 1.00 12.17 N ATOM 222 CA ALA A 19 -5.044 6.342 -17.389 1.00 11.91 C ATOM 223 C ALA A 19 -4.115 6.217 -16.191 1.00 11.79 C ATOM 224 O ALA A 19 -3.027 6.792 -16.181 1.00 11.90 O ATOM 225 CB ALA A 19 -6.468 6.632 -16.944 1.00 11.75 C ATOM 0 H ALA A 19 -4.954 4.268 -17.638 1.00 12.17 H new ATOM 0 HA ALA A 19 -4.715 7.180 -18.003 1.00 11.91 H new ATOM 0 HB1 ALA A 19 -6.485 7.546 -16.350 1.00 11.75 H new ATOM 0 HB2 ALA A 19 -7.105 6.757 -17.820 1.00 11.75 H new ATOM 0 HB3 ALA A 19 -6.837 5.802 -16.342 1.00 11.75 H new ATOM 231 N GLU A 20 -4.532 5.442 -15.196 1.00 11.76 N ATOM 232 CA GLU A 20 -3.692 5.173 -14.040 1.00 11.81 C ATOM 233 C GLU A 20 -4.222 3.972 -13.257 1.00 11.36 C ATOM 234 O GLU A 20 -4.745 4.106 -12.151 1.00 11.31 O ATOM 235 CB GLU A 20 -3.589 6.418 -13.149 1.00 12.34 C ATOM 236 CG GLU A 20 -2.574 6.304 -12.026 1.00 12.69 C ATOM 237 CD GLU A 20 -2.333 7.631 -11.339 1.00 13.43 C ATOM 238 OE1 GLU A 20 -3.257 8.137 -10.669 1.00 13.77 O1- ATOM 239 OE2 GLU A 20 -1.224 8.188 -11.492 1.00 13.82 O ATOM 0 H GLU A 20 -5.446 4.990 -15.169 1.00 11.76 H new ATOM 0 HA GLU A 20 -2.689 4.927 -14.389 1.00 11.81 H new ATOM 0 HB2 GLU A 20 -3.329 7.274 -13.771 1.00 12.34 H new ATOM 0 HB3 GLU A 20 -4.569 6.623 -12.717 1.00 12.34 H new ATOM 0 HG2 GLU A 20 -2.924 5.576 -11.294 1.00 12.69 H new ATOM 0 HG3 GLU A 20 -1.633 5.927 -12.426 1.00 12.69 H new ATOM 246 N LEU A 21 -4.100 2.802 -13.897 1.00 11.26 N ATOM 247 CA LEU A 21 -4.387 1.489 -13.309 1.00 11.08 C ATOM 248 C LEU A 21 -5.869 1.337 -13.021 1.00 10.75 C ATOM 249 O LEU A 21 -6.614 0.676 -13.744 1.00 10.51 O ATOM 250 CB LEU A 21 -3.565 1.289 -12.029 1.00 11.53 C ATOM 251 CG LEU A 21 -3.404 -0.162 -11.546 1.00 11.78 C ATOM 252 CD1 LEU A 21 -2.249 -0.261 -10.563 1.00 11.96 C ATOM 253 CD2 LEU A 21 -4.684 -0.666 -10.891 1.00 12.13 C ATOM 0 H LEU A 21 -3.790 2.742 -14.867 1.00 11.26 H new ATOM 0 HA LEU A 21 -4.104 0.721 -14.029 1.00 11.08 H new ATOM 0 HB2 LEU A 21 -2.572 1.709 -12.190 1.00 11.53 H new ATOM 0 HB3 LEU A 21 -4.029 1.867 -11.230 1.00 11.53 H new ATOM 0 HG LEU A 21 -3.193 -0.786 -12.415 1.00 11.78 H new ATOM 0 HD11 LEU A 21 -2.144 -1.293 -10.228 1.00 11.96 H new ATOM 0 HD12 LEU A 21 -1.328 0.057 -11.051 1.00 11.96 H new ATOM 0 HD13 LEU A 21 -2.446 0.381 -9.705 1.00 11.96 H new ATOM 0 HD21 LEU A 21 -4.542 -1.694 -10.559 1.00 12.13 H new ATOM 0 HD22 LEU A 21 -4.926 -0.038 -10.034 1.00 12.13 H new ATOM 0 HD23 LEU A 21 -5.501 -0.627 -11.611 1.00 12.13 H new ATOM 265 N LYS A 22 -6.257 2.012 -11.954 1.00 10.97 N ATOM 266 CA LYS A 22 -7.527 1.801 -11.263 1.00 10.97 C ATOM 267 C LYS A 22 -8.688 2.113 -12.174 1.00 10.51 C ATOM 268 O LYS A 22 -9.681 1.394 -12.208 1.00 10.50 O ATOM 269 CB LYS A 22 -7.592 2.699 -10.028 1.00 11.77 C ATOM 270 CG LYS A 22 -8.809 2.451 -9.150 1.00 12.31 C ATOM 271 CD LYS A 22 -8.912 3.464 -8.017 1.00 13.08 C ATOM 272 CE LYS A 22 -9.638 4.738 -8.441 1.00 13.66 C ATOM 273 NZ LYS A 22 -8.907 5.509 -9.486 1.00 14.10 N1+ ATOM 0 H LYS A 22 -5.686 2.743 -11.529 1.00 10.97 H new ATOM 0 HA LYS A 22 -7.590 0.755 -10.963 1.00 10.97 H new ATOM 0 HB2 LYS A 22 -6.691 2.549 -9.434 1.00 11.77 H new ATOM 0 HB3 LYS A 22 -7.593 3.741 -10.348 1.00 11.77 H new ATOM 0 HG2 LYS A 22 -9.711 2.496 -9.760 1.00 12.31 H new ATOM 0 HG3 LYS A 22 -8.756 1.445 -8.733 1.00 12.31 H new ATOM 0 HD2 LYS A 22 -9.438 3.012 -7.176 1.00 13.08 H new ATOM 0 HD3 LYS A 22 -7.911 3.718 -7.668 1.00 13.08 H new ATOM 0 HE2 LYS A 22 -10.627 4.477 -8.816 1.00 13.66 H new ATOM 0 HE3 LYS A 22 -9.786 5.372 -7.567 1.00 13.66 H new ATOM 0 HZ1 LYS A 22 -9.145 6.518 -9.403 1.00 14.10 H new ATOM 0 HZ2 LYS A 22 -7.883 5.383 -9.357 1.00 14.10 H new ATOM 0 HZ3 LYS A 22 -9.182 5.165 -10.428 1.00 14.10 H new ATOM 287 N THR A 23 -8.547 3.210 -12.885 1.00 10.33 N ATOM 288 CA THR A 23 -9.558 3.667 -13.811 1.00 10.01 C ATOM 289 C THR A 23 -8.932 3.948 -15.157 1.00 10.01 C ATOM 290 O THR A 23 -9.244 4.932 -15.822 1.00 10.38 O ATOM 291 CB THR A 23 -10.271 4.917 -13.269 1.00 10.64 C ATOM 292 OG1 THR A 23 -9.416 5.580 -12.324 1.00 10.93 O ATOM 293 CG2 THR A 23 -11.589 4.549 -12.606 1.00 11.05 C ATOM 0 H THR A 23 -7.725 3.812 -12.837 1.00 10.33 H new ATOM 0 HA THR A 23 -10.305 2.882 -13.929 1.00 10.01 H new ATOM 0 HB THR A 23 -10.487 5.585 -14.103 1.00 10.64 H new ATOM 0 HG1 THR A 23 -9.867 6.378 -11.978 1.00 10.93 H new ATOM 0 HG21 THR A 23 -12.072 5.451 -12.232 1.00 11.05 H new ATOM 0 HG22 THR A 23 -12.240 4.064 -13.334 1.00 11.05 H new ATOM 0 HG23 THR A 23 -11.401 3.867 -11.777 1.00 11.05 H new ATOM 301 N GLY A 24 -8.018 3.069 -15.534 1.00 9.82 N ATOM 302 CA GLY A 24 -7.420 3.142 -16.839 1.00 10.05 C ATOM 303 C GLY A 24 -8.222 2.387 -17.843 1.00 9.39 C ATOM 304 O GLY A 24 -8.332 2.785 -19.001 1.00 9.61 O ATOM 0 H GLY A 24 -7.681 2.303 -14.951 1.00 9.82 H new ATOM 0 HA2 GLY A 24 -7.337 4.185 -17.146 1.00 10.05 H new ATOM 0 HA3 GLY A 24 -6.408 2.739 -16.801 1.00 10.05 H new ATOM 308 N LYS A 25 -8.785 1.289 -17.383 1.00 8.70 N ATOM 309 CA LYS A 25 -9.505 0.394 -18.246 1.00 8.11 C ATOM 310 C LYS A 25 -10.220 -0.668 -17.435 1.00 7.19 C ATOM 311 O LYS A 25 -10.094 -1.852 -17.689 1.00 6.94 O ATOM 312 CB LYS A 25 -8.553 -0.213 -19.297 1.00 8.62 C ATOM 313 CG LYS A 25 -7.159 -0.606 -18.771 1.00 9.02 C ATOM 314 CD LYS A 25 -7.211 -1.509 -17.549 1.00 9.74 C ATOM 315 CE LYS A 25 -7.390 -2.976 -17.913 1.00 10.22 C ATOM 316 NZ LYS A 25 -6.165 -3.555 -18.518 1.00 10.38 N1+ ATOM 0 H LYS A 25 -8.753 0.999 -16.406 1.00 8.70 H new ATOM 0 HA LYS A 25 -10.271 0.952 -18.784 1.00 8.11 H new ATOM 0 HB2 LYS A 25 -9.025 -1.098 -19.724 1.00 8.62 H new ATOM 0 HB3 LYS A 25 -8.429 0.504 -20.108 1.00 8.62 H new ATOM 0 HG2 LYS A 25 -6.608 -1.111 -19.564 1.00 9.02 H new ATOM 0 HG3 LYS A 25 -6.604 0.298 -18.523 1.00 9.02 H new ATOM 0 HD2 LYS A 25 -6.292 -1.390 -16.975 1.00 9.74 H new ATOM 0 HD3 LYS A 25 -8.032 -1.195 -16.905 1.00 9.74 H new ATOM 0 HE2 LYS A 25 -7.654 -3.541 -17.019 1.00 10.22 H new ATOM 0 HE3 LYS A 25 -8.221 -3.077 -18.611 1.00 10.22 H new ATOM 0 HZ1 LYS A 25 -6.372 -4.510 -18.873 1.00 10.38 H new ATOM 0 HZ2 LYS A 25 -5.849 -2.954 -19.305 1.00 10.38 H new ATOM 0 HZ3 LYS A 25 -5.415 -3.607 -17.800 1.00 10.38 H new ATOM 330 N ARG A 26 -11.000 -0.220 -16.477 1.00 6.90 N ATOM 331 CA ARG A 26 -11.699 -1.130 -15.580 1.00 6.23 C ATOM 332 C ARG A 26 -13.191 -0.820 -15.567 1.00 5.83 C ATOM 333 O ARG A 26 -13.592 0.340 -15.628 1.00 6.27 O ATOM 334 CB ARG A 26 -11.094 -1.042 -14.180 1.00 6.68 C ATOM 335 CG ARG A 26 -9.620 -1.417 -14.159 1.00 7.16 C ATOM 336 CD ARG A 26 -9.193 -1.966 -12.810 1.00 7.38 C ATOM 337 NE ARG A 26 -7.782 -2.353 -12.808 1.00 7.54 N ATOM 338 CZ ARG A 26 -7.289 -3.382 -12.125 1.00 7.99 C ATOM 339 NH1 ARG A 26 -8.083 -4.129 -11.360 1.00 8.33 N1+ ATOM 340 NH2 ARG A 26 -5.996 -3.669 -12.207 1.00 8.37 N ATOM 0 H ARG A 26 -11.170 0.769 -16.294 1.00 6.90 H new ATOM 0 HA ARG A 26 -11.580 -2.153 -15.937 1.00 6.23 H new ATOM 0 HB2 ARG A 26 -11.213 -0.028 -13.799 1.00 6.68 H new ATOM 0 HB3 ARG A 26 -11.643 -1.701 -13.508 1.00 6.68 H new ATOM 0 HG2 ARG A 26 -9.424 -2.160 -14.932 1.00 7.16 H new ATOM 0 HG3 ARG A 26 -9.019 -0.540 -14.400 1.00 7.16 H new ATOM 0 HD2 ARG A 26 -9.366 -1.215 -12.040 1.00 7.38 H new ATOM 0 HD3 ARG A 26 -9.808 -2.830 -12.557 1.00 7.38 H new ATOM 0 HE ARG A 26 -7.134 -1.797 -13.367 1.00 7.54 H new ATOM 0 HH11 ARG A 26 -9.078 -3.914 -11.295 1.00 8.33 H new ATOM 0 HH12 ARG A 26 -7.696 -4.916 -10.840 1.00 8.33 H new ATOM 0 HH21 ARG A 26 -5.384 -3.101 -12.793 1.00 8.37 H new ATOM 0 HH22 ARG A 26 -5.614 -4.458 -11.684 1.00 8.37 H new ATOM 354 N ILE A 27 -14.004 -1.876 -15.517 1.00 5.15 N ATOM 355 CA ILE A 27 -15.453 -1.759 -15.699 1.00 4.81 C ATOM 356 C ILE A 27 -16.085 -0.781 -14.734 1.00 5.34 C ATOM 357 O ILE A 27 -16.028 -0.949 -13.515 1.00 5.76 O ATOM 358 CB ILE A 27 -16.182 -3.110 -15.542 1.00 4.32 C ATOM 359 CG1 ILE A 27 -15.743 -4.101 -16.612 1.00 4.09 C ATOM 360 CG2 ILE A 27 -17.687 -2.913 -15.593 1.00 4.22 C ATOM 361 CD1 ILE A 27 -16.058 -3.687 -18.028 1.00 4.18 C ATOM 0 H ILE A 27 -13.681 -2.829 -15.351 1.00 5.15 H new ATOM 0 HA ILE A 27 -15.570 -1.394 -16.720 1.00 4.81 H new ATOM 0 HB ILE A 27 -15.914 -3.522 -14.569 1.00 4.32 H new ATOM 0 HG12 ILE A 27 -14.668 -4.255 -16.525 1.00 4.09 H new ATOM 0 HG13 ILE A 27 -16.220 -5.061 -16.415 1.00 4.09 H new ATOM 0 HG21 ILE A 27 -18.184 -3.877 -15.481 1.00 4.22 H new ATOM 0 HG22 ILE A 27 -17.995 -2.250 -14.785 1.00 4.22 H new ATOM 0 HG23 ILE A 27 -17.964 -2.471 -16.550 1.00 4.22 H new ATOM 0 HD11 ILE A 27 -15.708 -4.455 -18.718 1.00 4.18 H new ATOM 0 HD12 ILE A 27 -17.135 -3.563 -18.140 1.00 4.18 H new ATOM 0 HD13 ILE A 27 -15.559 -2.744 -18.251 1.00 4.18 H new ATOM 373 N LEU A 28 -16.703 0.227 -15.312 1.00 5.52 N ATOM 374 CA LEU A 28 -17.474 1.192 -14.568 1.00 6.20 C ATOM 375 C LEU A 28 -18.964 0.996 -14.837 1.00 6.05 C ATOM 376 O LEU A 28 -19.787 1.100 -13.926 1.00 6.59 O ATOM 377 CB LEU A 28 -17.032 2.599 -14.962 1.00 6.86 C ATOM 378 CG LEU A 28 -16.084 3.291 -13.972 1.00 7.51 C ATOM 379 CD1 LEU A 28 -14.797 2.503 -13.801 1.00 8.22 C ATOM 380 CD2 LEU A 28 -15.779 4.710 -14.425 1.00 7.71 C ATOM 0 H LEU A 28 -16.683 0.398 -16.317 1.00 5.52 H new ATOM 0 HA LEU A 28 -17.304 1.053 -13.500 1.00 6.20 H new ATOM 0 HB2 LEU A 28 -16.542 2.549 -15.934 1.00 6.86 H new ATOM 0 HB3 LEU A 28 -17.920 3.220 -15.084 1.00 6.86 H new ATOM 0 HG LEU A 28 -16.586 3.333 -13.005 1.00 7.51 H new ATOM 0 HD11 LEU A 28 -14.146 3.018 -13.094 1.00 8.22 H new ATOM 0 HD12 LEU A 28 -15.028 1.507 -13.423 1.00 8.22 H new ATOM 0 HD13 LEU A 28 -14.292 2.418 -14.763 1.00 8.22 H new ATOM 0 HD21 LEU A 28 -15.106 5.183 -13.710 1.00 7.71 H new ATOM 0 HD22 LEU A 28 -15.306 4.685 -15.407 1.00 7.71 H new ATOM 0 HD23 LEU A 28 -16.706 5.281 -14.483 1.00 7.71 H new ATOM 392 N TYR A 29 -19.307 0.673 -16.085 1.00 5.47 N ATOM 393 CA TYR A 29 -20.707 0.554 -16.482 1.00 5.43 C ATOM 394 C TYR A 29 -20.840 -0.086 -17.865 1.00 4.86 C ATOM 395 O TYR A 29 -19.852 -0.516 -18.466 1.00 4.58 O ATOM 396 CB TYR A 29 -21.357 1.929 -16.482 1.00 6.20 C ATOM 397 CG TYR A 29 -20.906 2.805 -17.634 1.00 6.41 C ATOM 398 CD1 TYR A 29 -19.660 3.408 -17.614 1.00 6.76 C ATOM 399 CD2 TYR A 29 -21.712 3.004 -18.745 1.00 6.48 C ATOM 400 CE1 TYR A 29 -19.226 4.193 -18.666 1.00 7.24 C ATOM 401 CE2 TYR A 29 -21.288 3.783 -19.805 1.00 6.91 C ATOM 402 CZ TYR A 29 -20.045 4.377 -19.759 1.00 7.33 C ATOM 403 OH TYR A 29 -19.622 5.157 -20.814 1.00 7.99 O ATOM 0 H TYR A 29 -18.638 0.490 -16.833 1.00 5.47 H new ATOM 0 HA TYR A 29 -21.212 -0.091 -15.763 1.00 5.43 H new ATOM 0 HB2 TYR A 29 -22.440 1.811 -16.526 1.00 6.20 H new ATOM 0 HB3 TYR A 29 -21.129 2.431 -15.542 1.00 6.20 H new ATOM 0 HD1 TYR A 29 -19.015 3.262 -16.760 1.00 6.76 H new ATOM 0 HD2 TYR A 29 -22.688 2.542 -18.782 1.00 6.48 H new ATOM 0 HE1 TYR A 29 -18.252 4.659 -18.632 1.00 7.24 H new ATOM 0 HE2 TYR A 29 -21.927 3.925 -20.664 1.00 6.91 H new ATOM 0 HH TYR A 29 -20.319 5.182 -21.503 1.00 7.99 H new ATOM 413 N TRP A 30 -22.081 -0.130 -18.351 1.00 4.95 N ATOM 414 CA TRP A 30 -22.438 -0.813 -19.593 1.00 4.73 C ATOM 415 C TRP A 30 -23.148 0.131 -20.552 1.00 5.18 C ATOM 416 O TRP A 30 -23.762 1.109 -20.128 1.00 5.61 O ATOM 417 CB TRP A 30 -23.375 -1.969 -19.271 1.00 4.74 C ATOM 418 CG TRP A 30 -22.680 -3.280 -19.129 1.00 4.48 C ATOM 419 CD1 TRP A 30 -22.684 -4.301 -20.029 1.00 4.66 C ATOM 420 CD2 TRP A 30 -21.882 -3.716 -18.030 1.00 4.33 C ATOM 421 NE1 TRP A 30 -21.946 -5.350 -19.553 1.00 4.65 N ATOM 422 CE2 TRP A 30 -21.444 -5.016 -18.328 1.00 4.37 C ATOM 423 CE3 TRP A 30 -21.497 -3.139 -16.820 1.00 4.46 C ATOM 424 CZ2 TRP A 30 -20.647 -5.746 -17.465 1.00 4.41 C ATOM 425 CZ3 TRP A 30 -20.702 -3.867 -15.961 1.00 4.49 C ATOM 426 CH2 TRP A 30 -20.283 -5.159 -16.287 1.00 4.40 C ATOM 0 H TRP A 30 -22.875 0.313 -17.888 1.00 4.95 H new ATOM 0 HA TRP A 30 -21.523 -1.172 -20.064 1.00 4.73 H new ATOM 0 HB2 TRP A 30 -23.907 -1.747 -18.346 1.00 4.74 H new ATOM 0 HB3 TRP A 30 -24.124 -2.048 -20.058 1.00 4.74 H new ATOM 0 HD1 TRP A 30 -23.195 -4.285 -20.980 1.00 4.66 H new ATOM 0 HE1 TRP A 30 -21.795 -6.237 -20.034 1.00 4.65 H new ATOM 0 HE3 TRP A 30 -21.816 -2.140 -16.561 1.00 4.46 H new ATOM 0 HZ2 TRP A 30 -20.324 -6.746 -17.714 1.00 4.41 H new ATOM 0 HZ3 TRP A 30 -20.398 -3.431 -15.021 1.00 4.49 H new ATOM 0 HH2 TRP A 30 -19.659 -5.704 -15.594 1.00 4.40 H new ATOM 437 N ARG A 31 -23.066 -0.175 -21.842 1.00 5.31 N ATOM 438 CA ARG A 31 -23.700 0.635 -22.871 1.00 5.89 C ATOM 439 C ARG A 31 -23.859 -0.173 -24.149 1.00 6.18 C ATOM 440 O ARG A 31 -23.099 -1.115 -24.393 1.00 6.15 O ATOM 441 CB ARG A 31 -22.852 1.874 -23.171 1.00 6.39 C ATOM 442 CG ARG A 31 -21.558 1.551 -23.903 1.00 6.58 C ATOM 443 CD ARG A 31 -20.761 2.802 -24.223 1.00 7.25 C ATOM 444 NE ARG A 31 -19.610 2.508 -25.073 1.00 7.68 N ATOM 445 CZ ARG A 31 -18.804 3.431 -25.591 1.00 8.49 C ATOM 446 NH1 ARG A 31 -19.013 4.717 -25.347 1.00 8.90 N1+ ATOM 447 NH2 ARG A 31 -17.780 3.063 -26.350 1.00 9.06 N ATOM 0 H ARG A 31 -22.562 -0.986 -22.200 1.00 5.31 H new ATOM 0 HA ARG A 31 -24.680 0.944 -22.506 1.00 5.89 H new ATOM 0 HB2 ARG A 31 -23.437 2.570 -23.771 1.00 6.39 H new ATOM 0 HB3 ARG A 31 -22.616 2.380 -22.235 1.00 6.39 H new ATOM 0 HG2 ARG A 31 -20.953 0.881 -23.292 1.00 6.58 H new ATOM 0 HG3 ARG A 31 -21.787 1.020 -24.827 1.00 6.58 H new ATOM 0 HD2 ARG A 31 -21.405 3.526 -24.721 1.00 7.25 H new ATOM 0 HD3 ARG A 31 -20.420 3.263 -23.296 1.00 7.25 H new ATOM 0 HE ARG A 31 -19.411 1.530 -25.283 1.00 7.68 H new ATOM 0 HH11 ARG A 31 -19.796 5.004 -24.759 1.00 8.90 H new ATOM 0 HH12 ARG A 31 -18.391 5.420 -25.747 1.00 8.90 H new ATOM 0 HH21 ARG A 31 -17.612 2.074 -26.535 1.00 9.06 H new ATOM 0 HH22 ARG A 31 -17.161 3.769 -26.748 1.00 9.06 H new ATOM 461 N ASP A 32 -24.846 0.183 -24.957 1.00 6.64 N ATOM 462 CA ASP A 32 -24.955 -0.381 -26.293 1.00 7.19 C ATOM 463 C ASP A 32 -23.976 0.333 -27.201 1.00 7.82 C ATOM 464 O ASP A 32 -23.843 1.554 -27.149 1.00 8.07 O ATOM 465 CB ASP A 32 -26.359 -0.221 -26.890 1.00 7.56 C ATOM 466 CG ASP A 32 -27.455 -0.723 -26.000 1.00 7.94 C ATOM 467 OD1 ASP A 32 -27.596 -1.949 -25.883 1.00 8.10 O ATOM 468 OD2 ASP A 32 -28.197 0.112 -25.440 1.00 8.31 O1- ATOM 0 H ASP A 32 -25.576 0.853 -24.714 1.00 6.64 H new ATOM 0 HA ASP A 32 -24.741 -1.447 -26.215 1.00 7.19 H new ATOM 0 HB2 ASP A 32 -26.534 0.833 -27.107 1.00 7.56 H new ATOM 0 HB3 ASP A 32 -26.403 -0.753 -27.840 1.00 7.56 H new ATOM 473 N PRO A 33 -23.275 -0.422 -28.047 1.00 8.28 N ATOM 474 CA PRO A 33 -22.407 0.145 -29.075 1.00 9.11 C ATOM 475 C PRO A 33 -23.195 1.011 -30.055 1.00 9.74 C ATOM 476 O PRO A 33 -22.619 1.740 -30.858 1.00 10.41 O ATOM 477 CB PRO A 33 -21.816 -1.070 -29.798 1.00 9.60 C ATOM 478 CG PRO A 33 -22.106 -2.250 -28.930 1.00 8.98 C ATOM 479 CD PRO A 33 -23.257 -1.886 -28.037 1.00 8.23 C ATOM 0 HA PRO A 33 -21.643 0.792 -28.643 1.00 9.11 H new ATOM 0 HB2 PRO A 33 -22.264 -1.192 -30.784 1.00 9.60 H new ATOM 0 HB3 PRO A 33 -20.743 -0.951 -29.948 1.00 9.60 H new ATOM 0 HG2 PRO A 33 -22.353 -3.120 -29.538 1.00 8.98 H new ATOM 0 HG3 PRO A 33 -21.230 -2.514 -28.337 1.00 8.98 H new ATOM 0 HD2 PRO A 33 -24.195 -2.298 -28.410 1.00 8.23 H new ATOM 0 HD3 PRO A 33 -23.116 -2.275 -27.029 1.00 8.23 H new ATOM 487 N MET A 34 -24.521 0.920 -29.982 1.00 9.60 N ATOM 488 CA MET A 34 -25.392 1.726 -30.823 1.00 10.19 C ATOM 489 C MET A 34 -25.971 2.906 -30.051 1.00 9.99 C ATOM 490 O MET A 34 -26.728 3.704 -30.603 1.00 10.53 O ATOM 491 CB MET A 34 -26.542 0.886 -31.395 1.00 10.40 C ATOM 492 CG MET A 34 -26.152 -0.013 -32.557 1.00 10.85 C ATOM 493 SD MET A 34 -26.328 -1.781 -32.210 1.00 10.55 S ATOM 494 CE MET A 34 -24.932 -2.065 -31.141 1.00 10.30 C ATOM 0 H MET A 34 -25.014 0.293 -29.346 1.00 9.60 H new ATOM 0 HA MET A 34 -24.781 2.103 -31.643 1.00 10.19 H new ATOM 0 HB2 MET A 34 -26.955 0.268 -30.597 1.00 10.40 H new ATOM 0 HB3 MET A 34 -27.336 1.557 -31.722 1.00 10.40 H new ATOM 0 HG2 MET A 34 -26.766 0.240 -33.421 1.00 10.85 H new ATOM 0 HG3 MET A 34 -25.117 0.192 -32.830 1.00 10.85 H new ATOM 0 HE1 MET A 34 -24.727 -3.134 -31.087 1.00 10.30 H new ATOM 0 HE2 MET A 34 -24.059 -1.547 -31.538 1.00 10.30 H new ATOM 0 HE3 MET A 34 -25.155 -1.687 -30.143 1.00 10.30 H new ATOM 504 N VAL A 35 -25.600 3.037 -28.786 1.00 9.32 N ATOM 505 CA VAL A 35 -26.048 4.174 -27.982 1.00 9.27 C ATOM 506 C VAL A 35 -24.858 4.895 -27.309 1.00 9.25 C ATOM 507 O VAL A 35 -24.936 5.315 -26.153 1.00 8.98 O ATOM 508 CB VAL A 35 -27.068 3.715 -26.915 1.00 8.70 C ATOM 509 CG1 VAL A 35 -28.170 2.883 -27.561 1.00 8.84 C ATOM 510 CG2 VAL A 35 -26.374 2.948 -25.802 1.00 7.95 C ATOM 0 H VAL A 35 -24.996 2.379 -28.294 1.00 9.32 H new ATOM 0 HA VAL A 35 -26.533 4.882 -28.653 1.00 9.27 H new ATOM 0 HB VAL A 35 -27.528 4.596 -26.469 1.00 8.70 H new ATOM 0 HG11 VAL A 35 -28.881 2.566 -26.798 1.00 8.84 H new ATOM 0 HG12 VAL A 35 -28.686 3.482 -28.312 1.00 8.84 H new ATOM 0 HG13 VAL A 35 -27.732 2.005 -28.036 1.00 8.84 H new ATOM 0 HG21 VAL A 35 -27.110 2.635 -25.062 1.00 7.95 H new ATOM 0 HG22 VAL A 35 -25.881 2.069 -26.218 1.00 7.95 H new ATOM 0 HG23 VAL A 35 -25.632 3.589 -25.326 1.00 7.95 H new ATOM 520 N PRO A 36 -23.756 5.120 -28.047 1.00 9.74 N ATOM 521 CA PRO A 36 -22.508 5.602 -27.474 1.00 9.85 C ATOM 522 C PRO A 36 -22.667 6.975 -26.832 1.00 10.22 C ATOM 523 O PRO A 36 -22.881 7.978 -27.518 1.00 10.95 O ATOM 524 CB PRO A 36 -21.539 5.654 -28.661 1.00 10.65 C ATOM 525 CG PRO A 36 -22.202 4.885 -29.742 1.00 11.10 C ATOM 526 CD PRO A 36 -23.664 5.031 -29.494 1.00 10.41 C ATOM 0 HA PRO A 36 -22.154 4.954 -26.672 1.00 9.85 H new ATOM 0 HB2 