USER MOD reduce.3.24.130724 H: found=0, std=0, add=783, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 780 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 95 HIS : no HD1:sc= 0.345 K(o=0.71,f=-3.9!) USER MOD Set 1.2: A 97 LYS NZ :NH3+ -171:sc= 0.367 (180deg=0) USER MOD Set 2.1: A 47 MET CE :methyl 162:sc= -0.0477 (180deg=-0.679) USER MOD Set 2.2: A 56 HIS : no HD1:sc= 1.26 K(o=1.2,f=-7.5!) USER MOD Set 