PRO A 36 -21.350 6.682 -28.969 1.00 10.65 H new ATOM 0 HB3 PRO A 36 -20.575 5.216 -28.401 1.00 10.65 H new ATOM 0 HG2 PRO A 36 -21.930 5.273 -30.724 1.00 11.10 H new ATOM 0 HG3 PRO A 36 -21.903 3.837 -29.719 1.00 11.10 H new ATOM 0 HD2 PRO A 36 -24.066 5.922 -29.977 1.00 10.41 H new ATOM 0 HD3 PRO A 36 -24.224 4.179 -29.880 1.00 10.41 H new ATOM 534 N GLY A 37 -22.561 7.002 -25.512 1.00 9.82 N ATOM 535 CA GLY A 37 -22.799 8.214 -24.761 1.00 10.31 C ATOM 536 C GLY A 37 -23.750 7.957 -23.615 1.00 9.86 C ATOM 537 O GLY A 37 -23.725 8.656 -22.600 1.00 10.21 O ATOM 0 H GLY A 37 -22.311 6.194 -24.942 1.00 9.82 H new ATOM 0 HA2 GLY A 37 -21.855 8.600 -24.377 1.00 10.31 H new ATOM 0 HA3 GLY A 37 -23.212 8.979 -25.418 1.00 10.31 H new ATOM 541 N GLN A 38 -24.584 6.941 -23.787 1.00 9.21 N ATOM 542 CA GLN A 38 -25.519 6.512 -22.761 1.00 8.88 C ATOM 543 C GLN A 38 -24.797 5.725 -21.676 1.00 8.38 C ATOM 544 O GLN A 38 -24.251 4.648 -21.923 1.00 8.00 O ATOM 545 CB GLN A 38 -26.628 5.668 -23.388 1.00 8.51 C ATOM 546 CG GLN A 38 -27.442 4.886 -22.383 1.00 8.11 C ATOM 547 CD GLN A 38 -28.065 5.756 -21.315 1.00 8.18 C ATOM 548 OE1 GLN A 38 -28.397 6.919 -21.548 1.00 8.47 O ATOM 549 NE2 GLN A 38 -28.213 5.195 -20.135 1.00 8.21 N ATOM 0 H GLN A 38 -24.630 6.391 -24.645 1.00 9.21 H new ATOM 0 HA GLN A 38 -25.966 7.394 -22.301 1.00 8.88 H new ATOM 0 HB2 GLN A 38 -27.294 6.321 -23.952 1.00 8.51 H new ATOM 0 HB3 GLN A 38 -26.184 4.973 -24.101 1.00 8.51 H new ATOM 0 HG2 GLN A 38 -28.230 4.344 -22.906 1.00 8.11 H new ATOM 0 HG3 GLN A 38 -26.803 4.141 -21.909 1.00 8.11 H new ATOM 0 HE21 GLN A 38 -27.923 4.228 -19.990 1.00 8.21 H new ATOM 0 HE22 GLN A 38 -28.618 5.727 -19.365 1.00 8.21 H new ATOM 558 N ARG A 39 -24.793 6.277 -20.475 1.00 8.53 N ATOM 559 CA ARG A 39 -24.134 5.660 -19.350 1.00 8.21 C ATOM 560 C ARG A 39 -25.130 4.902 -18.485 1.00 8.04 C ATOM 561 O ARG A 39 -25.846 5.492 -17.676 1.00 8.70 O ATOM 562 CB ARG A 39 -23.432 6.738 -18.537 1.00 8.96 C ATOM 563 CG ARG A 39 -22.578 6.189 -17.418 1.00 8.86 C ATOM 564 CD ARG A 39 -21.481 7.159 -17.044 1.00 9.10 C ATOM 565 NE ARG A 39 -21.992 8.379 -16.421 1.00 10.02 N ATOM 566 CZ ARG A 39 -21.215 9.370 -15.989 1.00 10.60 C ATOM 567 NH1 ARG A 39 -19.898 9.303 -16.148 1.00 10.42 N1+ ATOM 568 NH2 ARG A 39 -21.753 10.429 -15.403 1.00 11.51 N ATOM 0 H ARG A 39 -25.247 7.164 -20.258 1.00 8.53 H new ATOM 0 HA ARG A 39 -23.401 4.940 -19.714 1.00 8.21 H new ATOM 0 HB2 ARG A 39 -22.807 7.334 -19.202 1.00 8.96 H new ATOM 0 HB3 ARG A 39 -24.180 7.410 -18.116 1.00 8.96 H new ATOM 0 HG2 ARG A 39 -23.201 5.986 -16.547 1.00 8.86 H new ATOM 0 HG3 ARG A 39 -22.139 5.239 -17.724 1.00 8.86 H new ATOM 0 HD2 ARG A 39 -20.788 6.670 -16.360 1.00 9.10 H new ATOM 0 HD3 ARG A 39 -20.915 7.422 -17.937 1.00 9.10 H new ATOM 0 HE ARG A 39 -23.001 8.476 -16.311 1.00 10.02 H new ATOM 0 HH11 ARG A 39 -19.480 8.491 -16.602 1.00 10.42 H new ATOM 0 HH12 ARG A 39 -19.305 10.064 -15.816 1.00 10.42 H new ATOM 0 HH21 ARG A 39 -22.764 10.486 -15.282 1.00 11.51 H new ATOM 0 HH22 ARG A 39 -21.156 11.187 -15.073 1.00 11.51 H new ATOM 582 N PHE A 40 -25.183 3.589 -18.673 1.00 7.31 N ATOM 583 CA PHE A 40 -26.045 2.742 -17.867 1.00 7.34 C ATOM 584 C PHE A 40 -25.384 2.479 -16.535 1.00 7.47 C ATOM 585 O PHE A 40 -24.214 2.125 -16.484 1.00 7.06 O ATOM 586 CB PHE A 40 -26.328 1.407 -18.557 1.00 6.76 C ATOM 587 CG PHE A 40 -27.232 1.506 -19.747 1.00 6.92 C ATOM 588 CD1 PHE A 40 -26.715 1.736 -21.010 1.00 6.93 C ATOM 589 CD2 PHE A 40 -28.599 1.353 -19.603 1.00 7.27 C ATOM 590 CE1 PHE A 40 -27.548 1.814 -22.109 1.00 7.26 C ATOM 591 CE2 PHE A 40 -29.436 1.428 -20.697 1.00 7.50 C ATOM 592 CZ PHE A 40 -28.909 1.660 -21.951 1.00 7.49 C ATOM 0 H PHE A 40 -24.638 3.090 -19.377 1.00 7.31 H new ATOM 0 HA PHE A 40 -26.993 3.262 -17.728 1.00 7.34 H new ATOM 0 HB2 PHE A 40 -25.382 0.966 -18.870 1.00 6.76 H new ATOM 0 HB3 PHE A 40 -26.774 0.725 -17.833 1.00 6.76 H new ATOM 0 HD1 PHE A 40 -25.649 1.856 -21.138 1.00 6.93 H new ATOM 0 HD2 PHE A 40 -29.016 1.173 -18.623 1.00 7.27 H new ATOM 0 HE1 PHE A 40 -27.134 1.995 -23.090 1.00 7.26 H new ATOM 0 HE2 PHE A 40 -30.502 1.305 -20.572 1.00 7.50 H new ATOM 0 HZ PHE A 40 -29.563 1.721 -22.809 1.00 7.49 H new ATOM 602 N ASP A 41 -26.148 2.632 -15.471 1.00 8.18 N ATOM 603 CA ASP A 41 -25.634 2.473 -14.120 1.00 8.62 C ATOM 604 C ASP A 41 -25.172 1.045 -13.884 1.00 8.07 C ATOM 605 O ASP A 41 -24.294 0.800 -13.055 1.00 8.18 O ATOM 606 CB ASP A 41 -26.727 2.830 -13.111 1.00 9.62 C ATOM 607 CG ASP A 41 -27.131 4.288 -13.178 1.00 10.23 C ATOM 608 OD1 ASP A 41 -27.957 4.640 -14.047 1.00 10.61 O ATOM 609 OD2 ASP A 41 -26.633 5.090 -12.358 1.00 10.48 O1- ATOM 0 H ASP A 41 -27.139 2.869 -15.516 1.00 8.18 H new ATOM 0 HA ASP A 41 -24.781 3.140 -13.993 1.00 8.62 H new ATOM 0 HB2 ASP A 41 -27.602 2.206 -13.293 1.00 9.62 H new ATOM 0 HB3 ASP A 41 -26.376 2.600 -12.105 1.00 9.62 H new ATOM 614 N LYS A 42 -25.762 0.104 -14.611 1.00 7.60 N ATOM 615 CA LYS A 42 -25.518 -1.304 -14.350 1.00 7.23 C ATOM 616 C LYS A 42 -25.876 -2.180 -15.553 1.00 6.69 C ATOM 617 O LYS A 42 -26.796 -1.880 -16.315 1.00 6.78 O ATOM 618 CB LYS A 42 -26.350 -1.723 -13.133 1.00 8.14 C ATOM 619 CG LYS A 42 -27.813 -1.324 -13.239 1.00 8.90 C ATOM 620 CD LYS A 42 -28.608 -1.759 -12.020 1.00 9.77 C ATOM 621 CE LYS A 42 -30.078 -1.396 -12.157 1.00 10.52 C ATOM 622 NZ LYS A 42 -30.721 -2.090 -13.306 1.00 10.91 N1+ ATOM 0 H LYS A 42 -26.407 0.290 -15.379 1.00 7.60 H new ATOM 0 HA LYS A 42 -24.454 -1.443 -14.157 1.00 7.23 H new ATOM 0 HB2 LYS A 42 -26.283 -2.804 -13.011 1.00 8.14 H new ATOM 0 HB3 LYS A 42 -25.922 -1.274 -12.237 1.00 8.14 H new ATOM 0 HG2 LYS A 42 -27.887 -0.243 -13.354 1.00 8.90 H new ATOM 0 HG3 LYS A 42 -28.247 -1.770 -14.134 1.00 8.90 H new ATOM 0 HD2 LYS A 42 -28.509 -2.836 -11.885 1.00 9.77 H new ATOM 0 HD3 LYS A 42 -28.197 -1.286 -11.128 1.00 9.77 H new ATOM 0 HE2 LYS A 42 -30.602 -1.656 -11.237 1.00 10.52 H new ATOM 0 HE3 LYS A 42 -30.174 -0.318 -12.285 1.00 10.52 H new ATOM 0 HZ1 LYS A 42 -31.755 -2.022 -13.218 1.00 10.91 H new ATOM 0 HZ2 LYS A 42 -30.419 -1.642 -14.195 1.00 10.91 H new ATOM 0 HZ3 LYS A 42 -30.439 -3.091 -13.309 1.00 10.91 H new ATOM 636 N PRO A 43 -25.117 -3.288 -15.707 1.00 6.27 N ATOM 637 CA PRO A 43 -25.269 -4.272 -16.796 1.00 6.04 C ATOM 638 C PRO A 43 -26.670 -4.870 -16.887 1.00 6.80 C ATOM 639 O PRO A 43 -27.248 -5.268 -15.875 1.00 7.51 O ATOM 640 CB PRO A 43 -24.267 -5.379 -16.432 1.00 6.00 C ATOM 641 CG PRO A 43 -23.961 -5.155 -14.991 1.00 6.35 C ATOM 642 CD PRO A 43 -24.023 -3.668 -14.809 1.00 6.19 C ATOM 0 HA PRO A 43 -25.097 -3.801 -17.764 1.00 6.04 H new ATOM 0 HB2 PRO A 43 -24.693 -6.369 -16.597 1.00 6.00 H new ATOM 0 HB3 PRO A 43 -23.366 -5.314 -17.043 1.00 6.00 H new ATOM 0 HG2 PRO A 43 -24.683 -5.662 -14.351 1.00 6.35 H new ATOM 0 HG3 PRO A 43 -22.976 -5.544 -14.731 1.00 6.35 H new ATOM 0 HD2 PRO A 43 -24.232 -3.393 -13.775 1.00 6.19 H new ATOM 0 HD3 PRO A 43 -23.085 -3.185 -15.084 1.00 6.19 H new ATOM 650 N GLY A 44 -27.194 -4.967 -18.102 1.00 6.81 N ATOM 651 CA GLY A 44 -28.496 -5.573 -18.310 1.00 7.59 C ATOM 652 C GLY A 44 -28.846 -5.670 -19.780 1.00 7.56 C ATOM 653 O GLY A 44 -27.966 -5.876 -20.615 1.00 7.08 O ATOM 0 H GLY A 44 -26.738 -4.635 -18.952 1.00 6.81 H new ATOM 0 HA2 GLY A 44 -28.507 -6.569 -17.868 1.00 7.59 H new ATOM 0 HA3 GLY A 44 -29.256 -4.986 -17.794 1.00 7.59 H new ATOM 657 N LYS A 45 -30.127 -5.524 -20.089 1.00 8.20 N ATOM 658 CA LYS A 45 -30.596 -5.488 -21.465 1.00 8.37 C ATOM 659 C LYS A 45 -30.960 -4.057 -21.817 1.00 8.15 C ATOM 660 O LYS A 45 -31.485 -3.316 -20.983 1.00 8.27 O ATOM 661 CB LYS A 45 -31.822 -6.388 -21.642 1.00 9.30 C ATOM 662 CG LYS A 45 -32.257 -6.571 -23.097 1.00 9.65 C ATOM 663 CD LYS A 45 -33.712 -6.213 -23.307 1.00 10.42 C ATOM 664 CE LYS A 45 -34.641 -6.974 -22.369 1.00 11.07 C ATOM 665 NZ LYS A 45 -34.586 -8.446 -22.595 1.00 11.68 N1+ ATOM 0 H LYS A 45 -30.868 -5.428 -19.394 1.00 8.20 H new ATOM 0 HA LYS A 45 -29.807 -5.851 -22.123 1.00 8.37 H new ATOM 0 HB2 LYS A 45 -31.606 -7.366 -21.213 1.00 9.30 H new ATOM 0 HB3 LYS A 45 -32.653 -5.968 -21.076 1.00 9.30 H new ATOM 0 HG2 LYS A 45 -31.635 -5.950 -23.741 1.00 9.65 H new ATOM 0 HG3 LYS A 45 -32.092 -7.606 -23.396 1.00 9.65 H new ATOM 0 HD2 LYS A 45 -33.845 -5.142 -23.155 1.00 10.42 H new ATOM 0 HD3 LYS A 45 -33.990 -6.425 -24.339 1.00 10.42 H new ATOM 0 HE2 LYS A 45 -34.370 -6.756 -21.336 1.00 11.07 H new ATOM 0 HE3 LYS A 45 -35.664 -6.624 -22.510 1.00 11.07 H new ATOM 0 HZ1 LYS A 45 -35.258 -8.920 -21.959 1.00 11.68 H new ATOM 0 HZ2 LYS A 45 -34.837 -8.655 -23.582 1.00 11.68 H new ATOM 0 HZ3 LYS A 45 -33.624 -8.791 -22.402 1.00 11.68 H new ATOM 679 N SER A 46 -30.656 -3.671 -23.039 1.00 8.03 N ATOM 680 CA SER A 46 -30.943 -2.334 -23.518 1.00 7.98 C ATOM 681 C SER A 46 -32.447 -2.067 -23.559 1.00 8.64 C ATOM 682 O SER A 46 -33.242 -2.952 -23.880 1.00 9.20 O ATOM 683 CB SER A 46 -30.344 -2.156 -24.910 1.00 8.03 C ATOM 684 OG SER A 46 -30.616 -0.865 -25.433 1.00 8.36 O ATOM 0 H SER A 46 -30.204 -4.273 -23.727 1.00 8.03 H new ATOM 0 HA SER A 46 -30.497 -1.618 -22.828 1.00 7.98 H new ATOM 0 HB2 SER A 46 -29.266 -2.312 -24.866 1.00 8.03 H new ATOM 0 HB3 SER A 46 -30.749 -2.914 -25.581 1.00 8.03 H new ATOM 0 HG SER A 46 -29.879 -0.259 -25.208 1.00 8.36 H new ATOM 690 N PRO A 47 -32.858 -0.846 -23.203 1.00 8.70 N ATOM 691 CA PRO A 47 -34.240 -0.403 -23.360 1.00 9.38 C ATOM 692 C PRO A 47 -34.533 -0.031 -24.807 1.00 9.63 C ATOM 693 O PRO A 47 -35.678 -0.014 -25.255 1.00 10.25 O ATOM 694 CB PRO A 47 -34.313 0.829 -22.465 1.00 9.45 C ATOM 695 CG PRO A 47 -32.929 1.375 -22.455 1.00 8.81 C ATOM 696 CD PRO A 47 -32.005 0.195 -22.598 1.00 8.26 C ATOM 0 HA PRO A 47 -34.966 -1.173 -23.097 1.00 9.38 H new ATOM 0 HB2 PRO A 47 -35.023 1.559 -22.854 1.00 9.45 H new ATOM 0 HB3 PRO A 47 -34.642 0.568 -21.459 1.00 9.45 H new ATOM 0 HG2 PRO A 47 -32.785 2.082 -23.272 1.00 8.81 H new ATOM 0 HG3 PRO A 47 -32.731 1.913 -21.528 1.00 8.81 H new ATOM 0 HD2 PRO A 47 -31.150 0.430 -23.232 1.00 8.26 H new ATOM 0 HD3 PRO A 47 -31.609 -0.123 -21.633 1.00 8.26 H new ATOM 704 N TYR A 48 -33.454 0.259 -25.523 1.00 9.26 N ATOM 705 CA TYR A 48 -33.512 0.730 -26.892 1.00 9.61 C ATOM 706 C TYR A 48 -33.613 -0.465 -27.830 1.00 9.96 C ATOM 707 O TYR A 48 -34.362 -0.449 -28.804 1.00 10.49 O ATOM 708 CB TYR A 48 -32.240 1.532 -27.184 1.00 9.34 C ATOM 709 CG TYR A 48 -31.924 2.587 -26.150 1.00 9.17 C ATOM 710 CD1 TYR A 48 -32.781 3.656 -25.925 1.00 9.63 C ATOM 711 CD2 TYR A 48 -30.762 2.506 -25.395 1.00 8.69 C ATOM 712 CE1 TYR A 48 -32.484 4.618 -24.977 1.00 9.70 C ATOM 713 CE2 TYR A 48 -30.462 3.462 -24.447 1.00 8.75 C ATOM 714 CZ TYR A 48 -31.323 4.515 -24.242 1.00 9.30 C ATOM 715 OH TYR A 48 -31.022 5.468 -23.296 1.00 9.57 O ATOM 0 H TYR A 48 -32.505 0.171 -25.161 1.00 9.26 H new ATOM 0 HA TYR A 48 -34.384 1.366 -27.042 1.00 9.61 H new ATOM 0 HB2 TYR A 48 -31.398 0.844 -27.254 1.00 9.34 H new ATOM 0 HB3 TYR A 48 -32.341 2.012 -28.157 1.00 9.34 H new ATOM 0 HD1 TYR A 48 -33.693 3.737 -26.499 1.00 9.63 H new ATOM 0 HD2 TYR A 48 -30.082 1.682 -25.552 1.00 8.69 H new ATOM 0 HE1 TYR A 48 -33.158 5.446 -24.814 1.00 9.70 H new ATOM 0 HE2 TYR A 48 -29.554 3.384 -23.868 1.00 8.75 H new ATOM 0 HH TYR A 48 -30.312 5.133 -22.709 1.00 9.57 H new ATOM 725 N MET A 49 -32.833 -1.495 -27.525 1.00 9.74 N ATOM 726 CA MET A 49 -32.814 -2.716 -28.308 1.00 10.23 C ATOM 727 C MET A 49 -32.794 -3.938 -27.405 1.00 10.20 C ATOM 728 O MET A 49 -32.354 -3.849 -26.269 1.00 9.87 O ATOM 729 CB MET A 49 -31.607 -2.736 -29.226 1.00 10.28 C ATOM 730 CG MET A 49 -31.782 -1.857 -30.436 1.00 10.38 C ATOM 731 SD MET A 49 -30.342 -0.841 -30.798 1.00 10.09 S ATOM 732 CE MET A 49 -30.251 0.077 -29.272 1.00 9.55 C ATOM 0 H MET A 49 -32.197 -1.503 -26.727 1.00 9.74 H new ATOM 0 HA MET A 49 -33.722 -2.744 -28.911 1.00 10.23 H new ATOM 0 HB2 MET A 49 -30.728 -2.411 -28.670 1.00 10.28 H new ATOM 0 HB3 MET A 49 -31.419 -3.760 -29.550 1.00 10.28 H new ATOM 0 HG2 MET A 49 -32.002 -2.483 -31.301 1.00 10.38 H new ATOM 0 HG3 MET A 49 -32.645 -1.209 -30.283 1.00 10.38 H new ATOM 0 HE1 MET A 49 -30.349 1.142 -29.482 1.00 9.55 H new ATOM 0 HE2 MET A 49 -31.057 -0.238 -28.609 1.00 9.55 H new ATOM 0 HE3 MET A 49 -29.291 -0.111 -28.791 1.00 9.55 H new ATOM 742 N ASP A 50 -33.225 -5.085 -27.904 1.00 10.69 N ATOM 743 CA ASP A 50 -33.224 -6.299 -27.091 1.00 10.83 C ATOM 744 C ASP A 50 -31.864 -6.976 -27.119 1.00 10.64 C ATOM 745 O ASP A 50 -31.732 -8.168 -27.404 1.00 11.23 O ATOM 746 CB ASP A 50 -34.322 -7.268 -27.530 1.00 11.76 C ATOM 747 CG ASP A 50 -34.224 -7.671 -28.991 1.00 12.21 C ATOM 748 OD1 ASP A 50 -34.403 -6.797 -29.865 1.00 12.33 O1- ATOM 749 OD2 ASP A 50 -33.957 -8.858 -29.273 1.00 12.54 O ATOM 0 H ASP A 50 -33.576 -5.205 -28.854 1.00 10.69 H new ATOM 0 HA ASP A 50 -33.434 -6.003 -26.063 1.00 10.83 H new ATOM 0 HB2 ASP A 50 -34.275 -8.163 -26.910 1.00 11.76 H new ATOM 0 HB3 ASP A 50 -35.294 -6.808 -27.352 1.00 11.76 H new ATOM 754 N MET A 51 -30.855 -6.204 -26.797 1.00 9.87 N ATOM 755 CA MET A 51 -29.507 -6.728 -26.663 1.00 9.64 C ATOM 756 C MET A 51 -29.051 -6.574 -25.234 1.00 8.84 C ATOM 757 O MET A 51 -29.415 -5.603 -24.570 1.00 8.36 O ATOM 758 CB MET A 51 -28.503 -6.008 -27.574 1.00 9.70 C ATOM 759 CG MET A 51 -29.037 -4.753 -28.241 1.00 9.43 C ATOM 760 SD MET A 51 -27.807 -3.445 -28.418 1.00 9.38 S ATOM 761 CE MET A 51 -26.345 -4.379 -28.840 1.00 9.04 C ATOM 0 H MET A 51 -30.937 -5.203 -26.621 1.00 9.87 H new ATOM 0 HA MET A 51 -29.539 -7.777 -26.958 1.00 9.64 H new ATOM 0 HB2 MET A 51 -27.624 -5.744 -26.986 1.00 9.70 H new ATOM 0 HB3 MET A 51 -28.173 -6.702 -28.347 1.00 9.70 H new ATOM 0 HG2 MET A 51 -29.423 -5.012 -29.227 1.00 9.43 H new ATOM 0 HG3 MET A 51 -29.877 -4.373 -27.660 1.00 9.43 H new ATOM 0 HE1 MET A 51 -25.518 -3.695 -29.031 1.00 9.04 H new ATOM 0 HE2 MET A 51 -26.085 -5.041 -28.014 1.00 9.04 H new ATOM 0 HE3 MET A 51 -26.538 -4.973 -29.733 1.00 9.04 H new ATOM 771 N PRO A 52 -28.277 -7.530 -24.724 1.00 8.77 N ATOM 772 CA PRO A 52 -27.580 -7.334 -23.475 1.00 8.04 C ATOM 773 C PRO A 52 -26.469 -6.325 -23.687 1.00 7.35 C ATOM 774 O PRO A 52 -25.732 -6.406 -24.673 1.00 7.56 O ATOM 775 CB PRO A 52 -27.029 -8.715 -23.129 1.00 8.35 C ATOM 776 CG PRO A 52 -26.945 -9.435 -24.433 1.00 9.16 C ATOM 777 CD PRO A 52 -28.020 -8.854 -25.315 1.00 9.51 C ATOM 0 HA PRO A 52 -28.210 -6.948 -22.673 1.00 8.04 H new ATOM 0 HB2 PRO A 52 -26.050 -8.642 -22.655 1.00 8.35 H new ATOM 0 HB3 PRO A 52 -27.683 -9.237 -22.431 1.00 8.35 H new ATOM 0 HG2 PRO A 52 -25.961 -9.306 -24.884 1.00 9.16 H new ATOM 0 HG3 PRO A 52 -27.094 -10.506 -24.295 1.00 9.16 H new ATOM 0 HD2 PRO A 52 -27.689 -8.773 -26.350 1.00 9.51 H new ATOM 0 HD3 PRO A 52 -28.917 -9.474 -25.315 1.00 9.51 H new ATOM 785 N LEU A 53 -26.370 -5.364 -22.792 1.00 6.71 N ATOM 786 CA LEU A 53 -25.454 -4.252 -22.982 1.00 6.20 C ATOM 787 C LEU A 53 -24.011 -4.730 -23.057 1.00 5.97 C ATOM 788 O LEU A 53 -23.670 -5.809 -22.561 1.00 6.05 O ATOM 789 CB LEU A 53 -25.647 -3.208 -21.881 1.00 5.79 C ATOM 790 CG LEU A 53 -27.076 -2.687 -21.777 1.00 6.23 C ATOM 791 CD1 LEU A 53 -27.292 -1.937 -20.476 1.00 6.10 C ATOM 792 CD2 LEU A 53 -27.379 -1.792 -22.960 1.00 6.57 C ATOM 0 H LEU A 53 -26.910 -5.328 -21.927 1.00 6.71 H new ATOM 0 HA LEU A 53 -25.682 -3.779 -23.937 1.00 6.20 H new ATOM 0 HB2 LEU A 53 -25.357 -3.643 -20.925 1.00 5.79 H new ATOM 0 HB3 LEU A 53 -24.976 -2.369 -22.066 1.00 5.79 H new ATOM 0 HG LEU A 53 -27.757 -3.538 -21.786 1.00 6.23 H new ATOM 0 HD11 LEU A 53 -28.320 -1.577 -20.430 1.00 6.10 H new ATOM 0 HD12 LEU A 53 -27.103 -2.605 -19.635 1.00 6.10 H new ATOM 0 HD13 LEU A 53 -26.608 -1.089 -20.427 1.00 6.10 H new ATOM 0 HD21 LEU A 53 -28.401 -1.421 -22.883 1.00 6.57 H new ATOM 0 HD22 LEU A 53 -26.687 -0.950 -22.966 1.00 6.57 H new ATOM 0 HD23 LEU A 53 -27.268 -2.360 -23.884 1.00 6.57 H new ATOM 804 N ILE A 54 -23.168 -3.929 -23.672 1.00 5.92 N ATOM 805 CA ILE A 54 -21.788 -4.303 -23.883 1.00 5.98 C ATOM 806 C ILE A 54 -20.917 -3.655 -22.829 1.00 5.33 C ATOM 807 O ILE A 54 -21.074 -2.471 -22.517 1.00 5.16 O ATOM 808 CB ILE A 54 -21.308 -3.889 -25.289 1.00 6.77 C ATOM 809 CG1 ILE A 54 -22.182 -4.552 -26.358 1.00 7.56 C ATOM 810 CG2 ILE A 54 -19.842 -4.248 -25.502 1.00 7.04 C ATOM 811 CD1 ILE A 54 -22.164 -6.064 -26.315 1.00 7.89 C ATOM 0 H ILE A 54 -23.417 -3.009 -24.036 1.00 5.92 H new ATOM 0 HA ILE A 54 -21.711 -5.387 -23.805 1.00 5.98 H new ATOM 0 HB ILE A 54 -21.400 -2.806 -25.375 1.00 6.77 H new ATOM 0 HG12 ILE A 54 -23.209 -4.207 -26.238 1.00 7.56 H new ATOM 0 HG13 ILE A 54 -21.848 -4.223 -27.342 1.00 7.56 H new ATOM 0 HG21 ILE A 54 -19.534 -3.943 -26.502 1.00 7.04 H new ATOM 0 HG22 ILE A 54 -19.230 -3.733 -24.761 1.00 7.04 H new ATOM 0 HG23 ILE A 54 -19.712 -5.325 -25.395 1.00 7.04 H new ATOM 0 HD11 ILE A 54 -22.807 -6.458 -27.102 1.00 7.89 H new ATOM 0 HD12 ILE A 54 -21.145 -6.420 -26.466 1.00 7.89 H new ATOM 0 HD13 ILE A 54 -22.527 -6.405 -25.346 1.00 7.89 H new ATOM 823 N PRO A 55 -20.022 -4.430 -22.226 1.00 5.13 N ATOM 824 CA PRO A 55 -19.124 -3.917 -21.215 1.00 4.65 C ATOM 825 C PRO A 55 -17.948 -3.150 -21.810 1.00 5.10 C ATOM 826 O PRO A 55 -17.361 -3.542 -22.822 1.00 5.77 O ATOM 827 CB PRO A 55 -18.671 -5.178 -20.496 1.00 4.51 C ATOM 828 CG PRO A 55 -18.672 -6.215 -21.560 1.00 5.22 C ATOM 829 CD PRO A 55 -19.831 -5.874 -22.455 1.00 5.58 C ATOM 0 HA PRO A 55 -19.602 -3.191 -20.558 1.00 4.65 H new ATOM 0 HB2 PRO A 55 -17.680 -5.055 -20.059 1.00 4.51 H new ATOM 0 HB3 PRO A 55 -19.348 -5.439 -19.683 1.00 4.51 H new ATOM 0 HG2 PRO A 55 -17.734 -6.209 -22.114 1.00 5.22 H new ATOM 0 HG3 PRO A 55 -18.785 -7.212 -21.135 1.00 5.22 H new ATOM 0 HD2 PRO A 55 -19.609 -6.090 -23.500 1.00 5.58 H new ATOM 0 HD3 PRO A 55 -20.722 -6.444 -22.194 1.00 5.58 H new ATOM 837 N VAL A 56 -17.641 -2.045 -21.166 1.00 5.00 N ATOM 838 CA VAL A 56 -16.561 -1.149 -21.554 1.00 5.69 C ATOM 839 C VAL A 56 -15.185 -1.826 -21.524 1.00 5.96 C ATOM 840 O VAL A 56 -14.990 -2.840 -20.856 1.00 5.52 O ATOM 841 CB VAL A 56 -16.540 0.057 -20.613 1.00 5.77 C ATOM 842 CG1 VAL A 56 -17.841 0.843 -20.694 1.00 5.82 C ATOM 843 CG2 VAL A 56 -16.282 -0.442 -19.215 1.00 5.28 C ATOM 0 H VAL A 56 -18.145 -1.732 -20.336 1.00 5.00 H new ATOM 0 HA VAL A 56 -16.754 -0.843 -22.582 1.00 5.69 H new ATOM 0 HB VAL A 56 -15.747 0.743 -20.908 1.00 5.77 H new ATOM 0 HG11 VAL A 56 -17.795 1.694 -20.014 1.00 5.82 H new ATOM 0 HG12 VAL A 56 -17.987 1.201 -21.713 1.00 5.82 H new ATOM 0 HG13 VAL A 56 -18.674 0.198 -20.413 1.00 5.82 H new ATOM 0 HG21 VAL A 56 -16.263 0.402 -18.525 1.00 5.28 H new ATOM 0 HG22 VAL A 56 -17.074 -1.131 -18.923 1.00 5.28 H new ATOM 0 HG23 VAL A 56 -15.322 -0.958 -19.184 1.00 5.28 H new ATOM 853 N TYR A 57 -14.268 -1.201 -22.259 1.00 6.83 N ATOM 854 CA TYR A 57 -12.850 -1.597 -22.425 1.00 7.44 C ATOM 855 C TYR A 57 -12.518 -3.024 -21.982 1.00 7.10 C ATOM 856 O TYR A 57 -12.526 -3.961 -22.781 1.00 7.48 O ATOM 857 CB TYR A 57 -11.938 -0.589 -21.703 1.00 7.84 C ATOM 858 CG TYR A 57 -12.662 0.289 -20.705 1.00 7.40 C ATOM 859 CD1 TYR A 57 -13.271 1.476 -21.099 1.00 7.77 C ATOM 860 CD2 TYR A 57 -12.740 -0.068 -19.371 1.00 6.79 C ATOM 861 CE1 TYR A 57 -13.930 2.277 -20.187 1.00 7.62 C ATOM 862 CE2 TYR A 57 -13.392 0.721 -18.458 1.00 6.66 C ATOM 863 CZ TYR A 57 -13.984 1.896 -18.864 1.00 7.11 C ATOM 864 OH TYR A 57 -14.639 2.683 -17.946 1.00 7.23 O ATOM 0 H TYR A 57 -14.495 -0.359 -22.788 1.00 6.83 H new ATOM 0 HA TYR A 57 -12.668 -1.584 -23.500 1.00 7.44 H new ATOM 0 HB2 TYR A 57 -11.148 -1.134 -21.186 1.00 7.84 H new ATOM 0 HB3 TYR A 57 -11.454 0.045 -22.446 1.00 7.84 H new ATOM 0 HD1 TYR A 57 -13.228 1.776 -22.136 1.00 7.77 H new ATOM 0 HD2 TYR A 57 -12.278 -0.987 -19.042 1.00 6.79 H new ATOM 0 HE1 TYR A 57 -14.399 3.195 -20.508 1.00 7.62 H new ATOM 0 HE2 TYR A 57 -13.441 0.421 -17.422 1.00 6.66 H new ATOM 0 HH TYR A 57 -14.583 2.268 -17.060 1.00 7.23 H new ATOM 874 N GLU A 58 -12.207 -3.138 -20.690 1.00 6.59 N ATOM 875 CA GLU A 58 -11.666 -4.345 -20.067 1.00 6.41 C ATOM 876 C GLU A 58 -12.530 -5.552 -20.346 1.00 6.15 C ATOM 877 O GLU A 58 -12.019 -6.662 -20.479 1.00 6.62 O ATOM 878 CB GLU A 58 -11.585 -4.105 -18.566 1.00 5.89 C ATOM 879 CG GLU A 58 -12.715 -4.701 -17.758 1.00 5.18 C ATOM 880 CD GLU A 58 -12.461 -4.656 -16.263 1.00 5.25 C ATOM 881 OE1 GLU A 58 -11.432 -4.101 -15.842 1.00 5.25 O ATOM 882 OE2 GLU A 58 -13.291 -5.201 -15.504 1.00 5.61 O1- ATOM 0 H GLU A 58 -12.328 -2.370 -20.030 1.00 6.59 H new ATOM 0 HA GLU A 58 -10.680 -4.549 -20.483 1.00 6.41 H new ATOM 0 HB2 GLU A 58 -10.643 -4.512 -18.199 1.00 5.89 H new ATOM 0 HB3 GLU A 58 -11.559 -3.030 -18.387 1.00 5.89 H new ATOM 0 HG2 GLU A 58 -13.637 -4.164 -17.981 1.00 5.18 H new ATOM 0 HG3 GLU A 58 -12.867 -5.736 -18.064 1.00 5.18 H new ATOM 889 N GLU A 59 -13.826 -5.314 -20.415 1.00 5.59 N ATOM 890 CA GLU A 59 -14.803 -6.360 -20.682 1.00 5.52 C ATOM 891 C GLU A 59 -14.647 -7.497 -19.665 1.00 5.43 C ATOM 892 O GLU A 59 -14.111 -8.570 -19.968 1.00 6.06 O ATOM 893 CB GLU A 59 -14.664 -6.867 -22.130 1.00 6.40 C ATOM 894 CG GLU A 59 -15.668 -7.941 -22.523 1.00 6.94 C ATOM 895 CD GLU A 59 -15.641 -8.249 -24.006 1.00 7.89 C ATOM 896 OE1 GLU A 59 -16.064 -7.390 -24.806 1.00 8.12 O ATOM 897 OE2 GLU A 59 -15.193 -9.353 -24.387 1.00 8.58 O1- ATOM 0 H GLU A 59 -14.235 -4.388 -20.288 1.00 5.59 H new ATOM 0 HA GLU A 59 -15.807 -5.950 -20.573 1.00 5.52 H new ATOM 0 HB2 GLU A 59 -14.771 -6.021 -22.809 1.00 6.40 H new ATOM 0 HB3 GLU A 59 -13.657 -7.261 -22.268 1.00 6.40 H new ATOM 0 HG2 GLU A 59 -15.458 -8.852 -21.963 1.00 6.94 H new ATOM 0 HG3 GLU A 59 -16.670 -7.617 -22.241 1.00 6.94 H new ATOM 904 N GLU A 60 -15.106 -7.213 -18.453 1.00 4.88 N ATOM 905 CA GLU A 60 -15.005 -8.117 -17.309 1.00 5.05 C ATOM 906 C GLU A 60 -13.572 -8.578 -17.045 1.00 5.18 C ATOM 907 O GLU A 60 -13.138 -9.637 -17.505 1.00 5.82 O ATOM 908 CB GLU A 60 -15.950 -9.316 -17.430 1.00 5.91 C ATOM 909 CG GLU A 60 -15.959 -10.194 -16.188 1.00 6.37 C ATOM 910 CD GLU A 60 -17.130 -11.150 -16.146 1.00 7.13 C ATOM 911 OE1 GLU A 60 -18.246 -10.724 -15.793 1.00 7.64 O ATOM 912 OE2 GLU A 60 -16.939 -12.335 -16.486 1.00 7.41 O1- ATOM 0 H GLU A 60 -15.568 -6.331 -18.231 1.00 4.88 H new ATOM 0 HA GLU A 60 -15.320 -7.532 -16.445 1.00 5.05 H new ATOM 0 HB2 GLU A 60 -16.961 -8.957 -17.621 1.00 5.91 H new ATOM 0 HB3 GLU A 60 -15.657 -9.917 -18.291 1.00 5.91 H new ATOM 0 HG2 GLU A 60 -15.031 -10.764 -16.146 1.00 6.37 H new ATOM 0 HG3 GLU A 60 -15.984 -9.560 -15.302 1.00 6.37 H new ATOM 919 N ASN A 61 -12.850 -7.775 -16.293 1.00 4.82 N ATOM 920 CA ASN A 61 -11.556 -8.161 -15.757 1.00 5.21 C ATOM 921 C ASN A 61 -11.633 -8.067 -14.246 1.00 4.96 C ATOM 922 O ASN A 61 -11.197 -8.973 -13.520 1.00 5.37 O ATOM 923 CB ASN A 61 -10.454 -7.243 -16.289 1.00 5.66 C ATOM 924 CG ASN A 61 -9.093 -7.519 -15.675 1.00 6.39 C ATOM 925 OD1 ASN A 61 -8.781 -8.645 -15.286 1.00 6.60 O ATOM 926 ND2 ASN A 61 -8.277 -6.484 -15.574 1.00 7.02 N ATOM 0 H ASN A 61 -13.142 -6.833 -16.034 1.00 4.82 H new ATOM 0 HA ASN A 61 -11.314 -9.178 -16.064 1.00 5.21 H new ATOM 0 HB2 ASN A 61 -10.387 -7.357 -17.371 1.00 5.66 H new ATOM 0 HB3 ASN A 61 -10.729 -6.206 -16.094 1.00 5.66 H new ATOM 0 HD21 ASN A 61 -7.352 -6.603 -15.162 1.00 7.02 H new ATOM 0 HD22 ASN A 61 -8.573 -5.567 -15.908 1.00 7.02 H new ATOM 933 N ALA A 62 -12.238 -6.963 -13.807 1.00 4.60 N ATOM 934 CA ALA A 62 -12.507 -6.673 -12.425 1.00 4.73 C ATOM 935 C ALA A 62 -11.255 -6.430 -11.638 1.00 4.93 C ATOM 936 O ALA A 62 -11.032 -5.320 -11.150 1.00 5.41 O ATOM 937 CB ALA A 62 -13.350 -7.772 -11.855 1.00 4.86 C ATOM 0 H ALA A 62 -12.560 -6.229 -14.438 1.00 4.60 H new ATOM 0 HA ALA A 62 -13.063 -5.738 -12.358 1.00 4.73 H new ATOM 0 HB1 ALA A 62 -13.560 -7.562 -10.806 1.00 4.86 H new ATOM 0 HB2 ALA A 62 -14.287 -7.835 -12.408 1.00 4.86 H new ATOM 0 HB3 ALA A 62 -12.816 -8.719 -11.936 1.00 4.86 H new ATOM 943 N ASP A 63 -10.414 -7.427 -11.534 1.00 4.87 N ATOM 944 CA ASP A 63 -9.297 -7.302 -10.656 1.00 5.36 C ATOM 945 C ASP A 63 -8.250 -8.369 -10.874 1.00 5.66 C ATOM 946 O ASP A 63 -7.294 -8.507 -10.110 1.00 6.14 O ATOM 947 CB ASP A 63 -9.801 -7.387 -9.240 1.00 5.84 C ATOM 948 CG ASP A 63 -10.077 -8.826 -8.832 1.00 6.49 C ATOM 949 OD1 ASP A 63 -10.975 -9.451 -9.424 1.00 7.01 O ATOM 950 OD2 ASP A 63 -9.421 -9.327 -7.896 1.00 6.76 O1- ATOM 0 H ASP A 63 -10.484 -8.312 -12.037 1.00 4.87 H new ATOM 0 HA ASP A 63 -8.818 -6.344 -10.860 1.00 5.36 H new ATOM 0 HB2 ASP A 63 -9.065 -6.951 -8.564 1.00 5.84 H new ATOM 0 HB3 ASP A 63 -10.713 -6.798 -9.141 1.00 5.84 H new ATOM 955 N GLY A 64 -8.436 -9.097 -11.951 1.00 5.66 N ATOM 956 CA GLY A 64 -7.554 -10.193 -12.275 1.00 6.25 C ATOM 957 C GLY A 64 -7.854 -11.421 -11.458 1.00 6.54 C ATOM 958 O GLY A 64 -7.210 -12.456 -11.640 1.00 7.20 O ATOM 0 H GLY A 64 -9.193 -8.949 -12.619 1.00 5.66 H new ATOM 0 HA2 GLY A 64 -7.647 -10.431 -13.335 1.00 6.25 H new ATOM 0 HA3 GLY A 64 -6.521 -9.889 -12.106 1.00 6.25 H new ATOM 962 N ALA A 65 -8.855 -11.299 -10.577 1.00 6.34 N ATOM 963 CA ALA A 65 -9.231 -12.353 -9.647 1.00 6.92 C ATOM 964 C ALA A 65 -8.128 -12.566 -8.616 1.00 7.26 C ATOM 965 O ALA A 65 -7.706 -13.697 -8.364 1.00 7.82 O ATOM 966 CB ALA A 65 -9.547 -13.639 -10.399 1.00 7.42 C ATOM 0 H ALA A 65 -9.426 -10.458 -10.495 1.00 6.34 H new ATOM 0 HA ALA A 65 -10.133 -12.050 -9.115 1.00 6.92 H new ATOM 0 HB1 ALA A 65 -9.826 -14.417 -9.688 1.00 7.42 H new ATOM 0 HB2 ALA A 65 -10.373 -13.464 -11.088 1.00 7.42 H new ATOM 0 HB3 ALA A 65 -8.668 -13.958 -10.959 1.00 7.42 H new ATOM 972 N ALA A 66 -7.675 -11.468 -8.009 1.00 7.17 N ATOM 973 CA ALA A 66 -6.550 -11.513 -7.080 1.00 7.77 C ATOM 974 C ALA A 66 -6.356 -10.180 -6.359 1.00 7.57 C ATOM 975 O ALA A 66 -6.214 -10.137 -5.135 1.00 8.11 O ATOM 976 CB ALA A 66 -5.270 -11.886 -7.820 1.00 8.65 C ATOM 0 H ALA A 66 -8.071 -10.538 -8.145 1.00 7.17 H new ATOM 0 HA ALA A 66 -6.776 -12.272 -6.331 1.00 7.77 H new ATOM 0 HB1 ALA A 66 -4.438 -11.916 -7.116 1.00 8.65 H new ATOM 0 HB2 ALA A 66 -5.390 -12.866 -8.283 1.00 8.65 H new ATOM 0 HB3 ALA A 66 -5.066 -11.143 -8.591 1.00 8.65 H new ATOM 982 N VAL A 67 -6.357 -9.091 -7.118 1.00 6.98 N ATOM 983 CA VAL A 67 -6.033 -7.778 -6.568 1.00 6.95 C ATOM 984 C VAL A 67 -7.250 -7.157 -5.874 1.00 6.91 C ATOM 985 O VAL A 67 -7.413 -7.304 -4.663 1.00 7.31 O ATOM 986 CB VAL A 67 -5.506 -6.825 -7.668 1.00 6.72 C ATOM 987 CG1 VAL A 67 -4.937 -5.551 -7.060 1.00 6.95 C ATOM 988 CG2 VAL A 67 -4.468 -7.529 -8.533 1.00 6.89 C ATOM 0 H VAL A 67 -6.578 -9.089 -8.114 1.00 6.98 H new ATOM 0 HA VAL A 67 -5.245 -7.920 -5.828 1.00 6.95 H new ATOM 0 HB VAL A 67 -6.345 -6.543 -8.304 1.00 6.72 H new ATOM 0 HG11 VAL A 67 -4.574 -4.899 -7.855 1.00 6.95 H new ATOM 0 HG12 VAL A 67 -5.716 -5.037 -6.497 1.00 6.95 H new ATOM 0 HG13 VAL A 67 -4.113 -5.803 -6.392 1.00 6.95 H new ATOM 0 HG21 VAL A 67 -4.109 -6.844 -9.301 1.00 6.89 H new ATOM 0 HG22 VAL A 67 -3.632 -7.848 -7.911 1.00 6.89 H new ATOM 0 HG23 VAL A 67 -4.920 -8.400 -9.007 1.00 6.89 H new ATOM 998 N ARG A 68 -8.085 -6.481 -6.675 1.00 6.66 N ATOM 999 CA ARG A 68 -9.374 -5.896 -6.274 1.00 6.87 C ATOM 1000 C ARG A 68 -9.341 -5.064 -5.002 1.00 7.21 C ATOM 1001 O ARG A 68 -8.318 -4.876 -4.340 1.00 7.68 O ATOM 1002 CB ARG A 68 -10.433 -6.980 -6.124 1.00 7.41 C ATOM 1003 CG ARG A 68 -10.227 -7.851 -4.928 1.00 7.79 C ATOM 1004 CD ARG A 68 -11.322 -8.889 -4.805 1.00 8.65 C ATOM 1005 NE ARG A 68 -11.457 -9.651 -6.042 1.00 8.94 N ATOM 1006 CZ ARG A 68 -12.486 -10.438 -6.330 1.00 9.70 C ATOM 1007 NH1 ARG A 68 -13.450 -10.631 -5.436 1.00 10.21 N1+ ATOM 1008 NH2 ARG A 68 -12.544 -11.035 -7.514 1.00 10.14 N ATOM 0 H ARG A 68 -7.873 -6.320 -7.660 1.00 6.66 H new ATOM 0 HA ARG A 68 -9.621 -5.209 -7.083 1.00 6.87 H new ATOM 0 HB2 ARG A 68 -11.415 -6.511 -6.058 1.00 7.41 H new ATOM 0 HB3 ARG A 68 -10.436 -7.601 -7.020 1.00 7.41 H new ATOM 0 HG2 ARG A 68 -9.259 -8.348 -5.000 1.00 7.79 H new ATOM 0 HG3 ARG A 68 -10.204 -7.236 -4.028 1.00 7.79 H new ATOM 0 HD2 ARG A 68 -11.097 -9.564 -3.980 1.00 8.65 H new ATOM 0 HD3 ARG A 68 -12.267 -8.400 -4.569 1.00 8.65 H new ATOM 0 HE ARG A 68 -10.710 -9.574 -6.732 1.00 8.94 H new ATOM 0 HH11 ARG A 68 -13.400 -10.174 -4.526 1.00 10.21 H new ATOM 0 HH12 ARG A 68 -14.240 -11.236 -5.660 1.00 10.21 H new ATOM 0 HH21 ARG A 68 -11.800 -10.888 -8.196 1.00 10.14 H new ATOM 0 HH22 ARG A 68 -13.332 -11.641 -7.741 1.00 10.14 H new ATOM 1022 N ILE A 69 -10.505 -4.516 -4.733 1.00 7.25 N ATOM 1023 CA ILE A 69 -10.782 -3.808 -3.501 1.00 7.89 C ATOM 1024 C ILE A 69 -11.789 -4.595 -2.695 1.00 8.72 C ATOM 1025 O ILE A 69 -12.582 -5.352 -3.255 1.00 8.86 O ATOM 1026 CB ILE A 69 -11.374 -2.414 -3.758 1.00 7.93 C ATOM 1027 CG1 ILE A 69 -10.623 -1.710 -4.890 1.00 7.29 C ATOM 1028 CG2 ILE A 69 -11.326 -1.607 -2.477 1.00 8.79 C ATOM 1029 CD1 ILE A 69 -11.080 -0.287 -5.145 1.00 7.43 C ATOM 0 H ILE A 69 -11.298 -4.550 -5.373 1.00 7.25 H new ATOM 0 HA ILE A 69 -9.837 -3.696 -2.969 1.00 7.89 H new ATOM 0 HB ILE A 69 -12.414 -2.512 -4.071 1.00 7.93 H new ATOM 0 HG12 ILE A 69 -9.559 -1.702 -4.655 1.00 7.29 H new ATOM 0 HG13 ILE A 69 -10.743 -2.288 -5.806 1.00 7.29 H new ATOM 0 HG21 ILE A 69 -11.745 -0.617 -2.655 1.00 8.79 H new ATOM 0 HG22 ILE A 69 -11.906 -2.114 -1.706 1.00 8.79 H new ATOM 0 HG23 ILE A 69 -10.292 -1.509 -2.147 1.00 8.79 H new ATOM 0 HD11 ILE A 69 -10.499 0.141 -5.962 1.00 7.43 H new ATOM 0 HD12 ILE A 69 -12.137 -0.287 -5.413 1.00 7.43 H new ATOM 0 HD13 ILE A 69 -10.934 0.309 -4.244 1.00 7.43 H new ATOM 1041 N ASP A 70 -11.776 -4.398 -1.389 1.00 9.49 N ATOM 1042 CA ASP A 70 -12.683 -5.102 -0.507 1.00 10.50 C ATOM 1043 C ASP A 70 -14.072 -4.467 -0.524 1.00 10.98 C ATOM 1044 O ASP A 70 -14.653 -4.174 0.521 1.00 11.84 O ATOM 1045 CB ASP A 70 -12.107 -5.135 0.906 1.00 11.29 C ATOM 1046 CG ASP A 70 -12.821 -6.130 1.801 1.00 12.36 C ATOM 1047 OD1 ASP A 70 -12.716 -7.350 1.548 1.00 12.66 O1- ATOM 1048 OD2 ASP A 70 -13.501 -5.699 2.756 1.00 13.02 O ATOM 0 H ASP A 70 -11.143 -3.753 -0.916 1.00 9.49 H new ATOM 0 HA ASP A 70 -12.793 -6.127 -0.862 1.00 10.50 H new ATOM 0 HB2 ASP A 70 -11.048 -5.389 0.857 1.00 11.29 H new ATOM 0 HB3 ASP A 70 -12.176 -4.140 1.346 1.00 11.29 H new ATOM 1053 N GLY A 71 -14.584 -4.240 -1.729 1.00 10.56 N ATOM 1054 CA GLY A 71 -15.908 -3.675 -1.901 1.00 11.12 C ATOM 1055 C GLY A 71 -16.036 -2.316 -1.253 1.00 11.32 C ATOM 1056 O GLY A 71 -17.092 -1.951 -0.735 1.00 12.13 O ATOM 0 H GLY A 71 -14.096 -4.441 -2.602 1.00 10.56 H new ATOM 0 HA2 GLY A 71 -16.130 -3.591 -2.965 1.00 11.12 H new ATOM 0 HA3 GLY A 71 -16.648 -4.351 -1.473 1.00 11.12 H new ATOM 1060 N ARG A 72 -14.945 -1.580 -1.272 1.00 10.73 N ATOM 1061 CA ARG A 72 -14.887 -0.257 -0.711 1.00 11.04 C ATOM 1062 C ARG A 72 -14.171 0.633 -1.692 1.00 10.55 C ATOM 1063 O ARG A 72 -13.832 0.200 -2.795 1.00 9.83 O ATOM 1064 CB ARG A 72 -14.137 -0.291 0.621 1.00 11.16 C ATOM 1065 CG ARG A 72 -12.620 -0.338 0.479 1.00 10.42 C ATOM 1066 CD ARG A 72 -11.937 -0.479 1.829 1.00 10.89 C ATOM 1067 NE ARG A 72 -12.114 0.707 2.668 1.00 11.31 N ATOM 1068 CZ ARG A 72 -11.503 0.883 3.841 1.00 11.83 C ATOM 1069 NH1 ARG A 72 -10.730 -0.077 4.338 1.00 12.00 N1+ ATOM 1070 NH2 ARG A 72 -11.680 2.008 4.525 1.00 12.38 N ATOM 0 H ARG A 72 -14.066 -1.892 -1.684 1.00 10.73 H new ATOM 0 HA ARG A 72 -15.891 0.124 -0.526 1.00 11.04 H new ATOM 0 HB2 ARG A 72 -14.410 0.590 1.202 1.00 11.16 H new ATOM 0 HB3 ARG A 72 -14.465 -1.162 1.189 1.00 11.16 H new ATOM 0 HG2 ARG A 72 -12.339 -1.175 -0.161 1.00 10.42 H new ATOM 0 HG3 ARG A 72 -12.272 0.570 -0.013 1.00 10.42 H new ATOM 0 HD2 ARG A 72 -12.337 -1.351 2.347 1.00 10.89 H new ATOM 0 HD3 ARG A 72 -10.873 -0.659 1.678 1.00 10.89 H new ATOM 0 HE ARG A 72 -12.740 1.441 2.337 1.00 11.31 H new ATOM 0 HH11 ARG A 72 -10.604 -0.948 3.823 1.00 12.00 H new ATOM 0 HH12 ARG A 72 -10.263 0.057 5.235 1.00 12.00 H new ATOM 0 HH21 ARG A 72 -12.285 2.741 4.154 1.00 12.38 H new ATOM 0 HH22 ARG A 72 -11.211 2.139 5.421 1.00 12.38 H new ATOM 1084 N VAL A 73 -13.943 1.858 -1.308 1.00 11.11 N ATOM 1085 CA VAL A 73 -13.143 2.738 -2.116 1.00 10.97 C ATOM 1086 C VAL A 73 -11.971 3.256 -1.325 1.00 10.92 C ATOM 1087 O VAL A 73 -12.125 3.882 -0.277 1.00 11.44 O ATOM 1088 CB VAL A 73 -13.954 3.899 -2.665 1.00 11.58 C ATOM 1089 CG1 VAL A 73 -13.110 4.760 -3.599 1.00 11.61 C ATOM 1090 CG2 VAL A 73 -15.191 3.361 -3.363 1.00 11.56 C ATOM 0 H VAL A 73 -14.298 2.269 -0.445 1.00 11.11 H new ATOM 0 HA VAL A 73 -12.778 2.158 -2.964 1.00 10.97 H new ATOM 0 HB VAL A 73 -14.270 4.540 -1.842 1.00 11.58 H new ATOM 0 HG11 VAL A 73 -13.714 5.584 -3.979 1.00 11.61 H new ATOM 0 HG12 VAL A 73 -12.255 5.158 -3.053 1.00 11.61 H new ATOM 0 HG13 VAL A 73 -12.758 4.154 -4.434 1.00 11.61 H new ATOM 0 HG21 VAL A 73 -15.776 4.191 -3.758 1.00 11.56 H new ATOM 0 HG22 VAL A 73 -14.891 2.706 -4.181 1.00 11.56 H new ATOM 0 HG23 VAL A 73 -15.795 2.799 -2.651 1.00 11.56 H new ATOM 1100 N THR A 74 -10.806 2.966 -1.832 1.00 10.48 N ATOM 1101 CA THR A 74 -9.587 3.410 -1.242 1.00 10.58 C ATOM 1102 C THR A 74 -9.043 4.559 -2.079 1.00 10.71 C ATOM 1103 O THR A 74 -8.513 4.363 -3.174 1.00 10.65 O ATOM 1104 CB THR A 74 -8.560 2.259 -1.094 1.00 10.38 C ATOM 1105 OG1 THR A 74 -7.271 2.776 -0.751 1.00 10.63 O ATOM 1106 CG2 THR A 74 -8.466 1.416 -2.362 1.00 9.98 C ATOM 0 H THR A 74 -10.681 2.408 -2.677 1.00 10.48 H new ATOM 0 HA THR A 74 -9.780 3.760 -0.228 1.00 10.58 H new ATOM 0 HB THR A 74 -8.911 1.613 -0.289 1.00 10.38 H new ATOM 0 HG1 THR A 74 -6.635 2.036 -0.660 1.00 10.63 H new ATOM 0 HG21 THR A 74 -7.735 0.620 -2.217 1.00 9.98 H new ATOM 0 HG22 THR A 74 -9.440 0.979 -2.581 1.00 9.98 H new ATOM 0 HG23 THR A 74 -8.155 2.046 -3.196 1.00 9.98 H new ATOM 1114 N GLN A 75 -9.253 5.762 -1.576 1.00 11.10 N ATOM 1115 CA GLN A 75 -8.952 6.986 -2.298 1.00 11.47 C ATOM 1116 C GLN A 75 -7.444 7.206 -2.411 1.00 11.19 C ATOM 1117 O GLN A 75 -6.857 8.054 -1.729 1.00 11.49 O ATOM 1118 CB GLN A 75 -9.622 8.173 -1.597 1.00 12.23 C ATOM 1119 CG GLN A 75 -9.492 9.487 -2.350 1.00 12.99 C ATOM 1120 CD GLN A 75 -10.231 10.618 -1.670 1.00 13.67 C ATOM 1121 OE1 GLN A 75 -9.679 11.312 -0.815 1.00 13.95 O ATOM 1122 NE2 GLN A 75 -11.482 10.820 -2.049 1.00 14.09 N ATOM 0 H GLN A 75 -9.641 5.919 -0.646 1.00 11.10 H new ATOM 0 HA GLN A 75 -9.346 6.899 -3.311 1.00 11.47 H new ATOM 0 HB2 GLN A 75 -10.679 7.949 -1.456 1.00 12.23 H new ATOM 0 HB3 GLN A 75 -9.186 8.290 -0.605 1.00 12.23 H new ATOM 0 HG2 GLN A 75 -8.438 9.748 -2.440 1.00 12.99 H new ATOM 0 HG3 GLN A 75 -9.877 9.362 -3.362 1.00 12.99 H new ATOM 0 HE21 GLN A 75 -11.902 10.222 -2.761 1.00 14.09 H new ATOM 0 HE22 GLN A 75 -12.027 11.574 -1.629 1.00 14.09 H new ATOM 1131 N ASN A 76 -6.826 6.421 -3.267 1.00 10.79 N ATOM 1132 CA ASN A 76 -5.420 6.548 -3.559 1.00 10.66 C ATOM 1133 C ASN A 76 -5.227 6.424 -5.060 1.00 11.04 C ATOM 1134 O ASN A 76 -5.886 5.617 -5.721 1.00 11.22 O ATOM 1135 CB ASN A 76 -4.585 5.495 -2.808 1.00 10.19 C ATOM 1136 CG ASN A 76 -4.675 4.099 -3.404 1.00 9.94 C ATOM 1137 OD1 ASN A 76 -3.878 3.731 -4.261 1.00 10.12 O ATOM 1138 ND2 ASN A 76 -5.625 3.305 -2.944 1.00 9.78 N ATOM 0 H ASN A 76 -7.291 5.673 -3.782 1.00 10.79 H new ATOM 0 HA ASN A 76 -5.071 7.523 -3.219 1.00 10.66 H new ATOM 0 HB2 ASN A 76 -3.542 5.810 -2.801 1.00 10.19 H new ATOM 0 HB3 ASN A 76 -4.914 5.458 -1.769 1.00 10.19 H new ATOM 0 HD21 ASN A 76 -5.712 2.354 -3.302 1.00 9.78 H new ATOM 0 HD22 ASN A 76 -6.271 3.643 -2.231 1.00 9.78 H new ATOM 1145 N LEU A 77 -4.361 7.261 -5.587 1.00 11.36 N ATOM 1146 CA LEU A 77 -4.063 7.297 -7.018 1.00 11.92 C ATOM 1147 C LEU A 77 -3.393 6.006 -7.475 1.00 11.78 C ATOM 1148 O LEU A 77 -3.411 5.659 -8.655 1.00 12.15 O ATOM 1149 CB LEU A 77 -3.152 8.483 -7.326 1.00 12.58 C ATOM 1150 CG LEU A 77 -3.708 9.848 -6.922 1.00 13.28 C ATOM 1151 CD1 LEU A 77 -2.664 10.933 -7.127 1.00 13.59 C ATOM 1152 CD2 LEU A 77 -4.966 10.165 -7.713 1.00 13.71 C ATOM 0 H LEU A 77 -3.836 7.943 -5.039 1.00 11.36 H new ATOM 0 HA LEU A 77 -5.004 7.404 -7.558 1.00 11.92 H new ATOM 0 HB2 LEU A 77 -2.199 8.331 -6.819 1.00 12.58 H new ATOM 0 HB3 LEU A 77 -2.945 8.494 -8.396 1.00 12.58 H new ATOM 0 HG LEU A 77 -3.965 9.814 -5.863 1.00 13.28 H new ATOM 0 HD11 LEU A 77 -3.079 11.897 -6.834 1.00 13.59 H new ATOM 0 HD12 LEU A 77 -1.788 10.714 -6.517 1.00 13.59 H new ATOM 0 HD13 LEU A 77 -2.376 10.967 -8.178 1.00 13.59 H new ATOM 0 HD21 LEU A 77 -5.349 11.140 -7.413 1.00 13.71 H new ATOM 0 HD22 LEU A 77 -4.733 10.179 -8.778 1.00 13.71 H new ATOM 0 HD23 LEU A 77 -5.721 9.403 -7.517 1.00 13.71 H new ATOM 1164 N GLY A 78 -2.824 5.302 -6.520 1.00 11.41 N ATOM 1165 CA GLY A 78 -2.049 4.119 -6.806 1.00 11.44 C ATOM 1166 C GLY A 78 -0.855 4.072 -5.906 1.00 10.55 C ATOM 1167 O GLY A 78 -0.563 3.047 -5.289 1.00 10.48 O ATOM 0 H GLY A 78 -2.886 5.534 -5.529 1.00 11.41 H new ATOM 0 HA2 GLY A 78 -2.660 3.228 -6.663 1.00 11.44 H new ATOM 0 HA3 GLY A 78 -1.731 4.123 -7.849 1.00 11.44 H new ATOM 1171 N VAL A 79 -0.169 5.210 -5.872 1.00 9.99 N ATOM 1172 CA VAL A 79 0.828 5.535 -4.866 1.00 9.16 C ATOM 1173 C VAL A 79 1.690 4.330 -4.462 1.00 8.69 C ATOM 1174 O VAL A 79 1.580 3.764 -3.375 1.00 8.93 O ATOM 1175 CB VAL A 79 0.143 6.215 -3.663 1.00 9.21 C ATOM 1176 CG1 VAL A 79 -0.705 5.249 -2.859 1.00 8.66 C ATOM 1177 CG2 VAL A 79 1.161 6.930 -2.792 1.00 9.75 C ATOM 0 H VAL A 79 -0.297 5.949 -6.563 1.00 9.99 H new ATOM 0 HA VAL A 79 1.535 6.240 -5.302 1.00 9.16 H new ATOM 0 HB VAL A 79 -0.541 6.964 -4.062 1.00 9.21 H new ATOM 0 HG11 VAL A 79 -1.165 5.777 -2.024 1.00 8.66 H new ATOM 0 HG12 VAL A 79 -1.483 4.830 -3.497 1.00 8.66 H new ATOM 0 HG13 VAL A 79 -0.077 4.444 -2.477 1.00 8.66 H new ATOM 0 HG21 VAL A 79 0.653 7.401 -1.951 1.00 9.75 H new ATOM 0 HG22 VAL A 79 1.890 6.211 -2.419 1.00 9.75 H new ATOM 0 HG23 VAL A 79 1.672 7.692 -3.380 1.00 9.75 H new ATOM 1187 N ARG A 80 2.578 3.963 -5.360 1.00 8.26 N ATOM 1188 CA ARG A 80 3.391 2.778 -5.177 1.00 8.04 C ATOM 1189 C ARG A 80 4.551 3.077 -4.258 1.00 7.16 C ATOM 1190 O ARG A 80 5.237 4.090 -4.397 1.00 6.61 O ATOM 1191 CB ARG A 80 3.888 2.282 -6.525 1.00 8.39 C ATOM 1192 CG ARG A 80 2.750 1.946 -7.463 1.00 8.96 C ATOM 1193 CD ARG A 80 3.240 1.478 -8.822 1.00 9.63 C ATOM 1194 NE ARG A 80 3.522 0.044 -8.853 1.00 10.25 N ATOM 1195 CZ ARG A 80 3.199 -0.748 -9.878 1.00 10.94 C ATOM 1196 NH1 ARG A 80 2.609 -0.239 -10.952 1.00 11.11 N1+ ATOM 1197 NH2 ARG A 80 3.464 -2.047 -9.833 1.00 11.64 N ATOM 0 H ARG A 80 2.757 4.469 -6.227 1.00 8.26 H new ATOM 0 HA ARG A 80 2.786 1.996 -4.718 1.00 8.04 H new ATOM 0 HB2 ARG A 80 4.520 3.044 -6.981 1.00 8.39 H new ATOM 0 HB3 ARG A 80 4.510 1.399 -6.379 1.00 8.39 H new ATOM 0 HG2 ARG A 80 2.131 1.168 -7.015 1.00 8.96 H new ATOM 0 HG3 ARG A 80 2.116 2.824 -7.591 1.00 8.96 H new ATOM 0 HD2 ARG A 80 2.489 1.714 -9.576 1.00 9.63 H new ATOM 0 HD3 ARG A 80 4.143 2.028 -9.088 1.00 9.63 H new ATOM 0 HE ARG A 80 3.990 -0.374 -8.049 1.00 10.25 H new ATOM 0 HH11 ARG A 80 2.402 0.759 -10.995 1.00 11.11 H new ATOM 0 HH12 ARG A 80 2.363 -0.845 -11.734 1.00 11.11 H new ATOM 0 HH21 ARG A 80 3.917 -2.447 -9.011 1.00 11.64 H new ATOM 0 HH22 ARG A 80 3.214 -2.646 -10.620 1.00 11.64 H new ATOM 1211 N THR A 81 4.742 2.184 -3.317 1.00 7.24 N ATOM 1212 CA THR A 81 5.692 2.378 -2.238 1.00 6.59 C ATOM 1213 C THR A 81 6.568 1.157 -2.075 1.00 6.82 C ATOM 1214 O THR A 81 6.135 0.030 -2.313 1.00 7.73 O ATOM 1215 CB THR A 81 4.980 2.641 -0.889 1.00 6.98 C ATOM 1216 OG1 THR A 81 4.018 1.612 -0.633 1.00 8.00 O ATOM 1217 CG2 THR A 81 4.296 3.994 -0.874 1.00 7.05 C ATOM 0 H THR A 81 4.242 1.296 -3.274 1.00 7.24 H new ATOM 0 HA THR A 81 6.295 3.247 -2.503 1.00 6.59 H new ATOM 0 HB THR A 81 5.739 2.637 -0.107 1.00 6.98 H new ATOM 0 HG1 THR A 81 3.574 1.785 0.223 1.00 8.00 H new ATOM 0 HG21 THR A 81 3.807 4.144 0.089 1.00 7.05 H new ATOM 0 HG22 THR A 81 5.037 4.778 -1.030 1.00 7.05 H new ATOM 0 HG23 THR A 81 3.552 4.034 -1.669 1.00 7.05 H new ATOM 1225 N ALA A 82 7.795 1.389 -1.679 1.00 6.18 N ATOM 1226 CA ALA A 82 8.693 0.313 -1.350 1.00 6.65 C ATOM 1227 C ALA A 82 9.075 0.425 0.111 1.00 6.65 C ATOM 1228 O ALA A 82 9.479 1.493 0.575 1.00 5.88 O ATOM 1229 CB ALA A 82 9.920 0.349 -2.246 1.00 6.36 C ATOM 0 H ALA A 82 8.196 2.321 -1.577 1.00 6.18 H new ATOM 0 HA ALA A 82 8.199 -0.644 -1.516 1.00 6.65 H new ATOM 0 HB1 ALA A 82 10.587 -0.472 -1.982 1.00 6.36 H new ATOM 0 HB2 ALA A 82 9.613 0.247 -3.287 1.00 6.36 H new ATOM 0 HB3 ALA A 82 10.441 1.297 -2.112 1.00 6.36 H new ATOM 1235 N GLU A 83 8.901 -0.657 0.839 1.00 7.70 N ATOM 1236 CA GLU A 83 9.230 -0.684 2.246 1.00 8.10 C ATOM 1237 C GLU A 83 10.736 -0.704 2.419 1.00 7.90 C ATOM 1238 O GLU A 83 11.447 -1.381 1.678 1.00 8.21 O ATOM 1239 CB GLU A 83 8.599 -1.907 2.912 1.00 9.47 C ATOM 1240 CG GLU A 83 8.836 -1.981 4.410 1.00 10.14 C ATOM 1241 CD GLU A 83 8.410 -3.310 4.997 1.00 11.52 C ATOM 1242 OE1 GLU A 83 7.205 -3.498 5.250 1.00 12.06 O1- ATOM 1243 OE2 GLU A 83 9.285 -4.181 5.195 1.00 12.15 O ATOM 0 H GLU A 83 8.531 -1.535 0.475 1.00 7.70 H new ATOM 0 HA GLU A 83 8.832 0.211 2.724 1.00 8.10 H new ATOM 0 HB2 GLU A 83 7.525 -1.898 2.724 1.00 9.47 H new ATOM 0 HB3 GLU A 83 8.997 -2.808 2.446 1.00 9.47 H new ATOM 0 HG2 GLU A 83 9.894 -1.818 4.616 1.00 10.14 H new ATOM 0 HG3 GLU A 83 8.288 -1.177 4.902 1.00 10.14 H new ATOM 1250 N VAL A 84 11.207 0.068 3.374 1.00 7.58 N ATOM 1251 CA VAL A 84 12.618 0.112 3.711 1.00 7.50 C ATOM 1252 C VAL A 84 13.139 -1.249 4.123 1.00 8.74 C ATOM 1253 O VAL A 84 12.502 -1.962 4.901 1.00 9.71 O ATOM 1254 CB VAL A 84 12.873 1.129 4.833 1.00 7.28 C ATOM 1255 CG1 VAL A 84 14.281 0.998 5.372 1.00 7.49 C ATOM 1256 CG2 VAL A 84 12.615 2.537 4.329 1.00 6.28 C ATOM 0 H VAL A 84 10.624 0.684 3.941 1.00 7.58 H new ATOM 0 HA VAL A 84 13.155 0.422 2.815 1.00 7.50 H new ATOM 0 HB VAL A 84 12.184 0.922 5.652 1.00 7.28 H new ATOM 0 HG11 VAL A 84 14.436 1.729 6.165 1.00 7.49 H new ATOM 0 HG12 VAL A 84 14.426 -0.006 5.770 1.00 7.49 H new ATOM 0 HG13 VAL A 84 14.996 1.177 4.569 1.00 7.49 H new ATOM 0 HG21 VAL A 84 12.799 3.250 5.132 1.00 6.28 H new ATOM 0 HG22 VAL A 84 13.281 2.752 3.493 1.00 6.28 H new ATOM 0 HG23 VAL A 84 11.580 2.621 3.999 1.00 6.28 H new ATOM 1266 N LYS A 85 14.305 -1.594 3.594 1.00 8.82 N ATOM 1267 CA LYS A 85 14.886 -2.897 3.840 1.00 10.03 C ATOM 1268 C LYS A 85 16.304 -2.785 4.358 1.00 10.02 C ATOM 1269 O LYS A 85 17.000 -1.802 4.110 1.00 9.25 O ATOM 1270 CB LYS A 85 14.915 -3.743 2.565 1.00 10.75 C ATOM 1271 CG LYS A 85 13.577 -3.849 1.874 1.00 10.58 C ATOM 1272 CD LYS A 85 12.553 -4.525 2.759 1.00 11.03 C ATOM 1273 CE LYS A 85 11.166 -4.333 2.196 1.00 10.50 C ATOM 1274 NZ LYS A 85 10.150 -5.165 2.897 1.00 11.02 N1+ ATOM 0 H LYS A 85 14.863 -0.987 2.993 1.00 8.82 H new ATOM 0 HA LYS A 85 14.257 -3.375 4.590 1.00 10.03 H new ATOM 0 HB2 LYS A 85 15.639 -3.314 1.872 1.00 10.75 H new ATOM 0 HB3 LYS A 85 15.266 -4.745 2.813 1.00 10.75 H new ATOM 0 HG2 LYS A 85 13.226 -2.854 1.603 1.00 10.58 H new ATOM 0 HG3 LYS A 85 13.688 -4.412 0.947 1.00 10.58 H new ATOM 0 HD2 LYS A 85 12.777 -5.589 2.838 1.00 11.03 H new ATOM 0 HD3 LYS A 85 12.604 -4.112 3.767 1.00 11.03 H new ATOM 0 HE2 LYS A 85 10.887 -3.282 2.273 1.00 10.50 H new ATOM 0 HE3 LYS A 85 11.169 -4.585 1.135 1.00 10.50 H new ATOM 0 HZ1 LYS A 85 9.247 -5.117 2.383 1.00 11.02 H new ATOM 0 HZ2 LYS A 85 10.475 -6.152 2.934 1.00 11.02 H new ATOM 0 HZ3 LYS A 85 10.016 -4.808 3.865 1.00 11.02 H new ATOM 1288 N LEU A 86 16.713 -3.797 5.080 1.00 10.96 N ATOM 1289 CA LEU A 86 18.124 -4.031 5.328 1.00 11.21 C ATOM 1290 C LEU A 86 18.668 -4.908 4.214 1.00 11.85 C ATOM 1291 O LEU A 86 18.120 -5.975 3.940 1.00 12.43 O ATOM 1292 CB LEU A 86 18.354 -4.715 6.672 1.00 12.08 C ATOM 1293 CG LEU A 86 18.500 -3.781 7.868 1.00 11.90 C ATOM 1294 CD1 LEU A 86 17.173 -3.132 8.229 1.00 11.97 C ATOM 1295 CD2 LEU A 86 19.087 -4.538 9.048 1.00 12.76 C ATOM 0 H LEU A 86 16.089 -4.479 5.511 1.00 10.96 H new ATOM 0 HA LEU A 86 18.638 -3.070 5.354 1.00 11.21 H new ATOM 0 HB2 LEU A 86 17.522 -5.393 6.862 1.00 12.08 H new ATOM 0 HB3 LEU A 86 19.253 -5.327 6.599 1.00 12.08 H new ATOM 0 HG LEU A 86 19.185 -2.977 7.598 1.00 11.90 H new ATOM 0 HD11 LEU A 86 17.312 -2.472 9.086 1.00 11.97 H new ATOM 0 HD12 LEU A 86 16.808 -2.553 7.380 1.00 11.97 H new ATOM 0 HD13 LEU A 86 16.446 -3.905 8.480 1.00 11.97 H new ATOM 0 HD21 LEU A 86 19.188 -3.864 9.899 1.00 12.76 H new ATOM 0 HD22 LEU A 86 18.427 -5.363 9.315 1.00 12.76 H new ATOM 0 HD23 LEU A 86 20.067 -4.930 8.777 1.00 12.76 H new ATOM 1307 N GLY A 87 19.722 -4.465 3.555 1.00 11.89 N ATOM 1308 CA GLY A 87 20.182 -5.198 2.390 1.00 12.65 C ATOM 1309 C GLY A 87 21.585 -5.703 2.522 1.00 12.97 C ATOM 1310 O GLY A 87 22.174 -6.192 1.559 1.00 13.25 O ATOM 0 H GLY A 87 20.260 -3.632 3.794 1.00 11.89 H new ATOM 0 HA2 GLY A 87 19.515 -6.042 2.214 1.00 12.65 H new ATOM 0 HA3 GLY A 87 20.117 -4.552 1.514 1.00 12.65 H new ATOM 1314 N ARG A 88 22.119 -5.569 3.708 1.00 13.08 N ATOM 1315 CA ARG A 88 23.440 -6.034 4.002 1.00 13.46 C ATOM 1316 C ARG A 88 23.495 -6.640 5.398 1.00 14.71 C ATOM 1317 O ARG A 88 22.656 -6.344 6.255 1.00 15.30 O ATOM 1318 CB ARG A 88 24.368 -4.850 3.905 1.00 13.18 C ATOM 1319 CG ARG A 88 23.860 -3.652 4.635 1.00 13.67 C ATOM 1320 CD ARG A 88 24.409 -2.376 4.052 1.00 14.20 C ATOM 1321 NE ARG A 88 24.212 -2.295 2.608 1.00 14.90 N ATOM 1322 CZ ARG A 88 24.608 -1.270 1.862 1.00 15.63 C ATOM 1323 NH1 ARG A 88 25.208 -0.228 2.422 1.00 15.77 N1+ ATOM 1324 NH2 ARG A 88 24.413 -1.294 0.549 1.00 16.35 N ATOM 0 H ARG A 88 21.644 -5.132 4.497 1.00 13.08 H new ATOM 0 HA ARG A 88 23.736 -6.811 3.297 1.00 13.46 H new ATOM 0 HB2 ARG A 88 25.344 -5.126 4.305 1.00 13.18 H new ATOM 0 HB3 ARG A 88 24.514 -4.595 2.855 1.00 13.18 H new ATOM 0 HG2 ARG A 88 22.771 -3.634 4.593 1.00 13.67 H new ATOM 0 HG3 ARG A 88 24.137 -3.721 5.687 1.00 13.67 H new ATOM 0 HD2 ARG A 88 23.926 -1.524 4.530 1.00 14.20 H new ATOM 0 HD3 ARG A 88 25.474 -2.306 4.275 1.00 14.20 H new ATOM 0 HE ARG A 88 23.742 -3.072 2.144 1.00 14.90 H new ATOM 0 HH11 ARG A 88 25.367 -0.212 3.429 1.00 15.77 H new ATOM 0 HH12 ARG A 88 25.510 0.557 1.845 1.00 15.77 H new ATOM 0 HH21 ARG A 88 23.960 -2.098 0.115 1.00 16.35 H new ATOM 0 HH22 ARG A 88 24.716 -0.508 -0.026 1.00 16.35 H new ATOM 1338 N LEU A 89 24.490 -7.478 5.601 1.00 15.20 N ATOM 1339 CA LEU A 89 24.681 -8.190 6.852 1.00 16.46 C ATOM 1340 C LEU A 89 26.135 -8.618 6.943 1.00 16.93 C ATOM 1341 O LEU A 89 26.603 -9.444 6.157 1.00 16.94 O ATOM 1342 CB LEU A 89 23.747 -9.400 6.962 1.00 16.92 C ATOM 1343 CG LEU A 89 23.810 -10.158 8.290 1.00 17.63 C ATOM 1344 CD1 LEU A 89 23.416 -9.252 9.446 1.00 18.22 C ATOM 1345 CD2 LEU A 89 22.908 -11.380 8.239 1.00 17.91 C ATOM 0 H LEU A 89 25.197 -7.688 4.897 1.00 15.20 H new ATOM 0 HA LEU A 89 24.435 -7.529 7.683 1.00 16.46 H new ATOM 0 HB2 LEU A 89 22.723 -9.063 6.804 1.00 16.92 H new ATOM 0 HB3 LEU A 89 23.982 -10.094 6.155 1.00 16.92 H new ATOM 0 HG LEU A 89 24.836 -10.488 8.452 1.00 17.63 H new ATOM 0 HD11 LEU A 89 23.468 -9.811 10.380 1.00 18.22 H new ATOM 0 HD12 LEU A 89 24.099 -8.404 9.492 1.00 18.22 H new ATOM 0 HD13 LEU A 89 22.399 -8.891 9.295 1.00 18.22 H new ATOM 0 HD21 LEU A 89 22.961 -11.911 9.189 1.00 17.91 H new ATOM 0 HD22 LEU A 89 21.880 -11.066 8.056 1.00 17.91 H new ATOM 0 HD23 LEU A 89 23.235 -12.040 7.436 1.00 17.91 H new ATOM 1357 N GLY A 90 26.837 -8.042 7.897 1.00 17.39 N ATOM 1358 CA GLY A 90 28.273 -8.181 7.963 1.00 17.91 C ATOM 1359 C GLY A 90 28.900 -6.897 7.501 1.00 17.35 C ATOM 1360 O GLY A 90 29.757 -6.319 8.170 1.00 17.38 O ATOM 0 H GLY A 90 26.432 -7.471 8.639 1.00 17.39 H new ATOM 0 HA2 GLY A 90 28.585 -8.409 8.982 1.00 17.91 H new ATOM 0 HA3 GLY A 90 28.602 -9.010 7.336 1.00 17.91 H new ATOM 1364 N SER A 91 28.437 -6.454 6.343 1.00 16.99 N ATOM 1365 CA SER A 91 28.671 -5.108 5.873 1.00 16.48 C ATOM 1366 C SER A 91 27.797 -4.159 6.691 1.00 15.54 C ATOM 1367 O SER A 91 26.866 -4.587 7.376 1.00 15.66 O ATOM 1368 CB SER A 91 28.299 -5.027 4.392 1.00 16.77 C ATOM 1369 OG SER A 91 28.935 -6.059 3.652 1.00 17.11 O ATOM 0 H SER A 91 27.886 -7.026 5.703 1.00 16.99 H new ATOM 0 HA SER A 91 29.719 -4.832 5.989 1.00 16.48 H new ATOM 0 HB2 SER A 91 27.218 -5.107 4.280 1.00 16.77 H new ATOM 0 HB3 SER A 91 28.590 -4.055 3.993 1.00 16.77 H new ATOM 0 HG SER A 91 28.681 -5.989 2.708 1.00 17.11 H new ATOM 1375 N THR A 92 28.096 -2.879 6.594 1.00 14.73 N ATOM 1376 CA THR A 92 27.476 -1.867 7.439 1.00 13.85 C ATOM 1377 C THR A 92 26.044 -1.638 7.046 1.00 13.26 C ATOM 1378 O THR A 92 25.769 -0.981 6.047 1.00 13.32 O ATOM 1379 CB THR A 92 28.203 -0.526 7.341 1.00 13.23 C ATOM 1380 OG1 THR A 92 29.621 -0.724 7.414 1.00 13.97 O ATOM 1381 CG2 THR A 92 27.759 0.419 8.448 1.00 12.68 C ATOM 0 H THR A 92 28.774 -2.507 5.929 1.00 14.73 H new ATOM 0 HA THR A 92 27.534 -2.245 8.460 1.00 13.85 H new ATOM 0 HB THR A 92 27.950 -0.076 6.381 1.00 13.23 H new ATOM 0 HG1 THR A 92 30.076 0.142 7.348 1.00 13.97 H new ATOM 0 HG21 THR A 92 28.292 1.365 8.354 1.00 12.68 H new ATOM 0 HG22 THR A 92 26.687 0.597 8.366 1.00 12.68 H new ATOM 0 HG23 THR A 92 27.980 -0.027 9.418 1.00 12.68 H new ATOM 1389 N GLU A 93 25.156 -2.137 7.880 1.00 12.87 N ATOM 1390 CA GLU A 93 23.735 -2.110 7.618 1.00 12.37 C ATOM 1391 C GLU A 93 23.244 -0.712 7.301 1.00 11.13 C ATOM 1392 O GLU A 93 23.439 0.233 8.065 1.00 10.78 O ATOM 1393 CB GLU A 93 22.988 -2.683 8.807 1.00 13.03 C ATOM 1394 CG GLU A 93 21.550 -2.253 8.858 1.00 13.80 C ATOM 1395 CD GLU A 93 21.095 -1.939 10.269 1.00 14.57 C ATOM 1396 OE1 GLU A 93 20.745 -2.881 11.009 1.00 14.92 O1- ATOM 1397 OE2 GLU A 93 21.082 -0.751 10.651 1.00 14.94 O ATOM 0 H GLU A 93 25.404 -2.576 8.766 1.00 12.87 H new ATOM 0 HA GLU A 93 23.541 -2.723 6.738 1.00 12.37 H new ATOM 0 HB2 GLU A 93 23.035 -3.771 8.769 1.00 13.03 H new ATOM 0 HB3 GLU A 93 23.487 -2.374 9.726 1.00 13.03 H new ATOM 0 HG2 GLU A 93 21.414 -1.373 8.230 1.00 13.80 H new ATOM 0 HG3 GLU A 93 20.922 -3.041 8.443 1.00 13.80 H new ATOM 1404 N ARG A 94 22.618 -0.615 6.143 1.00 10.57 N ATOM 1405 CA ARG A 94 22.045 0.613 5.663 1.00 9.39 C ATOM 1406 C ARG A 94 20.634 0.305 5.184 1.00 8.96 C ATOM 1407 O ARG A 94 20.302 -0.864 4.964 1.00 9.64 O ATOM 1408 CB ARG A 94 22.882 1.170 4.510 1.00 9.13 C ATOM 1409 CG ARG A 94 23.024 2.687 4.502 1.00 9.07 C ATOM 1410 CD ARG A 94 23.976 3.189 5.585 1.00 9.14 C ATOM 1411 NE ARG A 94 23.404 3.123 6.928 1.00 9.49 N ATOM 1412 CZ ARG A 94 24.107 3.329 8.042 1.00 9.84 C ATOM 1413 NH1 ARG A 94 25.398 3.636 7.971 1.00 9.96 N1+ ATOM 1414 NH2 ARG A 94 23.518 3.237 9.224 1.00 10.27 N ATOM 0 H ARG A 94 22.496 -1.402 5.506 1.00 10.57 H new ATOM 0 HA ARG A 94 22.025 1.361 6.456 1.00 9.39 H new ATOM 0 HB2 ARG A 94 23.876 0.726 4.553 1.00 9.13 H new ATOM 0 HB3 ARG A 94 22.433 0.856 3.568 1.00 9.13 H new ATOM 0 HG2 ARG A 94 23.386 3.010 3.526 1.00 9.07 H new ATOM 0 HG3 ARG A 94 22.044 3.142 4.645 1.00 9.07 H new ATOM 0 HD2 ARG A 94 24.892 2.598 5.557 1.00 9.14 H new ATOM 0 HD3 ARG A 94 24.255 4.220 5.366 1.00 9.14 H new ATOM 0 HE ARG A 94 22.411 2.907 7.018 1.00 9.49 H new ATOM 0 HH11 ARG A 94 25.854 3.715 7.062 1.00 9.96 H new ATOM 0 HH12 ARG A 94 25.933 3.793 8.825 1.00 9.96 H new ATOM 0 HH21 ARG A 94 22.526 3.008 9.283 1.00 10.27 H new ATOM 0 HH22 ARG A 94 24.056 3.395 10.076 1.00 10.27 H new ATOM 1428 N LEU A 95 19.819 1.322 5.011 1.00 7.97 N ATOM 1429 CA LEU A 95 18.447 1.122 4.567 1.00 7.54 C ATOM 1430 C LEU A 95 18.382 1.200 3.044 1.00 6.99 C ATOM 1431 O LEU A 95 18.657 2.239 2.450 1.00 6.27 O ATOM 1432 CB LEU A 95 17.532 2.183 5.193 1.00 6.93 C ATOM 1433 CG LEU A 95 17.363 2.120 6.721 1.00 7.79 C ATOM 1434 CD1 LEU A 95 17.199 0.684 7.197 1.00 8.88 C ATOM 1435 CD2 LEU A 95 18.528 2.796 7.430 1.00 7.89 C ATOM 0 H LEU A 95 20.077 2.296 5.169 1.00 7.97 H new ATOM 0 HA LEU A 95 18.107 0.137 4.886 1.00 7.54 H new ATOM 0 HB2 LEU A 95 17.921 3.167 4.932 1.00 6.93 H new ATOM 0 HB3 LEU A 95 16.546 2.098 4.736 1.00 6.93 H new ATOM 0 HG LEU A 95 16.453 2.664 6.975 1.00 7.79 H new ATOM 0 HD11 LEU A 95 17.082 0.671 8.281 1.00 8.88 H new ATOM 0 HD12 LEU A 95 16.317 0.245 6.731 1.00 8.88 H new ATOM 0 HD13 LEU A 95 18.081 0.106 6.921 1.00 8.88 H new ATOM 0 HD21 LEU A 95 18.382 2.736 8.508 1.00 7.89 H new ATOM 0 HD22 LEU A 95 19.458 2.294 7.162 1.00 7.89 H new ATOM 0 HD23 LEU A 95 18.580 3.842 7.128 1.00 7.89 H new ATOM 1447 N LEU A 96 18.045 0.079 2.419 1.00 7.59 N ATOM 1448 CA LEU A 96 18.026 -0.011 0.964 1.00 7.52 C ATOM 1449 C LEU A 96 16.653 0.341 0.415 1.00 6.76 C ATOM 1450 O LEU A 96 15.639 -0.197 0.866 1.00 6.96 O ATOM 1451 CB LEU A 96 18.430 -1.418 0.496 1.00 8.83 C ATOM 1452 CG LEU A 96 19.935 -1.677 0.339 1.00 9.65 C ATOM 1453 CD1 LEU A 96 20.556 -0.667 -0.618 1.00 9.37 C ATOM 1454 CD2 LEU A 96 20.645 -1.658 1.691 1.00 9.78 C ATOM 0 H LEU A 96 17.781 -0.782 2.898 1.00 7.59 H new ATOM 0 HA LEU A 96 18.750 0.707 0.580 1.00 7.52 H new ATOM 0 HB2 LEU A 96 18.030 -2.142 1.206 1.00 8.83 H new ATOM 0 HB3 LEU A 96 17.948 -1.611 -0.462 1.00 8.83 H new ATOM 0 HG LEU A 96 20.062 -2.673 -0.085 1.00 9.65 H new ATOM 0 HD11 LEU A 96 21.623 -0.867 -0.716 1.00 9.37 H new ATOM 0 HD12 LEU A 96 20.080 -0.751 -1.595 1.00 9.37 H new ATOM 0 HD13 LEU A 96 20.410 0.341 -0.229 1.00 9.37 H new ATOM 0 HD21 LEU A 96 21.709 -1.845 1.546 1.00 9.78 H new ATOM 0 HD22 LEU A 96 20.508 -0.684 2.160 1.00 9.78 H new ATOM 0 HD23 LEU A 96 20.225 -2.432 2.333 1.00 9.78 H new ATOM 1466 N VAL A 97 16.645 1.226 -0.574 1.00 6.13 N ATOM 1467 CA VAL A 97 15.417 1.715 -1.193 1.00 5.45 C ATOM 1468 C VAL A 97 15.656 1.965 -2.675 1.00 5.86 C ATOM 1469 O VAL A 97 16.797 2.129 -3.100 1.00 6.40 O ATOM 1470 CB VAL A 97 14.937 3.038 -0.552 1.00 4.23 C ATOM 1471 CG1 VAL A 97 14.590 2.856 0.919 1.00 4.19 C ATOM 1472 CG2 VAL A 97 15.992 4.117 -0.727 1.00 4.01 C ATOM 0 H VAL A 97 17.494 1.627 -0.972 1.00 6.13 H new ATOM 0 HA VAL A 97 14.652 0.953 -1.043 1.00 5.45 H new ATOM 0 HB VAL A 97 14.026 3.348 -1.064 1.00 4.23 H new ATOM 0 HG11 VAL A 97 14.257 3.807 1.335 1.00 4.19 H new ATOM 0 HG12 VAL A 97 13.793 2.119 1.016 1.00 4.19 H new ATOM 0 HG13 VAL A 97 15.471 2.512 1.461 1.00 4.19 H new ATOM 0 HG21 VAL A 97 15.643 5.044 -0.272 1.00 4.01 H new ATOM 0 HG22 VAL A 97 16.918 3.802 -0.245 1.00 4.01 H new ATOM 0 HG23 VAL A 97 16.173 4.280 -1.789 1.00 4.01 H new ATOM 1482 N PRO A 98 14.593 1.982 -3.488 1.00 5.92 N ATOM 1483 CA PRO A 98 14.689 2.394 -4.888 1.00 6.55 C ATOM 1484 C PRO A 98 15.246 3.815 -5.006 1.00 6.22 C ATOM 1485 O PRO A 98 14.836 4.710 -4.270 1.00 5.29 O ATOM 1486 CB PRO A 98 13.238 2.337 -5.384 1.00 6.53 C ATOM 1487 CG PRO A 98 12.539 1.418 -4.445 1.00 6.39 C ATOM 1488 CD PRO A 98 13.226 1.579 -3.118 1.00 5.71 C ATOM 0 HA PRO A 98 15.362 1.761 -5.467 1.00 6.55 H new ATOM 0 HB2 PRO A 98 12.781 3.327 -5.379 1.00 6.53 H new ATOM 0 HB3 PRO A 98 13.186 1.967 -6.408 1.00 6.53 H new ATOM 0 HG2 PRO A 98 11.481 1.669 -4.369 1.00 6.39 H new ATOM 0 HG3 PRO A 98 12.598 0.386 -4.792 1.00 6.39 H new ATOM 0 HD2 PRO A 98 12.738 2.334 -2.502 1.00 5.71 H new ATOM 0 HD3 PRO A 98 13.221 0.650 -2.548 1.00 5.71 H new ATOM 1496 N SER A 99 16.192 4.009 -5.916 1.00 7.21 N ATOM 1497 CA SER A 99 16.834 5.302 -6.111 1.00 7.37 C ATOM 1498 C SER A 99 15.821 6.397 -6.452 1.00 7.21 C ATOM 1499 O SER A 99 16.038 7.567 -6.128 1.00 7.21 O ATOM 1500 CB SER A 99 17.890 5.201 -7.221 1.00 8.73 C ATOM 1501 OG SER A 99 18.669 6.382 -7.303 1.00 9.29 O ATOM 0 H SER A 99 16.535 3.277 -6.538 1.00 7.21 H new ATOM 0 HA SER A 99 17.314 5.577 -5.172 1.00 7.37 H new ATOM 0 HB2 SER A 99 18.540 4.347 -7.030 1.00 8.73 H new ATOM 0 HB3 SER A 99 17.399 5.020 -8.177 1.00 8.73 H new ATOM 0 HG SER A 99 19.216 6.470 -6.495 1.00 9.29 H new ATOM 1507 N GLU A 100 14.709 6.030 -7.073 1.00 7.31 N ATOM 1508 CA GLU A 100 13.689 7.012 -7.431 1.00 7.41 C ATOM 1509 C GLU A 100 12.717 7.260 -6.275 1.00 6.33 C ATOM 1510 O GLU A 100 11.792 8.064 -6.405 1.00 6.56 O ATOM 1511 CB GLU A 100 12.926 6.569 -8.682 1.00 8.22 C ATOM 1512 CG GLU A 100 13.818 6.378 -9.899 1.00 9.47 C ATOM 1513 CD GLU A 100 13.040 6.021 -11.148 1.00 10.34 C ATOM 1514 OE1 GLU A 100 12.447 6.929 -11.769 1.00 10.86 O ATOM 1515 OE2 GLU A 100 13.008 4.828 -11.515 1.00 10.65 O1- ATOM 0 H GLU A 100 14.489 5.070 -7.338 1.00 7.31 H new ATOM 0 HA GLU A 100 14.200 7.951 -7.646 1.00 7.41 H new ATOM 0 HB2 GLU A 100 12.408 5.634 -8.470 1.00 8.22 H new ATOM 0 HB3 GLU A 100 12.162 7.311 -8.914 1.00 8.22 H new ATOM 0 HG2 GLU A 100 14.382 7.294 -10.077 1.00 9.47 H new ATOM 0 HG3 GLU A 100 14.544 5.592 -9.692 1.00 9.47 H new ATOM 1522 N ALA A 101 12.927 6.607 -5.145 1.00 5.34 N ATOM 1523 CA ALA A 101 12.023 6.768 -4.012 1.00 4.45 C ATOM 1524 C ALA A 101 12.267 8.087 -3.290 1.00 4.45 C ATOM 1525 O ALA A 101 11.327 8.791 -2.915 1.00 4.62 O ATOM 1526 CB ALA A 101 12.173 5.609 -3.039 1.00 3.75 C ATOM 0 H ALA A 101 13.705 5.967 -4.985 1.00 5.34 H new ATOM 0 HA ALA A 101 11.005 6.776 -4.402 1.00 4.45 H new ATOM 0 HB1 ALA A 101 11.490 5.747 -2.201 1.00 3.75 H new ATOM 0 HB2 ALA A 101 11.938 4.674 -3.548 1.00 3.75 H new ATOM 0 HB3 ALA A 101 13.198 5.574 -2.670 1.00 3.75 H new ATOM 1532 N LEU A 102 13.535 8.433 -3.133 1.00 4.73 N ATOM 1533 CA LEU A 102 13.915 9.576 -2.323 1.00 5.07 C ATOM 1534 C LEU A 102 13.976 10.861 -3.139 1.00 6.33 C ATOM 1535 O LEU A 102 14.018 10.829 -4.371 1.00 6.97 O ATOM 1536 CB LEU A 102 15.245 9.304 -1.606 1.00 4.90 C ATOM 1537 CG LEU A 102 16.396 8.794 -2.490 1.00 5.36 C ATOM 1538 CD1 LEU A 102 17.052 9.932 -3.254 1.00 6.64 C ATOM 1539 CD2 LEU A 102 17.430 8.069 -1.648 1.00 4.98 C ATOM 0 H LEU A 102 14.319 7.937 -3.557 1.00 4.73 H new ATOM 0 HA LEU A 102 13.140 9.722 -1.570 1.00 5.07 H new ATOM 0 HB2 LEU A 102 15.567 10.225 -1.119 1.00 4.90 H new ATOM 0 HB3 LEU A 102 15.067 8.572 -0.818 1.00 4.90 H new ATOM 0 HG LEU A 102 15.974 8.097 -3.214 1.00 5.36 H new ATOM 0 HD11 LEU A 102 17.861 9.538 -3.869 1.00 6.64 H new ATOM 0 HD12 LEU A 102 16.313 10.415 -3.893 1.00 6.64 H new ATOM 0 HD13 LEU A 102 17.453 10.660 -2.549 1.00 6.64 H new ATOM 0 HD21 LEU A 102 18.237 7.715 -2.289 1.00 4.98 H new ATOM 0 HD22 LEU A 102 17.833 8.751 -0.900 1.00 4.98 H new ATOM 0 HD23 LEU A 102 16.963 7.220 -1.150 1.00 4.98 H new ATOM 1551 N ILE A 103 13.976 11.984 -2.444 1.00 6.87 N ATOM 1552 CA ILE A 103 14.176 13.279 -3.069 1.00 8.18 C ATOM 1553 C ILE A 103 15.486 13.866 -2.604 1.00 8.75 C ATOM 1554 O ILE A 103 15.571 14.362 -1.490 1.00 8.67 O ATOM 1555 CB ILE A 103 13.087 14.304 -2.683 1.00 8.80 C ATOM 1556 CG1 ILE A 103 11.673 13.769 -2.939 1.00 8.52 C ATOM 1557 CG2 ILE A 103 13.327 15.619 -3.415 1.00 10.20 C ATOM 1558 CD1 ILE A 103 11.476 13.164 -4.315 1.00 8.14 C ATOM 0 H ILE A 103 13.838 12.024 -1.434 1.00 6.87 H new ATOM 0 HA ILE A 103 14.148 13.104 -4.145 1.00 8.18 H new ATOM 0 HB ILE A 103 13.158 14.483 -1.610 1.00 8.80 H new ATOM 0 HG12 ILE A 103 11.440 13.015 -2.187 1.00 8.52 H new ATOM 0 HG13 ILE A 103 10.960 14.582 -2.807 1.00 8.52 H new ATOM 0 HG21 ILE A 103 12.555 16.336 -3.137 1.00 10.20 H new ATOM 0 HG22 ILE A 103 14.305 16.015 -3.141 1.00 10.20 H new ATOM 0 HG23 ILE A 103 13.293 15.448 -4.491 1.00 10.20 H new ATOM 0 HD11 ILE A 103 10.450 12.810 -4.413 1.00 8.14 H new ATOM 0 HD12 ILE A 103 11.674 13.919 -5.076 1.00 8.14 H new ATOM 0 HD13 ILE A 103 12.162 12.327 -4.446 1.00 8.14 H new ATOM 1570 N ARG A 104 16.510 13.837 -3.411 1.00 9.50 N ATOM 1571 CA ARG A 104 17.706 14.525 -3.007 1.00 10.25 C ATOM 1572 C ARG A 104 17.842 15.842 -3.723 1.00 11.48 C ATOM 1573 O ARG A 104 17.672 15.947 -4.938 1.00 12.12 O ATOM 1574 CB ARG A 104 18.944 13.687 -3.117 1.00 10.50 C ATOM 1575 CG ARG A 104 19.146 13.053 -4.442 1.00 9.82 C ATOM 1576 CD ARG A 104 20.570 12.601 -4.504 1.00 9.98 C ATOM 1577 NE ARG A 104 20.918 11.975 -5.781 1.00 10.43 N ATOM 1578 CZ ARG A 104 21.859 11.041 -5.926 1.00 10.83 C ATOM 1579 NH1 ARG A 104 22.507 10.570 -4.868 1.00 10.83 N1+ ATOM 1580 NH2 ARG A 104 22.134 10.559 -7.130 1.00 11.42 N ATOM 0 H ARG A 104 16.545 13.366 -4.315 1.00 9.50 H new ATOM 0 HA ARG A 104 17.598 14.734 -1.943 1.00 10.25 H new ATOM 0 HB2 ARG A 104 19.810 14.310 -2.892 1.00 10.50 H new ATOM 0 HB3 ARG A 104 18.907 12.906 -2.357 1.00 10.50 H new ATOM 0 HG2 ARG A 104 18.469 12.209 -4.572 1.00 9.82 H new ATOM 0 HG3 ARG A 104 18.932 13.760 -5.243 1.00 9.82 H new ATOM 0 HD2 ARG A 104 21.224 13.456 -4.335 1.00 9.98 H new ATOM 0 HD3 ARG A 104 20.756 11.893 -3.696 1.00 9.98 H new ATOM 0 HE ARG A 104 20.408 12.272 -6.613 1.00 10.43 H new ATOM 0 HH11 ARG A 104 22.287 10.922 -3.936 1.00 10.83 H new ATOM 0 HH12 ARG A 104 23.225 9.856 -4.986 1.00 10.83 H new ATOM 0 HH21 ARG A 104 21.626 10.902 -7.945 1.00 11.42 H new ATOM 0 HH22 ARG A 104 22.854 9.845 -7.241 1.00 11.42 H new ATOM 1594 N THR A 105 18.128 16.842 -2.934 1.00 11.91 N ATOM 1595 CA THR A 105 18.112 18.210 -3.383 1.00 13.15 C ATOM 1596 C THR A 105 19.124 19.018 -2.583 1.00 13.72 C ATOM 1597 O THR A 105 19.183 18.902 -1.355 1.00 13.20 O ATOM 1598 CB THR A 105 16.697 18.832 -3.249 1.00 13.31 C ATOM 1599 OG1 THR A 105 16.747 20.250 -3.450 1.00 14.61 O ATOM 1600 CG2 THR A 105 16.083 18.526 -1.888 1.00 12.61 C ATOM 0 H THR A 105 18.381 16.730 -1.952 1.00 11.91 H new ATOM 0 HA THR A 105 18.382 18.231 -4.439 1.00 13.15 H new ATOM 0 HB THR A 105 16.069 18.384 -4.019 1.00 13.31 H new ATOM 0 HG1 THR A 105 15.846 20.625 -3.363 1.00 14.61 H new ATOM 0 HG21 THR A 105 15.092 18.976 -1.826 1.00 12.61 H new ATOM 0 HG22 THR A 105 16.000 17.447 -1.761 1.00 12.61 H new ATOM 0 HG23 THR A 105 16.717 18.936 -1.102 1.00 12.61 H new ATOM 1608 N GLY A 106 19.935 19.803 -3.273 1.00 14.84 N ATOM 1609 CA GLY A 106 20.931 20.607 -2.597 1.00 15.52 C ATOM 1610 C GLY A 106 21.935 19.762 -1.839 1.00 14.91 C ATOM 1611 O GLY A 106 22.757 19.071 -2.443 1.00 14.86 O ATOM 0 H GLY A 106 19.922 19.898 -4.288 1.00 14.84 H new ATOM 0 HA2 GLY A 106 21.456 21.222 -3.328 1.00 15.52 H new ATOM 0 HA3 GLY A 106 20.436 21.288 -1.904 1.00 15.52 H new ATOM 1615 N ALA A 107 21.854 19.791 -0.516 1.00 14.57 N ATOM 1616 CA ALA A 107 22.810 19.083 0.318 1.00 14.09 C ATOM 1617 C ALA A 107 22.143 18.048 1.214 1.00 12.88 C ATOM 1618 O ALA A 107 22.645 17.747 2.298 1.00 12.64 O ATOM 1619 CB ALA A 107 23.603 20.074 1.155 1.00 14.99 C ATOM 0 H ALA A 107 21.135 20.298 0.001 1.00 14.57 H new ATOM 0 HA ALA A 107 23.485 18.543 -0.346 1.00 14.09 H new ATOM 0 HB1 ALA A 107 24.317 19.535 1.777 1.00 14.99 H new ATOM 0 HB2 ALA A 107 24.139 20.759 0.498 1.00 14.99 H new ATOM 0 HB3 ALA A 107 22.922 20.640 1.791 1.00 14.99 H new ATOM 1625 N ARG A 108 21.021 17.495 0.769 1.00 12.19 N ATOM 1626 CA ARG A 108 20.291 16.530 1.581 1.00 11.09 C ATOM 1627 C ARG A 108 19.267 15.752 0.765 1.00 10.26 C ATOM 1628 O ARG A 108 19.099 15.989 -0.431 1.00 10.63 O ATOM 1629 CB ARG A 108 19.616 17.241 2.760 1.00 11.48 C ATOM 1630 CG ARG A 108 18.989 18.570 2.376 1.00 12.49 C ATOM 1631 CD ARG A 108 17.594 18.404 1.792 1.00 12.62 C ATOM 1632 NE ARG A 108 17.118 19.630 1.154 1.00 13.67 N ATOM 1633 CZ ARG A 108 15.954 20.224 1.431 1.00 14.22 C ATOM 1634 NH1 ARG A 108 15.184 19.778 2.416 1.00 13.92 N1+ ATOM 1635 NH2 ARG A 108 15.577 21.288 0.732 1.00 15.20 N ATOM 0 H ARG A 108 20.601 17.695 -0.139 1.00 12.19 H new ATOM 0 HA ARG A 108 21.011 15.806 1.963 1.00 11.09 H new ATOM 0 HB2 ARG A 108 18.847 16.590 3.177 1.00 11.48 H new ATOM 0 HB3 ARG A 108 20.353 17.407 3.546 1.00 11.48 H new ATOM 0 HG2 ARG A 108 18.938 19.212 3.255 1.00 12.49 H new ATOM 0 HG3 ARG A 108 19.627 19.074 1.650 1.00 12.49 H new ATOM 0 HD2 ARG A 108 17.601 17.594 1.062 1.00 12.62 H new ATOM 0 HD3 ARG A 108 16.902 18.115 2.583 1.00 12.62 H new ATOM 0 HE ARG A 108 17.716 20.062 0.449 1.00 13.67 H new ATOM 0 HH11 ARG A 108 15.479 18.974 2.970 1.00 13.92 H new ATOM 0 HH12 ARG A 108 14.297 20.239 2.619 1.00 13.92 H new ATOM 0 HH21 ARG A 108 16.175 21.648 -0.012 1.00 15.20 H new ATOM 0 HH22 ARG A 108 14.689 21.746 0.939 1.00 15.20 H new ATOM 1649 N THR A 109 18.579 14.838 1.430 1.00 9.26 N ATOM 1650 CA THR A 109 17.579 13.999 0.787 1.00 8.38 C ATOM 1651 C THR A 109 16.304 13.963 1.627 1.00 8.15 C ATOM 1652 O THR A 109 16.347 14.154 2.840 1.00 8.42 O ATOM 1653 CB THR A 109 18.113 12.564 0.588 1.00 7.38 C ATOM 1654 OG1 THR A 109 19.449 12.612 0.069 1.00 7.95 O ATOM 1655 CG2 THR A 109 17.241 11.780 -0.378 1.00 6.64 C ATOM 0 H THR A 109 18.697 14.657 2.427 1.00 9.26 H new ATOM 0 HA THR A 109 17.354 14.425 -0.191 1.00 8.38 H new ATOM 0 HB THR A 109 18.100 12.066 1.557 1.00 7.38 H new ATOM 0 HG1 THR A 109 20.088 12.469 0.798 1.00 7.95 H new ATOM 0 HG21 THR A 109 17.643 10.774 -0.497 1.00 6.64 H new ATOM 0 HG22 THR A 109 16.226 11.721 0.014 1.00 6.64 H new ATOM 0 HG23 THR A 109 17.227 12.282 -1.345 1.00 6.64 H new ATOM 1663 N ILE A 110 15.176 13.752 0.969 1.00 7.89 N ATOM 1664 CA ILE A 110 13.882 13.696 1.627 1.00 7.87 C ATOM 1665 C ILE A 110 13.144 12.425 1.209 1.00 6.75 C ATOM 1666 O ILE A 110 13.373 11.905 0.119 1.00 6.24 O ATOM 1667 CB ILE A 110 13.012 14.921 1.259 1.00 9.02 C ATOM 1668 CG1 ILE A 110 13.766 16.238 1.474 1.00 10.20 C ATOM 1669 CG2 ILE A 110 11.725 14.920 2.061 1.00 9.31 C ATOM 1670 CD1 ILE A 110 14.162 16.498 2.910 1.00 10.55 C ATOM 0 H ILE A 110 15.132 13.614 -0.041 1.00 7.89 H new ATOM 0 HA ILE A 110 14.055 13.698 2.703 1.00 7.87 H new ATOM 0 HB ILE A 110 12.772 14.843 0.199 1.00 9.02 H new ATOM 0 HG12 ILE A 110 14.664 16.235 0.856 1.00 10.20 H new ATOM 0 HG13 ILE A 110 13.143 17.062 1.126 1.00 10.20 H new ATOM 0 HG21 ILE A 110 11.126 15.789 1.789 1.00 9.31 H new ATOM 0 HG22 ILE A 110 11.164 14.011 1.847 1.00 9.31 H new ATOM 0 HG23 ILE A 110 11.959 14.960 3.125 1.00 9.31 H new ATOM 0 HD11 ILE A 110 14.691 17.449 2.975 1.00 10.55 H new ATOM 0 HD12 ILE A 110 13.268 16.536 3.533 1.00 10.55 H new ATOM 0 HD13 ILE A 110 14.813 15.696 3.259 1.00 10.55 H new ATOM 1682 N ALA A 111 12.280 11.917 2.073 1.00 6.58 N ATOM 1683 CA ALA A 111 11.466 10.752 1.749 1.00 5.74 C ATOM 1684 C ALA A 111 10.032 10.952 2.218 1.00 6.51 C ATOM 1685 O ALA A 111 9.802 11.336 3.361 1.00 7.39 O ATOM 1686 CB ALA A 111 12.050 9.500 2.383 1.00 5.00 C ATOM 0 H ALA A 111 12.123 12.293 3.008 1.00 6.58 H new ATOM 0 HA ALA A 111 11.466 10.630 0.666 1.00 5.74 H new ATOM 0 HB1 ALA A 111 11.429 8.641 2.130 1.00 5.00 H new ATOM 0 HB2 ALA A 111 13.061 9.340 2.008 1.00 5.00 H new ATOM 0 HB3 ALA A 111 12.079 9.620 3.466 1.00 5.00 H new ATOM 1692 N MET A 112 9.074 10.711 1.335 1.00 6.37 N ATOM 1693 CA MET A 112 7.665 10.782 1.709 1.00 7.19 C ATOM 1694 C MET A 112 7.205 9.418 2.209 1.00 6.90 C ATOM 1695 O MET A 112 6.958 8.503 1.418 1.00 6.29 O ATOM 1696 CB MET A 112 6.793 11.218 0.531 1.00 7.48 C ATOM 1697 CG MET A 112 7.123 12.598 -0.010 1.00 8.19 C ATOM 1698 SD MET A 112 5.755 13.321 -0.945 1.00 8.85 S ATOM 1699 CE MET A 112 5.311 11.959 -2.023 1.00 8.24 C ATOM 0 H MET A 112 9.243 10.466 0.359 1.00 6.37 H new ATOM 0 HA MET A 112 7.560 11.526 2.498 1.00 7.19 H new ATOM 0 HB2 MET A 112 6.898 10.490 -0.273 1.00 7.48 H new ATOM 0 HB3 MET A 112 5.748 11.202 0.841 1.00 7.48 H new ATOM 0 HG2 MET A 112 7.381 13.257 0.819 1.00 8.19 H new ATOM 0 HG3 MET A 112 8.002 12.533 -0.651 1.00 8.19 H new ATOM 0 HE1 MET A 112 4.515 12.273 -2.697 1.00 8.24 H new ATOM 0 HE2 MET A 112 6.182 11.657 -2.605 1.00 8.24 H new ATOM 0 HE3 MET A 112 4.967 11.117 -1.422 1.00 8.24 H new ATOM 1709 N VAL A 113 7.119 9.290 3.523 1.00 7.60 N ATOM 1710 CA VAL A 113 6.816 8.026 4.160 1.00 7.75 C ATOM 1711 C VAL A 113 5.308 7.811 4.281 1.00 8.59 C ATOM 1712 O VAL A 113 4.558 8.741 4.578 1.00 9.48 O ATOM 1713 CB VAL A 113 7.467 7.954 5.563 1.00 8.42 C ATOM 1714 CG1 VAL A 113 6.772 8.873 6.555 1.00 9.69 C ATOM 1715 CG2 VAL A 113 7.494 6.525 6.072 1.00 8.72 C ATOM 0 H VAL A 113 7.258 10.062 4.175 1.00 7.60 H new ATOM 0 HA VAL A 113 7.227 7.236 3.532 1.00 7.75 H new ATOM 0 HB VAL A 113 8.495 8.302 5.465 1.00 8.42 H new ATOM 0 HG11 VAL A 113 7.258 8.793 7.527 1.00 9.69 H new ATOM 0 HG12 VAL A 113 6.833 9.902 6.202 1.00 9.69 H new ATOM 0 HG13 VAL A 113 5.725 8.583 6.648 1.00 9.69 H new ATOM 0 HG21 VAL A 113 7.956 6.499 7.059 1.00 8.72 H new ATOM 0 HG22 VAL A 113 6.475 6.143 6.138 1.00 8.72 H new ATOM 0 HG23 VAL A 113 8.070 5.905 5.385 1.00 8.72 H new ATOM 1725 N ALA A 114 4.879 6.583 4.028 1.00 8.43 N ATOM 1726 CA ALA A 114 3.494 6.191 4.211 1.00 9.31 C ATOM 1727 C ALA A 114 3.197 6.040 5.696 1.00 10.44 C ATOM 1728 O ALA A 114 3.304 4.947 6.254 1.00 10.70 O ATOM 1729 CB ALA A 114 3.211 4.888 3.470 1.00 8.96 C ATOM 0 H ALA A 114 5.482 5.833 3.691 1.00 8.43 H new ATOM 0 HA ALA A 114 2.845 6.964 3.799 1.00 9.31 H new ATOM 0 HB1 ALA A 114 2.168 4.606 3.616 1.00 8.96 H new ATOM 0 HB2 ALA A 114 3.404 5.025 2.406 1.00 8.96 H new ATOM 0 HB3 ALA A 114 3.858 4.101 3.858 1.00 8.96 H new ATOM 1735 N LYS A 115 2.848 7.142 6.337 1.00 11.26 N ATOM 1736 CA LYS A 115 2.609 7.145 7.767 1.00 12.43 C ATOM 1737 C LYS A 115 1.313 6.412 8.083 1.00 13.26 C ATOM 1738 O LYS A 115 0.351 6.476 7.316 1.00 13.19 O ATOM 1739 CB LYS A 115 2.545 8.579 8.300 1.00 13.13 C ATOM 1740 CG LYS A 115 2.641 8.664 9.817 1.00 13.19 C ATOM 1741 CD LYS A 115 2.604 10.100 10.307 1.00 14.08 C ATOM 1742 CE LYS A 115 2.904 10.184 11.797 1.00 14.36 C ATOM 1743 NZ LYS A 115 4.313 9.820 12.111 1.00 14.88 N1+ ATOM 0 H LYS A 115 2.724 8.049 5.886 1.00 11.26 H new ATOM 0 HA LYS A 115 3.436 6.631 8.256 1.00 12.43 H new ATOM 0 HB2 LYS A 115 3.355 9.159 7.859 1.00 13.13 H new ATOM 0 HB3 LYS A 115 1.611 9.038 7.976 1.00 13.13 H new ATOM 0 HG2 LYS A 115 1.818 8.106 10.265 1.00 13.19 H new ATOM 0 HG3 LYS A 115 3.565 8.191 10.149 1.00 13.19 H new ATOM 0 HD2 LYS A 115 3.331 10.694 9.753 1.00 14.08 H new ATOM 0 HD3 LYS A 115 1.622 10.530 10.107 1.00 14.08 H new ATOM 0 HE2 LYS A 115 2.706 11.196 12.149 1.00 14.36 H new ATOM 0 HE3 LYS A 115 2.230 9.520 12.339 1.00 14.36 H new ATOM 0 HZ1 LYS A 115 4.550 10.144 13.070 1.00 14.88 H new ATOM 0 HZ2 LYS A 115 4.425 8.787 12.057 1.00 14.88 H new ATOM 0 HZ3 LYS A 115 4.950 10.274 11.425 1.00 14.88 H new ATOM 1757 N GLY A 116 1.291 5.733 9.223 1.00 14.15 N ATOM 1758 CA GLY A 116 0.136 4.948 9.612 1.00 15.10 C ATOM 1759 C GLY A 116 -1.098 5.790 9.870 1.00 16.02 C ATOM 1760 O GLY A 116 -2.188 5.256 10.062 1.00 16.92 O ATOM 0 H GLY A 116 2.061 5.713 9.891 1.00 14.15 H new ATOM 0 HA2 GLY A 116 -0.084 4.223 8.828 1.00 15.10 H new ATOM 0 HA3 GLY A 116 0.376 4.381 10.512 1.00 15.10 H new ATOM 1764 N GLU A 117 -0.935 7.109 9.869 1.00 15.88 N ATOM 1765 CA GLU A 117 -2.059 8.013 10.064 1.00 16.82 C ATOM 1766 C GLU A 117 -2.729 8.346 8.734 1.00 16.56 C ATOM 1767 O GLU A 117 -3.568 9.240 8.649 1.00 17.25 O ATOM 1768 CB GLU A 117 -1.618 9.297 10.763 1.00 17.04 C ATOM 1769 CG GLU A 117 -1.041 9.051 12.141 1.00 17.42 C ATOM 1770 CD GLU A 117 -0.914 10.319 12.957 1.00 17.95 C ATOM 1771 OE1 GLU A 117 -1.875 10.667 13.672 1.00 18.56 O ATOM 1772 OE2 GLU A 117 0.148 10.969 12.902 1.00 17.82 O1- ATOM 0 H GLU A 117 -0.037 7.573 9.735 1.00 15.88 H new ATOM 0 HA GLU A 117 -2.782 7.504 10.701 1.00 16.82 H new ATOM 0 HB2 GLU A 117 -0.873 9.802 10.148 1.00 17.04 H new ATOM 0 HB3 GLU A 117 -2.471 9.970 10.847 1.00 17.04 H new ATOM 0 HG2 GLU A 117 -1.675 8.343 12.674 1.00 17.42 H new ATOM 0 HG3 GLU A 117 -0.059 8.588 12.042 1.00 17.42 H new ATOM 1779 N GLY A 118 -2.344 7.607 7.699 1.00 15.62 N ATOM 1780 CA GLY A 118 -2.997 7.716 6.411 1.00 15.41 C ATOM 1781 C GLY A 118 -2.443 8.829 5.553 1.00 14.71 C ATOM 1782 O GLY A 118 -3.054 9.203 4.552 1.00 14.71 O ATOM 0 H GLY A 118 -1.583 6.928 7.732 1.00 15.62 H new ATOM 0 HA2 GLY A 118 -2.895 6.771 5.878 1.00 15.41 H new ATOM 0 HA3 GLY A 118 -4.063 7.881 6.565 1.00 15.41 H new ATOM 1786 N GLY A 119 -1.286 9.350 5.929 1.00 14.19 N ATOM 1787 CA GLY A 119 -0.707 10.452 5.206 1.00 13.68 C ATOM 1788 C GLY A 119 0.727 10.177 4.836 1.00 12.53 C ATOM 1789 O GLY A 119 1.331 9.231 5.341 1.00 12.20 O ATOM 0 H GLY A 119 -0.739 9.025 6.726 1.00 14.19 H new ATOM 0 HA2 GLY A 119 -1.287 10.641 4.303 1.00 13.68 H new ATOM 0 HA3 GLY A 119 -0.760 11.355 5.814 1.00 13.68 H new ATOM 1793 N PHE A 120 1.275 10.993 3.963 1.00 12.03 N ATOM 1794 CA PHE A 120 2.637 10.811 3.503 1.00 10.94 C ATOM 1795 C PHE A 120 3.506 11.950 3.991 1.00 11.32 C ATOM 1796 O PHE A 120 3.397 13.080 3.511 1.00 11.97 O ATOM 1797 CB PHE A 120 2.665 10.728 1.980 1.00 10.11 C ATOM 1798 CG PHE A 120 1.927 9.539 1.445 1.00 9.82 C ATOM 1799 CD1 PHE A 120 2.550 8.307 1.342 1.00 9.56 C ATOM 1800 CD2 PHE A 120 0.612 9.659 1.036 1.00 9.99 C ATOM 1801 CE1 PHE A 120 1.872 7.214 0.839 1.00 9.49 C ATOM 1802 CE2 PHE A 120 -0.070 8.572 0.531 1.00 9.89 C ATOM 1803 CZ PHE A 120 0.558 7.327 0.481 1.00 9.66 C ATOM 0 H PHE A 120 0.796 11.795 3.554 1.00 12.03 H new ATOM 0 HA PHE A 120 3.030 9.879 3.909 1.00 10.94 H new ATOM 0 HB2 PHE A 120 2.229 11.636 1.564 1.00 10.11 H new ATOM 0 HB3 PHE A 120 3.701 10.688 1.643 1.00 10.11 H new ATOM 0 HD1 PHE A 120 3.577 8.199 1.658 1.00 9.56 H new ATOM 0 HD2 PHE A 120 0.114 10.614 1.113 1.00 9.99 H new ATOM 0 HE1 PHE A 120 2.381 6.268 0.728 1.00 9.49 H new ATOM 0 HE2 PHE A 120 -1.084 8.684 0.176 1.00 9.89 H new ATOM 0 HZ PHE A 120 0.007 6.455 0.160 1.00 9.66 H new ATOM 1813 N ASP A 121 4.370 11.653 4.943 1.00 11.05 N ATOM 1814 CA ASP A 121 5.153 12.689 5.583 1.00 11.56 C ATOM 1815 C ASP A 121 6.567 12.713 5.026 1.00 10.58 C ATOM 1816 O ASP A 121 7.149 11.661 4.773 1.00 9.55 O ATOM 1817 CB ASP A 121 5.194 12.484 7.092 1.00 12.35 C ATOM 1818 CG ASP A 121 5.596 13.727 7.858 1.00 13.39 C ATOM 1819 OD1 ASP A 121 4.857 14.731 7.813 1.00 13.91 O1- ATOM 1820 OD2 ASP A 121 6.658 13.698 8.513 1.00 13.79 O ATOM 0 H ASP A 121 4.546 10.709 5.287 1.00 11.05 H new ATOM 0 HA ASP A 121 4.675 13.646 5.374 1.00 11.56 H new ATOM 0 HB2 ASP A 121 4.212 12.158 7.434 1.00 12.35 H new ATOM 0 HB3 ASP A 121 5.895 11.682 7.323 1.00 12.35 H new ATOM 1825 N PRO A 122 7.147 13.893 4.836 1.00 10.99 N ATOM 1826 CA PRO A 122 8.506 14.023 4.350 1.00 10.31 C ATOM 1827 C PRO A 122 9.524 13.960 5.482 1.00 10.40 C ATOM 1828 O PRO A 122 9.438 14.688 6.473 1.00 11.44 O ATOM 1829 CB PRO A 122 8.511 15.401 3.681 1.00 11.13 C ATOM 1830 CG PRO A 122 7.244 16.089 4.096 1.00 12.35 C ATOM 1831 CD PRO A 122 6.541 15.193 5.082 1.00 12.29 C ATOM 0 HA PRO A 122 8.786 13.214 3.675 1.00 10.31 H new ATOM 0 HB2 PRO A 122 9.383 15.978 3.990 1.00 11.13 H new ATOM 0 HB3 PRO A 122 8.561 15.304 2.596 1.00 11.13 H new ATOM 0 HG2 PRO A 122 7.464 17.057 4.547 1.00 12.35 H new ATOM 0 HG3 PRO A 122 6.609 16.278 3.230 1.00 12.35 H new ATOM 0 HD2 PRO A 122 6.697 15.523 6.109 1.00 12.29 H new ATOM 0 HD3 PRO A 122 5.464 15.174 4.913 1.00 12.29 H new ATOM 1839 N VAL A 123 10.459 13.043 5.350 1.00 9.36 N ATOM 1840 CA VAL A 123 11.539 12.905 6.302 1.00 9.43 C ATOM 1841 C VAL A 123 12.833 13.406 5.672 1.00 9.05 C ATOM 1842 O VAL A 123 13.133 13.082 4.522 1.00 8.18 O ATOM 1843 CB VAL A 123 11.709 11.429 6.751 1.00 8.79 C ATOM 1844 CG1 VAL A 123 12.217 10.568 5.619 1.00 7.90 C ATOM 1845 CG2 VAL A 123 12.616 11.330 7.968 1.00 9.39 C ATOM 0 H VAL A 123 10.491 12.374 4.581 1.00 9.36 H new ATOM 0 HA VAL A 123 11.300 13.499 7.184 1.00 9.43 H new ATOM 0 HB VAL A 123 10.727 11.052 7.036 1.00 8.79 H new ATOM 0 HG11 VAL A 123 12.326 9.540 5.964 1.00 7.90 H new ATOM 0 HG12 VAL A 123 11.508 10.600 4.791 1.00 7.90 H new ATOM 0 HG13 VAL A 123 13.184 10.942 5.283 1.00 7.90 H new ATOM 0 HG21 VAL A 123 12.718 10.285 8.262 1.00 9.39 H new ATOM 0 HG22 VAL A 123 13.598 11.736 7.724 1.00 9.39 H new ATOM 0 HG23 VAL A 123 12.183 11.898 8.792 1.00 9.39 H new ATOM 1855 N GLU A 124 13.565 14.240 6.388 1.00 9.85 N ATOM 1856 CA GLU A 124 14.888 14.624 5.939 1.00 9.72 C ATOM 1857 C GLU A 124 15.860 13.496 6.244 1.00 8.90 C ATOM 1858 O GLU A 124 16.188 13.226 7.400 1.00 9.21 O ATOM 1859 CB GLU A 124 15.349 15.933 6.576 1.00 10.96 C ATOM 1860 CG GLU A 124 16.674 16.426 6.018 1.00 11.07 C ATOM 1861 CD GLU A 124 16.980 17.851 6.412 1.00 12.34 C ATOM 1862 OE1 GLU A 124 16.534 18.773 5.701 1.00 12.83 O ATOM 1863 OE2 GLU A 124 17.676 18.061 7.427 1.00 12.93 O1- ATOM 0 H GLU A 124 13.270 14.659 7.270 1.00 9.85 H new ATOM 0 HA GLU A 124 14.855 14.798 4.863 1.00 9.72 H new ATOM 0 HB2 GLU A 124 14.587 16.696 6.418 1.00 10.96 H new ATOM 0 HB3 GLU A 124 15.443 15.794 7.653 1.00 10.96 H new ATOM 0 HG2 GLU A 124 17.476 15.776 6.370 1.00 11.07 H new ATOM 0 HG3 GLU A 124 16.656 16.350 4.931 1.00 11.07 H new ATOM 1870 N VAL A 125 16.310 12.846 5.194 1.00 8.03 N ATOM 1871 CA VAL A 125 17.093 11.631 5.311 1.00 7.30 C ATOM 1872 C VAL A 125 18.495 11.817 4.754 1.00 7.38 C ATOM 1873 O VAL A 125 18.745 12.697 3.928 1.00 7.84 O ATOM 1874 CB VAL A 125 16.371 10.453 4.594 1.00 6.19 C ATOM 1875 CG1 VAL A 125 15.369 10.966 3.586 1.00 6.15 C ATOM 1876 CG2 VAL A 125 17.322 9.524 3.888 1.00 5.62 C ATOM 0 H VAL A 125 16.144 13.143 4.232 1.00 8.03 H new ATOM 0 HA VAL A 125 17.188 11.394 6.371 1.00 7.30 H new ATOM 0 HB VAL A 125 15.866 9.894 5.382 1.00 6.19 H new ATOM 0 HG11 VAL A 125 14.879 10.123 3.099 1.00 6.15 H new ATOM 0 HG12 VAL A 125 14.622 11.577 4.094 1.00 6.15 H new ATOM 0 HG13 VAL A 125 15.882 11.569 2.837 1.00 6.15 H new ATOM 0 HG21 VAL A 125 16.759 8.724 3.408 1.00 5.62 H new ATOM 0 HG22 VAL A 125 17.880 10.079 3.134 1.00 5.62 H new ATOM 0 HG23 VAL A 125 18.016 9.096 4.611 1.00 5.62 H new ATOM 1886 N LYS A 126 19.404 10.996 5.242 1.00 7.21 N ATOM 1887 CA LYS A 126 20.738 10.935 4.715 1.00 7.44 C ATOM 1888 C LYS A 126 20.801 9.846 3.669 1.00 6.77 C ATOM 1889 O LYS A 126 20.546 8.683 3.958 1.00 6.29 O ATOM 1890 CB LYS A 126 21.757 10.644 5.799 1.00 8.03 C ATOM 1891 CG LYS A 126 23.177 10.658 5.269 1.00 8.46 C ATOM 1892 CD LYS A 126 24.174 10.048 6.238 1.00 9.06 C ATOM 1893 CE LYS A 126 24.579 11.001 7.365 1.00 9.72 C ATOM 1894 NZ LYS A 126 23.426 11.538 8.143 1.00 10.39 N1+ ATOM 0 H LYS A 126 19.231 10.355 6.016 1.00 7.21 H new ATOM 0 HA LYS A 126 20.978 11.905 4.280 1.00 7.44 H new ATOM 0 HB2 LYS A 126 21.660 11.384 6.594 1.00 8.03 H new ATOM 0 HB3 LYS A 126 21.546 9.671 6.242 1.00 8.03 H new ATOM 0 HG2 LYS A 126 23.213 10.112 4.326 1.00 8.46 H new ATOM 0 HG3 LYS A 126 23.469 11.686 5.054 1.00 8.46 H new ATOM 0 HD2 LYS A 126 23.744 9.145 6.671 1.00 9.06 H new ATOM 0 HD3 LYS A 126 25.066 9.745 5.689 1.00 9.06 H new ATOM 0 HE2 LYS A 126 25.252 10.479 8.045 1.00 9.72 H new ATOM 0 HE3 LYS A 126 25.138 11.835 6.940 1.00 9.72 H new ATOM 0 HZ1 LYS A 126 23.773 11.976 9.020 1.00 10.39 H new ATOM 0 HZ2 LYS A 126 22.926 12.251 7.575 1.00 10.39 H new ATOM 0 HZ3 LYS A 126 22.774 10.762 8.378 1.00 10.39 H new ATOM 1908 N ALA A 127 21.141 10.224 2.466 1.00 7.04 N ATOM 1909 CA ALA A 127 21.144 9.295 1.357 1.00 6.78 C ATOM 1910 C ALA A 127 22.302 9.567 0.426 1.00 7.69 C ATOM 1911 O ALA A 127 22.297 10.569 -0.288 1.00 8.30 O ATOM 1912 CB ALA A 127 19.833 9.385 0.600 1.00 6.34 C ATOM 0 H ALA A 127 21.422 11.174 2.223 1.00 7.04 H new ATOM 0 HA ALA A 127 21.258 8.287 1.756 1.00 6.78 H new ATOM 0 HB1 ALA A 127 19.845 8.682 -0.233 1.00 6.34 H new ATOM 0 HB2 ALA A 127 19.009 9.140 1.270 1.00 6.34 H new ATOM 0 HB3 ALA A 127 19.702 10.398 0.218 1.00 6.34 H new ATOM 1918 N GLY A 128 23.311 8.720 0.439 1.00 8.00 N ATOM 1919 CA GLY A 128 24.306 8.840 -0.598 1.00 8.94 C ATOM 1920 C GLY A 128 25.013 7.550 -0.929 1.00 9.46 C ATOM 1921 O GLY A 128 26.188 7.378 -0.607 1.00 10.10 O ATOM 0 H GLY A 128 23.459 7.977 1.121 1.00 8.00 H new ATOM 0 HA2 GLY A 128 23.829 9.222 -1.501 1.00 8.94 H new ATOM 0 HA3 GLY A 128 25.047 9.579 -0.292 1.00 8.94 H new ATOM 1925 N ALA A 129 24.296 6.636 -1.555 1.00 9.37 N ATOM 1926 CA ALA A 129 24.888 5.613 -2.386 1.00 10.27 C ATOM 1927 C ALA A 129 23.905 5.227 -3.478 1.00 10.12 C ATOM 1928 O ALA A 129 22.712 5.517 -3.363 1.00 9.18 O ATOM 1929 CB ALA A 129 25.328 4.418 -1.582 1.00 10.61 C ATOM 0 H ALA A 129 23.279 6.585 -1.499 1.00 9.37 H new ATOM 0 HA ALA A 129 25.791 6.014 -2.847 1.00 10.27 H new ATOM 0 HB1 ALA A 129 25.767 3.674 -2.247 1.00 10.61 H new ATOM 0 HB2 ALA A 129 26.069 4.728 -0.845 1.00 10.61 H new ATOM 0 HB3 ALA A 129 24.467 3.986 -1.072 1.00 10.61 H new ATOM 1935 N THR A 130 24.377 4.579 -4.519 1.00 11.12 N ATOM 1936 CA THR A 130 23.486 4.004 -5.511 1.00 11.19 C ATOM 1937 C THR A 130 24.031 2.666 -5.976 1.00 12.15 C ATOM 1938 O THR A 130 25.170 2.567 -6.443 1.00 13.17 O ATOM 1939 CB THR A 130 23.301 4.936 -6.713 1.00 11.72 C ATOM 1940 OG1 THR A 130 22.998 6.262 -6.258 1.00 11.18 O ATOM 1941 CG2 THR A 130 22.189 4.445 -7.631 1.00 11.68 C ATOM 0 H THR A 130 25.370 4.435 -4.704 1.00 11.12 H new ATOM 0 HA THR A 130 22.511 3.864 -5.044 1.00 11.19 H new ATOM 0 HB THR A 130 24.232 4.943 -7.279 1.00 11.72 H new ATOM 0 HG1 THR A 130 22.882 6.854 -7.030 1.00 11.18 H new ATOM 0 HG21 THR A 130 22.084 5.129 -8.473 1.00 11.68 H new ATOM 0 HG22 THR A 130 22.435 3.449 -8.000 1.00 11.68 H new ATOM 0 HG23 THR A 130 21.251 4.405 -7.077 1.00 11.68 H new ATOM 1949 N ALA A 131 23.218 1.640 -5.838 1.00 11.92 N ATOM 1950 CA ALA A 131 23.651 0.289 -6.125 1.00 12.91 C ATOM 1951 C ALA A 131 22.497 -0.561 -6.632 1.00 12.98 C ATOM 1952 O ALA A 131 21.445 -0.629 -5.997 1.00 12.19 O ATOM 1953 CB ALA A 131 24.261 -0.339 -4.881 1.00 12.87 C ATOM 0 H ALA A 131 22.249 1.717 -5.527 1.00 11.92 H new ATOM 0 HA ALA A 131 24.406 0.333 -6.910 1.00 12.91 H new ATOM 0 HB1 ALA A 131 24.584 -1.355 -5.107 1.00 12.87 H new ATOM 0 HB2 ALA A 131 25.119 0.251 -4.559 1.00 12.87 H new ATOM 0 HB3 ALA A 131 23.518 -0.363 -4.084 1.00 12.87 H new ATOM 1959 N GLY A 132 22.695 -1.185 -7.785 1.00 14.01 N ATOM 1960 CA GLY A 132 21.690 -2.069 -8.346 1.00 14.34 C ATOM 1961 C GLY A 132 20.419 -1.338 -8.721 1.00 13.47 C ATOM 1962 O GLY A 132 19.327 -1.897 -8.640 1.00 13.23 O ATOM 0 H GLY A 132 23.541 -1.094 -8.347 1.00 14.01 H new ATOM 0 HA2 GLY A 132 22.096 -2.561 -9.230 1.00 14.34 H new ATOM 0 HA3 GLY A 132 21.456 -2.852 -7.624 1.00 14.34 H new ATOM 1966 N GLY A 133 20.561 -0.083 -9.127 1.00 13.12 N ATOM 1967 CA GLY A 133 19.406 0.727 -9.463 1.00 12.40 C ATOM 1968 C GLY A 133 18.653 1.176 -8.228 1.00 10.98 C ATOM 1969 O GLY A 133 17.509 1.625 -8.308 1.00 10.30 O ATOM 0 H GLY A 133 21.459 0.390 -9.230 1.00 13.12 H new ATOM 0 HA2 GLY A 133 19.728 1.601 -10.030 1.00 12.40 H new ATOM 0 HA3 GLY A 133 18.738 0.157 -10.108 1.00 12.40 H new ATOM 1973 N GLN A 134 19.302 1.058 -7.079 1.00 10.62 N ATOM 1974 CA GLN A 134 18.696 1.426 -5.815 1.00 9.33 C ATOM 1975 C GLN A 134 19.568 2.456 -5.131 1.00 8.96 C ATOM 1976 O GLN A 134 20.656 2.762 -5.608 1.00 9.81 O ATOM 1977 CB GLN A 134 18.533 0.207 -4.904 1.00 9.38 C ATOM 1978 CG GLN A 134 17.754 -0.936 -5.531 1.00 9.89 C ATOM 1979 CD GLN A 134 17.664 -2.138 -4.614 1.00 10.08 C ATOM 1980 OE1 GLN A 134 16.717 -2.279 -3.841 1.00 10.39 O ATOM 1981 NE2 GLN A 134 18.659 -3.005 -4.682 1.00 10.17 N ATOM 0 H GLN A 134 20.256 0.707 -7.000 1.00 10.62 H new ATOM 0 HA GLN A 134 17.706 1.838 -6.010 1.00 9.33 H new ATOM 0 HB2 GLN A 134 19.521 -0.154 -4.618 1.00 9.38 H new ATOM 0 HB3 GLN A 134 18.030 0.516 -3.988 1.00 9.38 H new ATOM 0 HG2 GLN A 134 16.749 -0.595 -5.780 1.00 9.89 H new ATOM 0 HG3 GLN A 134 18.232 -1.229 -6.466 1.00 9.89 H new ATOM 0 HE21 GLN A 134 19.426 -2.851 -5.337 1.00 10.17 H new ATOM 0 HE22 GLN A 134 18.660 -3.828 -4.080 1.00 10.17 H new ATOM 1990 N SER A 135 19.116 2.976 -4.018 1.00 7.82 N ATOM 1991 CA SER A 135 19.901 3.931 -3.281 1.00 7.56 C ATOM 1992 C SER A 135 20.057 3.495 -1.840 1.00 7.12 C ATOM 1993 O SER A 135 19.266 2.701 -1.328 1.00 6.78 O ATOM 1994 CB SER A 135 19.296 5.332 -3.367 1.00 6.91 C ATOM 1995 OG SER A 135 19.425 5.859 -4.675 1.00 6.85 O ATOM 0 H SER A 135 18.211 2.754 -3.604 1.00 7.82 H new ATOM 0 HA SER A 135 20.891 3.972 -3.734 1.00 7.56 H new ATOM 0 HB2 SER A 135 18.243 5.295 -3.088 1.00 6.91 H new ATOM 0 HB3 SER A 135 19.792 5.991 -2.655 1.00 6.91 H new ATOM 0 HG SER A 135 19.178 6.807 -4.671 1.00 6.85 H new ATOM 2001 N GLU A 136 21.086 3.998 -1.199 1.00 7.39 N ATOM 2002 CA GLU A 136 21.324 3.689 0.198 1.00 7.25 C ATOM 2003 C GLU A 136 20.882 4.836 1.089 1.00 6.42 C ATOM 2004 O GLU A 136 21.369 5.963 0.977 1.00 6.54 O ATOM 2005 CB GLU A 136 22.801 3.397 0.421 1.00 8.31 C ATOM 2006 CG GLU A 136 23.268 2.130 -0.272 1.00 9.31 C ATOM 2007 CD GLU A 136 24.689 1.745 0.092 1.00 10.29 C ATOM 2008 OE1 GLU A 136 25.198 2.238 1.119 1.00 10.69 O ATOM 2009 OE2 GLU A 136 25.313 0.953 -0.643 1.00 10.79 O1- ATOM 0 H GLU A 136 21.774 4.623 -1.619 1.00 7.39 H new ATOM 0 HA GLU A 136 20.739 2.807 0.459 1.00 7.25 H new ATOM 0 HB2 GLU A 136 23.390 4.240 0.060 1.00 8.31 H new ATOM 0 HB3 GLU A 136 22.991 3.310 1.491 1.00 8.31 H new ATOM 0 HG2 GLU A 136 22.597 1.311 -0.011 1.00 9.31 H new ATOM 0 HG3 GLU A 136 23.199 2.266 -1.351 1.00 9.31 H new ATOM 2016 N ILE A 137 19.919 4.543 1.942 1.00 5.86 N ATOM 2017 CA ILE A 137 19.501 5.462 2.975 1.00 5.49 C ATOM 2018 C ILE A 137 20.387 5.274 4.187 1.00 6.25 C ATOM 2019 O ILE A 137 20.236 4.319 4.954 1.00 6.73 O ATOM 2020 CB ILE A 137 18.018 5.275 3.360 1.00 4.93 C ATOM 2021 CG1 ILE A 137 17.123 5.694 2.198 1.00 4.16 C ATOM 2022 CG2 ILE A 137 17.668 6.066 4.616 1.00 5.24 C ATOM 2023 CD1 ILE A 137 17.479 7.052 1.647 1.00 4.21 C ATOM 0 H ILE A 137 19.407 3.661 1.936 1.00 5.86 H new ATOM 0 HA ILE A 137 19.600 6.477 2.589 1.00 5.49 H new ATOM 0 HB ILE A 137 17.851 4.220 3.576 1.00 4.93 H new ATOM 0 HG12 ILE A 137 17.198 4.953 1.402 1.00 4.16 H new ATOM 0 HG13 ILE A 137 16.085 5.702 2.530 1.00 4.16 H new ATOM 0 HG21 ILE A 137 16.617 5.913 4.861 1.00 5.24 H new ATOM 0 HG22 ILE A 137 18.287 5.724 5.445 1.00 5.24 H new ATOM 0 HG23 ILE A 137 17.849 7.126 4.441 1.00 5.24 H new ATOM 0 HD11 ILE A 137 16.809 7.297 0.823 1.00 4.21 H new ATOM 0 HD12 ILE A 137 17.378 7.801 2.432 1.00 4.21 H new ATOM 0 HD13 ILE A 137 18.508 7.040 1.287 1.00 4.21 H new ATOM 2035 N LEU A 138 21.333 6.181 4.320 1.00 6.60 N ATOM 2036 CA LEU A 138 22.328 6.125 5.366 1.00 7.40 C ATOM 2037 C LEU A 138 21.693 6.438 6.716 1.00 7.59 C ATOM 2038 O LEU A 138 22.057 5.852 7.735 1.00 8.21 O ATOM 2039 CB LEU A 138 23.466 7.109 5.047 1.00 7.87 C ATOM 2040 CG LEU A 138 24.516 6.660 4.005 1.00 8.31 C ATOM 2041 CD1 LEU A 138 23.888 5.901 2.849 1.00 7.93 C ATOM 2042 CD2 LEU A 138 25.264 7.869 3.461 1.00 8.79 C ATOM 0 H LEU A 138 21.432 6.984 3.699 1.00 6.60 H new ATOM 0 HA LEU A 138 22.744 5.119 5.418 1.00 7.40 H new ATOM 0 HB2 LEU A 138 23.020 8.040 4.697 1.00 7.87 H new ATOM 0 HB3 LEU A 138 23.988 7.335 5.977 1.00 7.87 H new ATOM 0 HG LEU A 138 25.206 5.988 4.515 1.00 8.31 H new ATOM 0 HD11 LEU A 138 24.664 5.606 2.143 1.00 7.93 H new ATOM 0 HD12 LEU A 138 23.385 5.011 3.228 1.00 7.93 H new ATOM 0 HD13 LEU A 138 23.163 6.540 2.345 1.00 7.93 H new ATOM 0 HD21 LEU A 138 26.001 7.541 2.728 1.00 8.79 H new ATOM 0 HD22 LEU A 138 24.558 8.550 2.986 1.00 8.79 H new ATOM 0 HD23 LEU A 138 25.769 8.382 4.279 1.00 8.79 H new ATOM 2054 N GLU A 139 20.742 7.361 6.718 1.00 7.31 N ATOM 2055 CA GLU A 139 20.008 7.709 7.915 1.00 7.84 C ATOM 2056 C GLU A 139 18.695 8.347 7.521 1.00 7.45 C ATOM 2057 O GLU A 139 18.568 8.836 6.414 1.00 6.77 O ATOM 2058 CB GLU A 139 20.841 8.642 8.794 1.00 8.66 C ATOM 2059 CG GLU A 139 20.031 9.534 9.714 1.00 9.21 C ATOM 2060 CD GLU A 139 20.882 10.290 10.707 1.00 9.98 C ATOM 2061 OE1 GLU A 139 21.844 10.959 10.280 1.00 10.28 O1- ATOM 2062 OE2 GLU A 139 20.608 10.203 11.922 1.00 10.44 O ATOM 0 H GLU A 139 20.462 7.886 5.889 1.00 7.31 H new ATOM 0 HA GLU A 139 19.799 6.811 8.497 1.00 7.84 H new ATOM 0 HB2 GLU A 139 21.520 8.040 9.398 1.00 8.66 H new ATOM 0 HB3 GLU A 139 21.458 9.270 8.151 1.00 8.66 H new ATOM 0 HG2 GLU A 139 19.465 10.246 9.114 1.00 9.21 H new ATOM 0 HG3 GLU A 139 19.306 8.925 10.255 1.00 9.21 H new ATOM 2069 N GLY A 140 17.724 8.334 8.408 1.00 8.06 N ATOM 2070 CA GLY A 140 16.495 9.036 8.138 1.00 8.05 C ATOM 2071 C GLY A 140 15.299 8.141 8.284 1.00 8.05 C ATOM 2072 O GLY A 140 14.235 8.576 8.723 1.00 8.87 O ATOM 0 H GLY A 140 17.762 7.853 9.307 1.00 8.06 H new ATOM 0 HA2 GLY A 140 16.402 9.881 8.820 1.00 8.05 H new ATOM 0 HA3 GLY A 140 16.523 9.443 7.127 1.00 8.05 H new ATOM 2076 N LEU A 141 15.484 6.879 7.940 1.00 7.34 N ATOM 2077 CA LEU A 141 14.375 5.937 7.930 1.00 7.46 C ATOM 2078 C LEU A 141 14.705 4.628 8.632 1.00 8.16 C ATOM 2079 O LEU A 141 15.791 4.449 9.179 1.00 8.50 O ATOM 2080 CB LEU A 141 13.912 5.662 6.500 1.00 6.40 C ATOM 2081 CG LEU A 141 13.175 6.816 5.828 1.00 6.03 C ATOM 2082 CD1 LEU A 141 13.019 6.549 4.344 1.00 5.58 C ATOM 2083 CD2 LEU A 141 11.815 7.024 6.483 1.00 6.58 C ATOM 0 H LEU A 141 16.383 6.483 7.666 1.00 7.34 H new ATOM 0 HA LEU A 141 13.566 6.407 8.489 1.00 7.46 H new ATOM 0 HB2 LEU A 141 14.782 5.405 5.896 1.00 6.40 H new ATOM 0 HB3 LEU A 141 13.260 4.789 6.507 1.00 6.40 H new ATOM 0 HG LEU A 141 13.761 7.727 5.952 1.00 6.03 H new ATOM 0 HD11 LEU A 141 12.491 7.381 3.878 1.00 5.58 H new ATOM 0 HD12 LEU A 141 14.003 6.443 3.888 1.00 5.58 H new ATOM 0 HD13 LEU A 141 12.450 5.631 4.197 1.00 5.58 H new ATOM 0 HD21 LEU A 141 11.299 7.850 5.995 1.00 6.58 H new ATOM 0 HD22 LEU A 141 11.221 6.116 6.384 1.00 6.58 H new ATOM 0 HD23 LEU A 141 11.951 7.255 7.539 1.00 6.58 H new ATOM 2095 N LYS A 142 13.745 3.720 8.589 1.00 8.54 N ATOM 2096 CA LYS A 142 13.836 2.435 9.254 1.00 9.51 C ATOM 2097 C LYS A 142 13.065 1.407 8.447 1.00 9.48 C ATOM 2098 O LYS A 142 12.165 1.750 7.685 1.00 8.97 O ATOM 2099 CB LYS A 142 13.219 2.557 10.645 1.00 10.71 C ATOM 2100 CG LYS A 142 13.251 1.274 11.458 1.00 11.83 C ATOM 2101 CD LYS A 142 12.554 1.441 12.802 1.00 12.89 C ATOM 2102 CE LYS A 142 11.054 1.644 12.635 1.00 13.50 C ATOM 2103 NZ LYS A 142 10.363 1.823 13.941 1.00 14.15 N1+ ATOM 0 H LYS A 142 12.870 3.858 8.084 1.00 8.54 H new ATOM 0 HA LYS A 142 14.878 2.126 9.339 1.00 9.51 H new ATOM 0 HB2 LYS A 142 13.746 3.336 11.196 1.00 10.71 H new ATOM 0 HB3 LYS A 142 12.184 2.883 10.543 1.00 10.71 H new ATOM 0 HG2 LYS A 142 12.769 0.474 10.895 1.00 11.83 H new ATOM 0 HG3 LYS A 142 14.286 0.971 11.620 1.00 11.83 H new ATOM 0 HD2 LYS A 142 12.736 0.561 13.419 1.00 12.89 H new ATOM 0 HD3 LYS A 142 12.980 2.294 13.330 1.00 12.89 H new ATOM 0 HE2 LYS A 142 10.875 2.517 12.008 1.00 13.50 H new ATOM 0 HE3 LYS A 142 10.628 0.786 12.115 1.00 13.50 H new ATOM 0 HZ1 LYS A 142 9.345 1.958 13.779 1.00 14.15 H new ATOM 0 HZ2 LYS A 142 10.511 0.979 14.531 1.00 14.15 H new ATOM 0 HZ3 LYS A 142 10.750 2.657 14.427 1.00 14.15 H new ATOM 2117 N ALA A 143 13.436 0.150 8.615 1.00 10.19 N ATOM 2118 CA ALA A 143 12.791 -0.937 7.902 1.00 10.49 C ATOM 2119 C ALA A 143 11.377 -1.131 8.408 1.00 11.20 C ATOM 2120 O ALA A 143 11.144 -1.169 9.615 1.00 12.12 O ATOM 2121 CB ALA A 143 13.583 -2.220 8.045 1.00 11.37 C ATOM 0 H ALA A 143 14.185 -0.144 9.243 1.00 10.19 H new ATOM 0 HA ALA A 143 12.752 -0.677 6.844 1.00 10.49 H new ATOM 0 HB1 ALA A 143 13.080 -3.020 7.502 1.00 11.37 H new ATOM 0 HB2 ALA A 143 14.583 -2.077 7.637 1.00 11.37 H new ATOM 0 HB3 ALA A 143 13.656 -2.487 9.099 1.00 11.37 H new ATOM 2127 N GLY A 144 10.445 -1.260 7.485 1.00 10.88 N ATOM 2128 CA GLY A 144 9.047 -1.292 7.852 1.00 11.54 C ATOM 2129 C GLY A 144 8.374 0.022 7.521 1.00 10.82 C ATOM 2130 O GLY A 144 7.161 0.168 7.666 1.00 11.32 O ATOM 0 H GLY A 144 10.629 -1.344 6.485 1.00 10.88 H new ATOM 0 HA2 GLY A 144 8.547 -2.105 7.325 1.00 11.54 H new ATOM 0 HA3 GLY A 144 8.951 -1.496 8.918 1.00 11.54 H new ATOM 2134 N GLN A 145 9.176 0.979 7.076 1.00 9.74 N ATOM 2135 CA GLN A 145 8.670 2.279 6.673 1.00 9.10 C ATOM 2136 C GLN A 145 8.584 2.339 5.159 1.00 8.05 C ATOM 2137 O GLN A 145 9.564 2.116 4.454 1.00 7.35 O ATOM 2138 CB GLN A 145 9.578 3.392 7.199 1.00 8.76 C ATOM 2139 CG GLN A 145 9.564 3.519 8.714 1.00 9.88 C ATOM 2140 CD GLN A 145 10.145 4.833 9.193 1.00 10.75 C ATOM 2141 OE1 GLN A 145 11.345 4.945 9.443 1.00 11.13 O ATOM 2142 NE2 GLN A 145 9.296 5.837 9.324 1.00 11.24 N ATOM 0 H GLN A 145 10.187 0.876 6.985 1.00 9.74 H new ATOM 0 HA GLN A 145 7.676 2.423 7.096 1.00 9.10 H new ATOM 0 HB2 GLN A 145 10.599 3.205 6.867 1.00 8.76 H new ATOM 0 HB3 GLN A 145 9.269 4.341 6.760 1.00 8.76 H new ATOM 0 HG2 GLN A 145 8.539 3.427 9.073 1.00 9.88 H new ATOM 0 HG3 GLN A 145 10.130 2.695 9.149 1.00 9.88 H new ATOM 0 HE21 GLN A 145 8.309 5.702 9.106 1.00 11.24 H new ATOM 0 HE22 GLN A 145 9.628 6.747 9.643 1.00 11.24 H new ATOM 2151 N GLN A 146 7.385 2.597 4.677 1.00 8.12 N ATOM 2152 CA GLN A 146 7.094 2.577 3.259 1.00 7.34 C ATOM 2153 C GLN A 146 7.287 3.949 2.654 1.00 6.41 C ATOM 2154 O GLN A 146 6.684 4.915 3.107 1.00 6.79 O ATOM 2155 CB GLN A 146 5.647 2.152 3.052 1.00 8.14 C ATOM 2156 CG GLN A 146 5.379 0.728 3.473 1.00 9.01 C ATOM 2157 CD GLN A 146 3.932 0.465 3.853 1.00 9.89 C ATOM 2158 OE1 GLN A 146 3.267 1.465 4.409 1.00 10.17 O flip ATOM 2159 NE2 GLN A 146 3.424 -0.642 3.673 1.00 10.49 N flip ATOM 0 H GLN A 146 6.582 2.828 5.262 1.00 8.12 H new ATOM 0 HA GLN A 146 7.773 1.876 2.775 1.00 7.34 H new ATOM 0 HB2 GLN A 146 4.995 2.819 3.616 1.00 8.14 H new ATOM 0 HB3 GLN A 146 5.388 2.268 1.999 1.00 8.14 H new ATOM 0 HG2 GLN A 146 5.659 0.059 2.659 1.00 9.01 H new ATOM 0 HG3 GLN A 146 6.018 0.483 4.321 1.00 9.01 H new ATOM 0 HE21 GLN A 146 3.968 -1.389 3.241 1.00 10.49 H new ATOM 0 HE22 GLN A 146 2.459 -0.812 3.956 1.00 10.49 H new ATOM 2168 N VAL A 147 8.108 4.028 1.627 1.00 5.45 N ATOM 2169 CA VAL A 147 8.342 5.287 0.946 1.00 4.76 C ATOM 2170 C VAL A 147 7.879 5.186 -0.491 1.00 4.67 C ATOM 2171 O VAL A 147 8.059 4.154 -1.139 1.00 4.76 O ATOM 2172 CB VAL A 147 9.825 5.710 0.988 1.00 3.89 C ATOM 2173 CG1 VAL A 147 10.228 6.062 2.409 1.00 4.21 C ATOM 2174 CG2 VAL A 147 10.729 4.616 0.431 1.00 3.49 C ATOM 0 H VAL A 147 8.625 3.236 1.245 1.00 5.45 H new ATOM 0 HA VAL A 147 7.770 6.052 1.471 1.00 4.76 H new ATOM 0 HB VAL A 147 9.944 6.591 0.358 1.00 3.89 H new ATOM 0 HG11 VAL A 147 11.277 6.359 2.427 1.00 4.21 H new ATOM 0 HG12 VAL A 147 9.611 6.886 2.769 1.00 4.21 H new ATOM 0 HG13 VAL A 147 10.086 5.194 3.053 1.00 4.21 H new ATOM 0 HG21 VAL A 147 11.767 4.945 0.474 1.00 3.49 H new ATOM 0 HG22 VAL A 147 10.610 3.709 1.024 1.00 3.49 H new ATOM 0 HG23 VAL A 147 10.456 4.411 -0.604 1.00 3.49 H new ATOM 2184 N VAL A 148 7.255 6.251 -0.972 1.00 4.95 N ATOM 2185 CA VAL A 148 6.705 6.265 -2.316 1.00 5.28 C ATOM 2186 C VAL A 148 7.813 6.167 -3.353 1.00 4.93 C ATOM 2187 O VAL A 148 8.827 6.862 -3.274 1.00 4.74 O ATOM 2188 CB VAL A 148 5.859 7.530 -2.580 1.00 6.08 C ATOM 2189 CG1 VAL A 148 4.669 7.583 -1.637 1.00 6.56 C ATOM 2190 CG2 VAL A 148 6.700 8.790 -2.442 1.00 6.56 C ATOM 0 H VAL A 148 7.118 7.116 -0.450 1.00 4.95 H new ATOM 0 HA VAL A 148 6.052 5.396 -2.401 1.00 5.28 H new ATOM 0 HB VAL A 148 5.491 7.479 -3.605 1.00 6.08 H new ATOM 0 HG11 VAL A 148 4.085 8.481 -1.838 1.00 6.56 H new ATOM 0 HG12 VAL A 148 4.045 6.703 -1.789 1.00 6.56 H new ATOM 0 HG13 VAL A 148 5.022 7.603 -0.606 1.00 6.56 H new ATOM 0 HG21 VAL A 148 6.079 9.665 -2.633 1.00 6.56 H new ATOM 0 HG22 VAL A 148 7.107 8.847 -1.432 1.00 6.56 H new ATOM 0 HG23 VAL A 148 7.518 8.762 -3.162 1.00 6.56 H new ATOM 2200 N VAL A 149 7.624 5.281 -4.311 1.00 5.25 N ATOM 2201 CA VAL A 149 8.603 5.080 -5.361 1.00 5.51 C ATOM 2202 C VAL A 149 7.965 5.390 -6.708 1.00 6.47 C ATOM 2203 O VAL A 149 8.449 4.985 -7.766 1.00 6.99 O ATOM 2204 CB VAL A 149 9.184 3.644 -5.303 1.00 5.65 C ATOM 2205 CG1 VAL A 149 9.524 3.301 -3.871 1.00 5.29 C ATOM 2206 CG2 VAL A 149 8.238 2.598 -5.863 1.00 6.22 C ATOM 0 H VAL A 149 6.798 4.687 -4.384 1.00 5.25 H new ATOM 0 HA VAL A 149 9.442 5.761 -5.218 1.00 5.51 H new ATOM 0 HB VAL A 149 10.077 3.632 -5.928 1.00 5.65 H new ATOM 0 HG11 VAL A 149 9.933 2.292 -3.826 1.00 5.29 H new ATOM 0 HG12 VAL A 149 10.262 4.009 -3.493 1.00 5.29 H new ATOM 0 HG13 VAL A 149 8.623 3.355 -3.260 1.00 5.29 H new ATOM 0 HG21 VAL A 149 8.702 1.614 -5.794 1.00 6.22 H new ATOM 0 HG22 VAL A 149 7.310 2.603 -5.291 1.00 6.22 H new ATOM 0 HG23 VAL A 149 8.021 2.825 -6.907 1.00 6.22 H new ATOM 2216 N SER A 150 6.866 6.144 -6.621 1.00 6.89 N ATOM 2217 CA SER A 150 6.110 6.628 -7.774 1.00 7.82 C ATOM 2218 C SER A 150 5.299 5.513 -8.438 1.00 8.09 C ATOM 2219 O SER A 150 5.620 4.328 -8.318 1.00 8.72 O ATOM 2220 CB SER A 150 7.035 7.305 -8.796 1.00 8.62 C ATOM 2221 OG SER A 150 7.781 8.354 -8.192 1.00 9.06 O ATOM 0 H SER A 150 6.471 6.440 -5.728 1.00 6.89 H new ATOM 0 HA SER A 150 5.403 7.370 -7.402 1.00 7.82 H new ATOM 0 HB2 SER A 150 7.716 6.567 -9.220 1.00 8.62 H new ATOM 0 HB3 SER A 150 6.443 7.703 -9.620 1.00 8.62 H new ATOM 0 HG SER A 150 8.364 8.769 -8.862 1.00 9.06 H new ATOM 2227 N GLY A 151 4.225 5.901 -9.111 1.00 7.84 N ATOM 2228 CA GLY A 151 3.447 4.954 -9.883 1.00 8.31 C ATOM 2229 C GLY A 151 4.140 4.632 -11.188 1.00 8.50 C ATOM 2230 O GLY A 151 3.700 5.058 -12.254 1.00 8.43 O ATOM 0 H GLY A 151 3.877 6.860 -9.136 1.00 7.84 H new ATOM 0 HA2 GLY A 151 3.302 4.040 -9.307 1.00 8.31 H new ATOM 0 HA3 GLY A 151 2.458 5.366 -10.083 1.00 8.31 H new ATOM 2234 N GLN A 152 5.232 3.887 -11.091 1.00 8.97 N ATOM 2235 CA GLN A 152 6.094 3.631 -12.234 1.00 9.41 C ATOM 2236 C GLN A 152 5.363 2.917 -13.364 1.00 9.73 C ATOM 2237 O GLN A 152 4.544 2.024 -13.127 1.00 9.97 O ATOM 2238 CB GLN A 152 7.321 2.818 -11.820 1.00 10.01 C ATOM 2239 CG GLN A 152 8.183 3.504 -10.776 1.00 10.63 C ATOM 2240 CD GLN A 152 9.262 2.591 -10.229 1.00 11.38 C ATOM 2241 OE1 GLN A 152 10.368 2.524 -10.762 1.00 11.71 O ATOM 2242 NE2 GLN A 152 8.949 1.883 -9.156 1.00 11.84 N ATOM 0 H GLN A 152 5.543 3.447 -10.225 1.00 8.97 H new ATOM 0 HA GLN A 152 6.413 4.605 -12.606 1.00 9.41 H new ATOM 0 HB2 GLN A 152 6.993 1.854 -11.431 1.00 10.01 H new ATOM 0 HB3 GLN A 152 7.927 2.616 -12.703 1.00 10.01 H new ATOM 0 HG2 GLN A 152 8.646 4.388 -11.215 1.00 10.63 H new ATOM 0 HG3 GLN A 152 7.552 3.848 -9.957 1.00 10.63 H new ATOM 0 HE21 GLN A 152 8.020 1.967 -8.743 1.00 11.84 H new ATOM 0 HE22 GLN A 152 9.637 1.254 -8.742 1.00 11.84 H new ATOM 2251 N PHE A 153 5.671 3.313 -14.585 1.00 9.95 N ATOM 2252 CA PHE A 153 5.143 2.657 -15.768 1.00 10.47 C ATOM 2253 C PHE A 153 6.237 1.821 -16.426 1.00 10.93 C ATOM 2254 O PHE A 153 7.228 1.475 -15.769 1.00 11.34 O ATOM 2255 CB PHE A 153 4.584 3.702 -16.742 1.00 10.62 C ATOM 2256 CG PHE A 153 5.467 4.909 -16.928 1.00 11.04 C ATOM 2257 CD1 PHE A 153 6.601 4.845 -17.721 1.00 11.27 C ATOM 2258 CD2 PHE A 153 5.156 6.107 -16.307 1.00 11.41 C ATOM 2259 CE1 PHE A 153 7.407 5.955 -17.889 1.00 11.87 C ATOM 2260 CE2 PHE A 153 5.959 7.218 -16.474 1.00 12.02 C ATOM 2261 CZ PHE A 153 7.086 7.142 -17.265 1.00 12.24 C ATOM 0 H PHE A 153 6.293 4.097 -14.785 1.00 9.95 H new ATOM 0 HA PHE A 153 4.329 1.991 -15.482 1.00 10.47 H new ATOM 0 HB2 PHE A 153 4.424 3.230 -17.711 1.00 10.62 H new ATOM 0 HB3 PHE A 153 3.609 4.031 -16.383 1.00 10.62 H new ATOM 0 HD1 PHE A 153 6.858 3.918 -18.213 1.00 11.27 H new ATOM 0 HD2 PHE A 153 4.276 6.173 -15.685 1.00 11.41 H new ATOM 0 HE1 PHE A 153 8.289 5.893 -18.509 1.00 11.87 H new ATOM 0 HE2 PHE A 153 5.704 8.147 -15.985 1.00 12.02 H new ATOM 0 HZ PHE A 153 7.716 8.010 -17.395 1.00 12.24 H new ATOM 2271 N LEU A 154 6.036 1.475 -17.699 1.00 11.05 N ATOM 2272 CA LEU A 154 7.002 0.698 -18.482 1.00 11.63 C ATOM 2273 C LEU A 154 7.036 -0.752 -18.008 1.00 11.39 C ATOM 2274 O LEU A 154 6.560 -1.656 -18.692 1.00 11.57 O ATOM 2275 CB LEU A 154 8.404 1.321 -18.405 1.00 12.16 C ATOM 2276 CG LEU A 154 9.484 0.598 -19.216 1.00 12.68 C ATOM 2277 CD1 LEU A 154 9.149 0.619 -20.700 1.00 13.16 C ATOM 2278 CD2 LEU A 154 10.846 1.225 -18.966 1.00 13.04 C ATOM 0 H LEU A 154 5.195 1.726 -18.219 1.00 11.05 H new ATOM 0 HA LEU A 154 6.681 0.715 -19.523 1.00 11.63 H new ATOM 0 HB2 LEU A 154 8.345 2.354 -18.748 1.00 12.16 H new ATOM 0 HB3 LEU A 154 8.715 1.350 -17.361 1.00 12.16 H new ATOM 0 HG LEU A 154 9.518 -0.442 -18.890 1.00 12.68 H new ATOM 0 HD11 LEU A 154 9.929 0.100 -21.257 1.00 13.16 H new ATOM 0 HD12 LEU A 154 8.194 0.121 -20.864 1.00 13.16 H new ATOM 0 HD13 LEU A 154 9.084 1.651 -21.044 1.00 13.16 H new ATOM 0 HD21 LEU A 154 11.601 0.699 -19.550 1.00 13.04 H new ATOM 0 HD22 LEU A 154 10.824 2.274 -19.262 1.00 13.04 H new ATOM 0 HD23 LEU A 154 11.091 1.152 -17.906 1.00 13.04 H new ATOM 2290 N ILE A 155 7.595 -0.953 -16.822 1.00 11.17 N ATOM 2291 CA ILE A 155 7.829 -2.283 -16.283 1.00 11.08 C ATOM 2292 C ILE A 155 6.591 -2.788 -15.540 1.00 10.31 C ATOM 2293 O ILE A 155 6.586 -3.882 -14.970 1.00 9.93 O ATOM 2294 CB ILE A 155 9.063 -2.277 -15.343 1.00 11.39 C ATOM 2295 CG1 ILE A 155 9.493 -3.704 -14.986 1.00 11.61 C ATOM 2296 CG2 ILE A 155 8.774 -1.470 -14.083 1.00 11.66 C ATOM 2297 CD1 ILE A 155 10.759 -3.769 -14.160 1.00 11.95 C ATOM 0 H ILE A 155 7.898 -0.197 -16.208 1.00 11.17 H new ATOM 0 HA ILE A 155 8.030 -2.960 -17.113 1.00 11.08 H new ATOM 0 HB ILE A 155 9.888 -1.802 -15.874 1.00 11.39 H new ATOM 0 HG12 ILE A 155 8.686 -4.191 -14.437 1.00 11.61 H new ATOM 0 HG13 ILE A 155 9.640 -4.270 -15.906 1.00 11.61 H new ATOM 0 HG21 ILE A 155 9.652 -1.478 -13.437 1.00 11.66 H new ATOM 0 HG22 ILE A 155 8.534 -0.443 -14.356 1.00 11.66 H new ATOM 0 HG23 ILE A 155 7.930 -1.912 -13.554 1.00 11.66 H new ATOM 0 HD11 ILE A 155 11.001 -4.810 -13.946 1.00 11.95 H new ATOM 0 HD12 ILE A 155 11.579 -3.312 -14.714 1.00 11.95 H new ATOM 0 HD13 ILE A 155 10.610 -3.231 -13.224 1.00 11.95 H new ATOM 2309 N ASP A 156 5.527 -1.987 -15.573 1.00 10.31 N ATOM 2310 CA ASP A 156 4.268 -2.375 -14.949 1.00 9.81 C ATOM 2311 C ASP A 156 3.651 -3.547 -15.702 1.00 9.63 C ATOM 2312 O ASP A 156 2.845 -4.287 -15.144 1.00 9.09 O ATOM 2313 CB ASP A 156 3.290 -1.197 -14.894 1.00 10.26 C ATOM 2314 CG ASP A 156 1.998 -1.542 -14.180 1.00 10.68 C ATOM 2315 OD1 ASP A 156 2.034 -1.778 -12.954 1.00 11.22 O ATOM 2316 OD2 ASP A 156 0.940 -1.581 -14.847 1.00 10.64 O1- ATOM 0 H ASP A 156 5.513 -1.072 -16.023 1.00 10.31 H new ATOM 0 HA ASP A 156 4.476 -2.682 -13.924 1.00 9.81 H new ATOM 0 HB2 ASP A 156 3.767 -0.358 -14.388 1.00 10.26 H new ATOM 0 HB3 ASP A 156 3.063 -0.871 -15.909 1.00 10.26 H new ATOM 2321 N SER A 157 4.037 -3.731 -16.953 1.00 10.26 N ATOM 2322 CA SER A 157 3.551 -4.860 -17.727 1.00 10.38 C ATOM 2323 C SER A 157 3.925 -6.171 -17.038 1.00 9.63 C ATOM 2324 O SER A 157 3.062 -7.007 -16.739 1.00 9.37 O ATOM 2325 CB SER A 157 4.126 -4.792 -19.142 1.00 11.42 C ATOM 2326 OG SER A 157 5.528 -4.563 -19.111 1.00 11.90 O ATOM 0 H SER A 157 4.681 -3.117 -17.452 1.00 10.26 H new ATOM 0 HA SER A 157 2.464 -4.818 -17.793 1.00 10.38 H new ATOM 0 HB2 SER A 157 3.918 -5.723 -19.668 1.00 11.42 H new ATOM 0 HB3 SER A 157 3.636 -3.994 -19.700 1.00 11.42 H new ATOM 0 HG SER A 157 6.000 -5.398 -19.312 1.00 11.90 H new ATOM 2332 N GLU A 158 5.211 -6.310 -16.739 1.00 9.47 N ATOM 2333 CA GLU A 158 5.723 -7.477 -16.036 1.00 9.00 C ATOM 2334 C GLU A 158 5.077 -7.594 -14.660 1.00 8.03 C ATOM 2335 O GLU A 158 4.794 -8.686 -14.173 1.00 7.69 O ATOM 2336 CB GLU A 158 7.245 -7.396 -15.892 1.00 9.38 C ATOM 2337 CG GLU A 158 8.009 -7.698 -17.176 1.00 10.19 C ATOM 2338 CD GLU A 158 7.862 -6.617 -18.228 1.00 10.79 C ATOM 2339 OE1 GLU A 158 8.478 -5.544 -18.066 1.00 11.17 O1- ATOM 2340 OE2 GLU A 158 7.135 -6.836 -19.221 1.00 11.06 O ATOM 0 H GLU A 158 5.924 -5.620 -16.976 1.00 9.47 H new ATOM 0 HA GLU A 158 5.474 -8.363 -16.621 1.00 9.00 H new ATOM 0 HB2 GLU A 158 7.514 -6.397 -15.548 1.00 9.38 H new ATOM 0 HB3 GLU A 158 7.564 -8.096 -15.119 1.00 9.38 H new ATOM 0 HG2 GLU A 158 9.066 -7.825 -16.941 1.00 10.19 H new ATOM 0 HG3 GLU A 158 7.657 -8.645 -17.586 1.00 10.19 H new ATOM 2347 N ALA A 159 4.849 -6.436 -14.044 1.00 7.82 N ATOM 2348 CA ALA A 159 4.250 -6.363 -12.719 1.00 7.20 C ATOM 2349 C ALA A 159 2.791 -6.797 -12.747 1.00 7.12 C ATOM 2350 O ALA A 159 2.271 -7.304 -11.757 1.00 6.81 O ATOM 2351 CB ALA A 159 4.370 -4.952 -12.163 1.00 7.44 C ATOM 0 H ALA A 159 5.074 -5.527 -14.449 1.00 7.82 H new ATOM 0 HA ALA A 159 4.792 -7.049 -12.067 1.00 7.20 H new ATOM 0 HB1 ALA A 159 3.918 -4.912 -11.172 1.00 7.44 H new ATOM 0 HB2 ALA A 159 5.422 -4.677 -12.093 1.00 7.44 H new ATOM 0 HB3 ALA A 159 3.856 -4.255 -12.825 1.00 7.44 H new ATOM 2357 N SER A 160 2.129 -6.593 -13.879 1.00 7.72 N ATOM 2358 CA SER A 160 0.751 -7.025 -14.036 1.00 8.04 C ATOM 2359 C SER A 160 0.700 -8.533 -14.257 1.00 7.99 C ATOM 2360 O SER A 160 -0.347 -9.148 -14.059 1.00 8.08 O ATOM 2361 CB SER A 160 0.062 -6.280 -15.187 1.00 8.99 C ATOM 2362 OG SER A 160 -1.327 -6.564 -15.237 1.00 9.64 O ATOM 0 H SER A 160 2.525 -6.132 -14.698 1.00 7.72 H new ATOM 0 HA SER A 160 0.209 -6.786 -13.121 1.00 8.04 H new ATOM 0 HB2 SER A 160 0.210 -5.207 -15.067 1.00 8.99 H new ATOM 0 HB3 SER A 160 0.526 -6.562 -16.132 1.00 8.99 H new ATOM 0 HG SER A 160 -1.735 -6.072 -15.980 1.00 9.64 H new ATOM 2368 N LEU A 161 1.807 -9.134 -14.660 1.00 8.10 N ATOM 2369 CA LEU A 161 1.868 -10.582 -14.758 1.00 8.40 C ATOM 2370 C LEU A 161 1.677 -11.188 -13.371 1.00 7.89 C ATOM 2371 O LEU A 161 0.821 -12.056 -13.168 1.00 8.18 O ATOM 2372 CB LEU A 161 3.203 -11.027 -15.356 1.00 9.04 C ATOM 2373 CG LEU A 161 3.486 -10.519 -16.773 1.00 9.80 C ATOM 2374 CD1 LEU A 161 4.866 -10.965 -17.233 1.00 10.57 C ATOM 2375 CD2 LEU A 161 2.421 -11.013 -17.736 1.00 10.37 C ATOM 0 H LEU A 161 2.665 -8.649 -14.922 1.00 8.10 H new ATOM 0 HA LEU A 161 1.073 -10.930 -15.418 1.00 8.40 H new ATOM 0 HB2 LEU A 161 4.006 -10.691 -14.700 1.00 9.04 H new ATOM 0 HB3 LEU A 161 3.233 -12.117 -15.365 1.00 9.04 H new ATOM 0 HG LEU A 161 3.462 -9.429 -16.760 1.00 9.80 H new ATOM 0 HD11 LEU A 161 5.050 -10.595 -18.242 1.00 10.57 H new ATOM 0 HD12 LEU A 161 5.622 -10.566 -16.556 1.00 10.57 H new ATOM 0 HD13 LEU A 161 4.916 -12.054 -17.231 1.00 10.57 H new ATOM 0 HD21 LEU A 161 2.637 -10.643 -18.738 1.00 10.37 H new ATOM 0 HD22 LEU A 161 2.416 -12.103 -17.745 1.00 10.37 H new ATOM 0 HD23 LEU A 161 1.445 -10.648 -17.417 1.00 10.37 H new ATOM 2387 N ARG A 162 2.452 -10.676 -12.415 1.00 7.38 N ATOM 2388 CA ARG A 162 2.350 -11.103 -11.022 1.00 7.17 C ATOM 2389 C ARG A 162 0.990 -10.726 -10.454 1.00 6.87 C ATOM 2390 O ARG A 162 0.416 -11.445 -9.636 1.00 6.95 O ATOM 2391 CB ARG A 162 3.443 -10.456 -10.163 1.00 7.15 C ATOM 2392 CG ARG A 162 4.851 -10.990 -10.394 1.00 7.34 C ATOM 2393 CD ARG A 162 5.445 -10.529 -11.715 1.00 7.40 C ATOM 2394 NE ARG A 162 6.860 -10.895 -11.830 1.00 7.84 N ATOM 2395 CZ ARG A 162 7.556 -10.871 -12.966 1.00 8.24 C ATOM 2396 NH1 ARG A 162 6.968 -10.522 -14.104 1.00 8.25 N1+ ATOM 2397 NH2 ARG A 162 8.841 -11.201 -12.960 1.00 8.90 N ATOM 0 H ARG A 162 3.160 -9.961 -12.582 1.00 7.38 H new ATOM 0 HA ARG A 162 2.475 -12.186 -10.999 1.00 7.17 H new ATOM 0 HB2 ARG A 162 3.443 -9.383 -10.352 1.00 7.15 H new ATOM 0 HB3 ARG A 162 3.187 -10.595 -9.113 1.00 7.15 H new ATOM 0 HG2 ARG A 162 5.496 -10.666 -9.578 1.00 7.34 H new ATOM 0 HG3 ARG A 162 4.830 -12.080 -10.370 1.00 7.34 H new ATOM 0 HD2 ARG A 162 4.886 -10.972 -12.540 1.00 7.40 H new ATOM 0 HD3 ARG A 162 5.340 -9.448 -11.804 1.00 7.40 H new ATOM 0 HE ARG A 162 7.345 -11.188 -10.982 1.00 7.84 H new ATOM 0 HH11 ARG A 162 5.979 -10.271 -14.111 1.00 8.25 H new ATOM 0 HH12 ARG A 162 7.505 -10.505 -14.971 1.00 8.25 H new ATOM 0 HH21 ARG A 162 9.294 -11.472 -12.087 1.00 8.90 H new ATOM 0 HH22 ARG A 162 9.376 -11.183 -13.828 1.00 8.90 H new ATOM 2411 N GLY A 163 0.484 -9.587 -10.899 1.00 6.89 N ATOM 2412 CA GLY A 163 -0.784 -9.097 -10.410 1.00 7.01 C ATOM 2413 C GLY A 163 -0.606 -7.917 -9.482 1.00 6.68 C ATOM 2414 O GLY A 163 -1.250 -7.846 -8.439 1.00 7.15 O ATOM 0 H GLY A 163 0.933 -8.991 -11.594 1.00 6.89 H new ATOM 0 HA2 GLY A 163 -1.411 -8.806 -11.253 1.00 7.01 H new ATOM 0 HA3 GLY A 163 -1.306 -9.897 -9.885 1.00 7.01 H new ATOM 2418 N THR A 164 0.274 -6.996 -9.878 1.00 6.17 N ATOM 2419 CA THR A 164 0.602 -5.792 -9.106 1.00 6.16 C ATOM 2420 C THR A 164 1.055 -6.125 -7.681 1.00 6.65 C ATOM 2421 O THR A 164 2.236 -6.383 -7.444 1.00 7.09 O ATOM 2422 CB THR A 164 -0.553 -4.754 -9.085 1.00 6.38 C ATOM 2423 OG1 THR A 164 -1.772 -5.333 -8.595 1.00 6.86 O ATOM 2424 CG2 THR A 164 -0.788 -4.190 -10.478 1.00 6.23 C ATOM 0 H THR A 164 0.787 -7.065 -10.757 1.00 6.17 H new ATOM 0 HA THR A 164 1.441 -5.331 -9.628 1.00 6.16 H new ATOM 0 HB THR A 164 -0.255 -3.951 -8.411 1.00 6.38 H new ATOM 0 HG1 THR A 164 -1.677 -6.307 -8.551 1.00 6.86 H new ATOM 0 HG21 THR A 164 -1.601 -3.464 -10.444 1.00 6.23 H new ATOM 0 HG22 THR A 164 0.120 -3.701 -10.831 1.00 6.23 H new ATOM 0 HG23 THR A 164 -1.052 -4.999 -11.158 1.00 6.23 H new ATOM 2432 N VAL A 165 0.118 -6.136 -6.746 1.00 6.89 N ATOM 2433 CA VAL A 165 0.425 -6.441 -5.358 1.00 7.69 C ATOM 2434 C VAL A 165 0.267 -7.937 -5.081 1.00 7.93 C ATOM 2435 O VAL A 165 -0.701 -8.378 -4.458 1.00 8.39 O ATOM 2436 CB VAL A 165 -0.456 -5.611 -4.396 1.00 8.39 C ATOM 2437 CG1 VAL A 165 -0.026 -4.152 -4.422 1.00 9.20 C ATOM 2438 CG2 VAL A 165 -1.933 -5.723 -4.760 1.00 8.56 C ATOM 0 H VAL A 165 -0.866 -5.936 -6.925 1.00 6.89 H new ATOM 0 HA VAL A 165 1.465 -6.169 -5.180 1.00 7.69 H new ATOM 0 HB VAL A 165 -0.323 -6.010 -3.391 1.00 8.39 H new ATOM 0 HG11 VAL A 165 -0.653 -3.576 -3.741 1.00 9.20 H new ATOM 0 HG12 VAL A 165 1.016 -4.074 -4.110 1.00 9.20 H new ATOM 0 HG13 VAL A 165 -0.132 -3.759 -5.433 1.00 9.20 H new ATOM 0 HG21 VAL A 165 -2.525 -5.128 -4.065 1.00 8.56 H new ATOM 0 HG22 VAL A 165 -2.087 -5.355 -5.774 1.00 8.56 H new ATOM 0 HG23 VAL A 165 -2.244 -6.766 -4.701 1.00 8.56 H new ATOM 2448 N ALA A 166 1.230 -8.715 -5.558 1.00 7.88 N ATOM 2449 CA ALA A 166 1.192 -10.165 -5.415 1.00 8.33 C ATOM 2450 C ALA A 166 1.342 -10.582 -3.953 1.00 8.94 C ATOM 2451 O ALA A 166 2.039 -9.926 -3.178 1.00 9.11 O ATOM 2452 CB ALA A 166 2.278 -10.802 -6.266 1.00 8.31 C ATOM 0 H ALA A 166 2.052 -8.364 -6.050 1.00 7.88 H new ATOM 0 HA ALA A 166 0.220 -10.516 -5.761 1.00 8.33 H new ATOM 0 HB1 ALA A 166 2.241 -11.885 -6.152 1.00 8.31 H new ATOM 0 HB2 ALA A 166 2.120 -10.542 -7.313 1.00 8.31 H new ATOM 0 HB3 ALA A 166 3.253 -10.436 -5.945 1.00 8.31 H new ATOM 2458 N ARG A 167 0.691 -11.674 -3.585 1.00 9.50 N ATOM 2459 CA ARG A 167 0.728 -12.162 -2.224 1.00 10.31 C ATOM 2460 C ARG A 167 1.539 -13.436 -2.143 1.00 10.80 C ATOM 2461 O ARG A 167 1.121 -14.484 -2.640 1.00 11.13 O ATOM 2462 CB ARG A 167 -0.694 -12.399 -1.692 1.00 10.89 C ATOM 2463 CG ARG A 167 -0.743 -12.807 -0.221 1.00 11.67 C ATOM 2464 CD ARG A 167 -0.274 -14.237 -0.006 1.00 12.28 C ATOM 2465 NE ARG A 167 0.042 -14.514 1.395 1.00 13.07 N ATOM 2466 CZ ARG A 167 0.851 -15.493 1.795 1.00 13.78 C ATOM 2467 NH1 ARG A 167 1.386 -16.322 0.907 1.00 13.81 N1+ ATOM 2468 NH2 ARG A 167 1.118 -15.650 3.086 1.00 14.58 N ATOM 0 H ARG A 167 0.127 -12.240 -4.219 1.00 9.50 H new ATOM 0 HA ARG A 167 1.205 -11.404 -1.602 1.00 10.31 H new ATOM 0 HB2 ARG A 167 -1.278 -11.489 -1.826 1.00 10.89 H new ATOM 0 HB3 ARG A 167 -1.171 -13.175 -2.291 1.00 10.89 H new ATOM 0 HG2 ARG A 167 -0.119 -12.130 0.363 1.00 11.67 H new ATOM 0 HG3 ARG A 167 -1.762 -12.701 0.150 1.00 11.67 H new ATOM 0 HD2 ARG A 167 -1.048 -14.925 -0.344 1.00 12.28 H new ATOM 0 HD3 ARG A 167 0.608 -14.424 -0.619 1.00 12.28 H new ATOM 0 HE ARG A 167 -0.383 -13.922 2.108 1.00 13.07 H new ATOM 0 HH11 ARG A 167 1.178 -16.210 -0.085 1.00 13.81 H new ATOM 0 HH12 ARG A 167 2.005 -17.071 1.217 1.00 13.81 H new ATOM 0 HH21 ARG A 167 0.703 -15.020 3.773 1.00 14.58 H new ATOM 0 HH22 ARG A 167 1.738 -16.400 3.391 1.00 14.58 H new ATOM 2482 N MET A 168 2.687 -13.335 -1.501 1.00 11.01 N ATOM 2483 CA MET A 168 3.522 -14.489 -1.209 1.00 11.55 C ATOM 2484 C MET A 168 4.303 -14.259 0.071 1.00 11.86 C ATOM 2485 O MET A 168 4.058 -14.898 1.094 1.00 11.94 O ATOM 2486 CB MET A 168 4.477 -14.780 -2.365 1.00 11.57 C ATOM 2487 CG MET A 168 3.768 -15.241 -3.624 1.00 11.64 C ATOM 2488 SD MET A 168 3.422 -13.901 -4.789 1.00 11.27 S ATOM 2489 CE MET A 168 5.046 -13.166 -4.972 1.00 10.38 C ATOM 0 H MET A 168 3.069 -12.451 -1.166 1.00 11.01 H new ATOM 0 HA MET A 168 2.873 -15.355 -1.078 1.00 11.55 H new ATOM 0 HB2 MET A 168 5.052 -13.881 -2.588 1.00 11.57 H new ATOM 0 HB3 MET A 168 5.189 -15.545 -2.056 1.00 11.57 H new ATOM 0 HG2 MET A 168 4.379 -15.995 -4.120 1.00 11.64 H new ATOM 0 HG3 MET A 168 2.830 -15.723 -3.348 1.00 11.64 H new ATOM 0 HE1 MET A 168 5.140 -12.734 -5.968 1.00 10.38 H new ATOM 0 HE2 MET A 168 5.178 -12.385 -4.223 1.00 10.38 H new ATOM 0 HE3 MET A 168 5.809 -13.932 -4.836 1.00 10.38 H new ATOM 2499 N GLN A 169 5.244 -13.342 -0.004 1.00 12.22 N ATOM 2500 CA GLN A 169 6.102 -13.011 1.126 1.00 12.70 C ATOM 2501 C GLN A 169 6.294 -11.503 1.215 1.00 12.99 C ATOM 2502 O GLN A 169 5.820 -10.857 2.147 1.00 13.33 O ATOM 2503 CB GLN A 169 7.465 -13.695 0.984 1.00 13.10 C ATOM 2504 CG GLN A 169 7.400 -15.215 0.963 1.00 13.81 C ATOM 2505 CD GLN A 169 8.770 -15.858 0.857 1.00 14.46 C ATOM 2506 OE1 GLN A 169 9.703 -15.169 0.220 1.00 14.64 O flip ATOM 2507 NE2 GLN A 169 8.990 -16.964 1.348 1.00 14.99 N flip ATOM 0 H GLN A 169 5.440 -12.802 -0.847 1.00 12.22 H new ATOM 0 HA GLN A 169 5.621 -13.367 2.037 1.00 12.70 H new ATOM 0 HB2 GLN A 169 7.938 -13.350 0.065 1.00 13.10 H new ATOM 0 HB3 GLN A 169 8.104 -13.381 1.809 1.00 13.10 H new ATOM 0 HG2 GLN A 169 6.908 -15.566 1.870 1.00 13.81 H new ATOM 0 HG3 GLN A 169 6.786 -15.537 0.122 1.00 13.81 H new ATOM 0 HE21 GLN A 169 8.245 -17.465 1.832 1.00 14.99 H new ATOM 0 HE22 GLN A 169 9.918 -17.381 1.271 1.00 14.99 H new ATOM 2516 N GLU A 170 7.001 -10.955 0.236 1.00 13.03 N ATOM 2517 CA GLU A 170 7.313 -9.536 0.212 1.00 13.47 C ATOM 2518 C GLU A 170 7.049 -8.963 -1.185 1.00 13.57 C ATOM 2519 O GLU A 170 6.310 -7.990 -1.336 1.00 13.95 O ATOM 2520 CB GLU A 170 8.778 -9.306 0.658 1.00 14.04 C ATOM 2521 CG GLU A 170 9.860 -9.798 -0.307 1.00 14.40 C ATOM 2522 CD GLU A 170 9.849 -11.297 -0.532 1.00 14.65 C ATOM 2523 OE1 GLU A 170 9.079 -11.768 -1.392 1.00 14.64 O ATOM 2524 OE2 GLU A 170 10.603 -12.013 0.160 1.00 15.01 O1- ATOM 0 H GLU A 170 7.371 -11.478 -0.557 1.00 13.03 H new ATOM 0 HA GLU A 170 6.666 -9.010 0.914 1.00 13.47 H new ATOM 0 HB2 GLU A 170 8.923 -8.238 0.821 1.00 14.04 H new ATOM 0 HB3 GLU A 170 8.926 -9.798 1.619 1.00 14.04 H new ATOM 0 HG2 GLU A 170 9.733 -9.296 -1.266 1.00 14.40 H new ATOM 0 HG3 GLU A 170 10.837 -9.506 0.079 1.00 14.40 H new ATOM 2531 N THR A 171 7.655 -9.577 -2.196 1.00 13.39 N ATOM 2532 CA THR A 171 7.524 -9.147 -3.582 1.00 13.67 C ATOM 2533 C THR A 171 7.741 -10.323 -4.522 1.00 13.64 C ATOM 2534 O THR A 171 6.979 -10.533 -5.465 1.00 13.80 O ATOM 2535 CB THR A 171 8.532 -8.036 -3.940 1.00 13.90 C ATOM 2536 OG1 THR A 171 9.832 -8.361 -3.424 1.00 13.68 O ATOM 2537 CG2 THR A 171 8.091 -6.679 -3.411 1.00 14.25 C ATOM 0 H THR A 171 8.255 -10.393 -2.075 1.00 13.39 H new ATOM 0 HA THR A 171 6.515 -8.751 -3.697 1.00 13.67 H new ATOM 0 HB THR A 171 8.576 -7.972 -5.027 1.00 13.90 H new ATOM 0 HG1 THR A 171 10.464 -7.650 -3.659 1.00 13.68 H new ATOM 0 HG21 THR A 171 8.829 -5.925 -3.685 1.00 14.25 H new ATOM 0 HG22 THR A 171 7.126 -6.416 -3.843 1.00 14.25 H new ATOM 0 HG23 THR A 171 8.003 -6.723 -2.325 1.00 14.25 H new ATOM 2545 N THR A 172 8.795 -11.079 -4.250 1.00 13.61 N ATOM 2546 CA THR A 172 9.158 -12.240 -5.051 1.00 13.78 C ATOM 2547 C THR A 172 10.468 -12.839 -4.554 1.00 14.39 C ATOM 2548 O THR A 172 11.231 -12.196 -3.830 1.00 14.89 O ATOM 2549 CB THR A 172 9.306 -11.883 -6.549 1.00 13.53 C ATOM 2550 OG1 THR A 172 9.747 -13.023 -7.302 1.00 13.57 O ATOM 2551 CG2 THR A 172 10.282 -10.730 -6.752 1.00 13.88 C ATOM 0 H THR A 172 9.424 -10.905 -3.466 1.00 13.61 H new ATOM 0 HA THR A 172 8.351 -12.965 -4.946 1.00 13.78 H new ATOM 0 HB THR A 172 8.324 -11.574 -6.907 1.00 13.53 H new ATOM 0 HG1 THR A 172 9.833 -12.778 -8.247 1.00 13.57 H new ATOM 0 HG21 THR A 172 10.363 -10.505 -7.815 1.00 13.88 H new ATOM 0 HG22 THR A 172 9.920 -9.849 -6.221 1.00 13.88 H new ATOM 0 HG23 THR A 172 11.262 -11.010 -6.365 1.00 13.88 H new ATOM 2559 N SER A 173 10.707 -14.084 -4.931 1.00 14.50 N ATOM 2560 CA SER A 173 11.958 -14.755 -4.625 1.00 15.21 C ATOM 2561 C SER A 173 12.883 -14.694 -5.834 1.00 15.64 C ATOM 2562 O SER A 173 14.026 -15.151 -5.790 1.00 15.85 O ATOM 2563 CB SER A 173 11.705 -16.203 -4.203 1.00 15.46 C ATOM 2564 OG SER A 173 10.860 -16.254 -3.064 1.00 15.55 O ATOM 0 H SER A 173 10.043 -14.655 -5.455 1.00 14.50 H new ATOM 0 HA SER A 173 12.439 -14.245 -3.790 1.00 15.21 H new ATOM 0 HB2 SER A 173 11.248 -16.752 -5.026 1.00 15.46 H new ATOM 0 HB3 SER A 173 12.653 -16.693 -3.981 1.00 15.46 H new ATOM 0 HG SER A 173 10.709 -17.188 -2.811 1.00 15.55 H new ATOM 2570 N GLY A 174 12.370 -14.114 -6.911 1.00 15.94 N ATOM 2571 CA GLY A 174 13.178 -13.848 -8.080 1.00 16.51 C ATOM 2572 C GLY A 174 13.354 -12.360 -8.276 1.00 16.95 C ATOM 2573 O GLY A 174 13.176 -11.840 -9.379 1.00 17.54 O ATOM 0 H GLY A 174 11.397 -13.821 -6.993 1.00 15.94 H new ATOM 0 HA2 GLY A 174 14.153 -14.324 -7.971 1.00 16.51 H new ATOM 0 HA3 GLY A 174 12.707 -14.283 -8.961 1.00 16.51 H new ATOM 2577 N LEU A 175 13.685 -11.679 -7.183 1.00 16.81 N ATOM 2578 CA LEU A 175 13.833 -10.229 -7.172 1.00 17.34 C ATOM 2579 C LEU A 175 14.870 -9.799 -8.208 1.00 17.70 C ATOM 2580 O LEU A 175 15.780 -10.564 -8.533 1.00 17.85 O ATOM 2581 CB LEU A 175 14.218 -9.764 -5.750 1.00 17.29 C ATOM 2582 CG LEU A 175 14.014 -8.275 -5.409 1.00 17.29 C ATOM 2583 CD1 LEU A 175 15.161 -7.422 -5.925 1.00 17.42 C ATOM 2584 CD2 LEU A 175 12.685 -7.772 -5.954 1.00 17.14 C ATOM 0 H LEU A 175 13.858 -12.119 -6.279 1.00 16.81 H new ATOM 0 HA LEU A 175 12.888 -9.757 -7.440 1.00 17.34 H new ATOM 0 HB2 LEU A 175 13.644 -10.354 -5.036 1.00 17.29 H new ATOM 0 HB3 LEU A 175 15.269 -10.005 -5.590 1.00 17.29 H new ATOM 0 HG LEU A 175 13.998 -8.187 -4.323 1.00 17.29 H new ATOM 0 HD11 LEU A 175 14.983 -6.378 -5.666 1.00 17.42 H new ATOM 0 HD12 LEU A 175 16.095 -7.754 -5.471 1.00 17.42 H new ATOM 0 HD13 LEU A 175 15.229 -7.521 -7.008 1.00 17.42 H new ATOM 0 HD21 LEU A 175 12.563 -6.719 -5.701 1.00 17.14 H new ATOM 0 HD22 LEU A 175 12.668 -7.889 -7.038 1.00 17.14 H new ATOM 0 HD23 LEU A 175 11.870 -8.347 -5.514 1.00 17.14 H new ATOM 2596 N GLU A 176 14.711 -8.596 -8.741 1.00 17.97 N ATOM 2597 CA GLU A 176 15.642 -8.062 -9.728 1.00 18.46 C ATOM 2598 C GLU A 176 17.003 -7.773 -9.095 1.00 18.48 C ATOM 2599 O GLU A 176 17.338 -6.629 -8.793 1.00 18.35 O ATOM 2600 CB GLU A 176 15.066 -6.800 -10.365 1.00 18.91 C ATOM 2601 CG GLU A 176 13.781 -7.055 -11.134 1.00 19.00 C ATOM 2602 CD GLU A 176 13.070 -5.780 -11.518 1.00 19.35 C ATOM 2603 OE1 GLU A 176 13.526 -5.108 -12.464 1.00 19.67 O ATOM 2604 OE2 GLU A 176 12.051 -5.444 -10.883 1.00 19.40 O1- ATOM 0 H GLU A 176 13.943 -7.968 -8.506 1.00 17.97 H new ATOM 0 HA GLU A 176 15.787 -8.812 -10.506 1.00 18.46 H new ATOM 0 HB2 GLU A 176 14.876 -6.061 -9.586 1.00 18.91 H new ATOM 0 HB3 GLU A 176 15.807 -6.370 -11.039 1.00 18.91 H new ATOM 0 HG2 GLU A 176 14.008 -7.625 -12.035 1.00 19.00 H new ATOM 0 HG3 GLU A 176 13.115 -7.669 -10.528 1.00 19.00 H new ATOM 2611 N VAL A 177 17.763 -8.830 -8.879 1.00 18.75 N ATOM 2612 CA VAL A 177 19.097 -8.736 -8.321 1.00 18.92 C ATOM 2613 C VAL A 177 19.967 -9.836 -8.915 1.00 19.38 C ATOM 2614 O VAL A 177 19.554 -10.997 -8.988 1.00 19.52 O ATOM 2615 CB VAL A 177 19.073 -8.831 -6.774 1.00 18.88 C ATOM 2616 CG1 VAL A 177 18.356 -10.091 -6.304 1.00 19.38 C ATOM 2617 CG2 VAL A 177 20.482 -8.776 -6.205 1.00 18.51 C ATOM 0 H VAL A 177 17.469 -9.784 -9.088 1.00 18.75 H new ATOM 0 HA VAL A 177 19.516 -7.763 -8.577 1.00 18.92 H new ATOM 0 HB VAL A 177 18.517 -7.971 -6.402 1.00 18.88 H new ATOM 0 HG11 VAL A 177 18.358 -10.126 -5.215 1.00 19.38 H new ATOM 0 HG12 VAL A 177 17.328 -10.081 -6.665 1.00 19.38 H new ATOM 0 HG13 VAL A 177 18.869 -10.969 -6.696 1.00 19.38 H new ATOM 0 HG21 VAL A 177 20.438 -8.844 -5.118 1.00 18.51 H new ATOM 0 HG22 VAL A 177 21.066 -9.608 -6.598 1.00 18.51 H new ATOM 0 HG23 VAL A 177 20.953 -7.836 -6.491 1.00 18.51 H new ATOM 2627 N LEU A 178 21.154 -9.474 -9.366 1.00 19.73 N ATOM 2628 CA LEU A 178 22.013 -10.417 -10.058 1.00 20.29 C ATOM 2629 C LEU A 178 23.453 -10.289 -9.589 1.00 20.67 C ATOM 2630 O LEU A 178 23.922 -9.195 -9.261 1.00 20.64 O ATOM 2631 CB LEU A 178 21.931 -10.225 -11.583 1.00 20.68 C ATOM 2632 CG LEU A 178 22.294 -8.833 -12.123 1.00 20.91 C ATOM 2633 CD1 LEU A 178 22.618 -8.918 -13.605 1.00 20.95 C ATOM 2634 CD2 LEU A 178 21.156 -7.845 -11.905 1.00 21.15 C ATOM 0 H LEU A 178 21.544 -8.537 -9.266 1.00 19.73 H new ATOM 0 HA LEU A 178 21.660 -11.420 -9.818 1.00 20.29 H new ATOM 0 HB2 LEU A 178 22.589 -10.955 -12.054 1.00 20.68 H new ATOM 0 HB3 LEU A 178 20.915 -10.459 -11.902 1.00 20.68 H new ATOM 0 HG LEU A 178 23.168 -8.478 -11.577 1.00 20.91 H new ATOM 0 HD11 LEU A 178 22.874 -7.927 -13.979 1.00 20.95 H new ATOM 0 HD12 LEU A 178 23.462 -9.591 -13.755 1.00 20.95 H new ATOM 0 HD13 LEU A 178 21.751 -9.297 -14.146 1.00 20.95 H new ATOM 0 HD21 LEU A 178 21.442 -6.869 -12.297 1.00 21.15 H new ATOM 0 HD22 LEU A 178 20.264 -8.197 -12.423 1.00 21.15 H new ATOM 0 HD23 LEU A 178 20.947 -7.761 -10.839 1.00 21.15 H new ATOM 2646 N PHE A 179 24.143 -11.419 -9.549 1.00 21.16 N ATOM 2647 CA PHE A 179 25.537 -11.457 -9.149 1.00 21.69 C ATOM 2648 C PHE A 179 26.421 -10.898 -10.254 1.00 22.01 C ATOM 2649 O PHE A 179 26.111 -11.039 -11.437 1.00 22.11 O ATOM 2650 CB PHE A 179 25.966 -12.887 -8.811 1.00 22.17 C ATOM 2651 CG PHE A 179 25.349 -13.427 -7.552 1.00 22.45 C ATOM 2652 CD1 PHE A 179 25.918 -13.170 -6.314 1.00 22.88 C ATOM 2653 CD2 PHE A 179 24.196 -14.192 -7.608 1.00 22.38 C ATOM 2654 CE1 PHE A 179 25.347 -13.666 -5.157 1.00 23.25 C ATOM 2655 CE2 PHE A 179 23.620 -14.689 -6.455 1.00 22.75 C ATOM 2656 CZ PHE A 179 24.216 -14.428 -5.218 1.00 23.19 C ATOM 0 H PHE A 179 23.753 -12.330 -9.792 1.00 21.16 H new ATOM 0 HA PHE A 179 25.651 -10.840 -8.258 1.00 21.69 H new ATOM 0 HB2 PHE A 179 25.702 -13.541 -9.642 1.00 22.17 H new ATOM 0 HB3 PHE A 179 27.051 -12.917 -8.714 1.00 22.17 H new ATOM 0 HD1 PHE A 179 26.818 -12.576 -6.253 1.00 22.88 H new ATOM 0 HD2 PHE A 179 23.742 -14.403 -8.565 1.00 22.38 H new ATOM 0 HE1 PHE A 179 25.798 -13.450 -4.200 1.00 23.25 H new ATOM 0 HE2 PHE A 179 22.715 -15.276 -6.509 1.00 22.75 H new ATOM 0 HZ PHE A 179 23.783 -14.828 -4.313 1.00 23.19 H new ATOM 2666 N GLN A 180 27.502 -10.253 -9.862 1.00 22.29 N ATOM 2667 CA GLN A 180 28.460 -9.718 -10.809 1.00 22.74 C ATOM 2668 C GLN A 180 29.437 -10.806 -11.222 1.00 22.89 C ATOM 2669 O GLN A 180 30.433 -11.012 -10.500 1.00 22.88 O ATOM 2670 CB GLN A 180 29.211 -8.535 -10.196 1.00 23.08 C ATOM 2671 CG GLN A 180 28.334 -7.318 -9.947 1.00 23.17 C ATOM 2672 CD GLN A 180 29.053 -6.231 -9.173 1.00 23.36 C ATOM 2673 OE1 GLN A 180 29.003 -6.195 -7.944 1.00 23.45 O ATOM 2674 NE2 GLN A 180 29.734 -5.346 -9.880 1.00 23.52 N ATOM 2675 OXT GLN A 180 29.191 -11.471 -12.247 1.00 23.12 O ATOM 0 H GLN A 180 27.740 -10.086 -8.884 1.00 22.29 H new ATOM 0 HA GLN A 180 27.926 -9.366 -11.692 1.00 22.74 H new ATOM 0 HB2 GLN A 180 29.658 -8.849 -9.253 1.00 23.08 H new ATOM 0 HB3 GLN A 180 30.029 -8.253 -10.858 1.00 23.08 H new ATOM 0 HG2 GLN A 180 27.996 -6.916 -10.902 1.00 23.17 H new ATOM 0 HG3 GLN A 180 27.444 -7.623 -9.397 1.00 23.17 H new ATOM 0 HE21 GLN A 180 29.751 -5.410 -10.898 1.00 23.52 H new ATOM 0 HE22 GLN A 180 30.243 -4.599 -9.408 1.00 23.52 H new TER 2684 GLN A 180 HETATM 2685 AG AG A 200 -28.224 -2.196 -30.580 1.00 9.75 AG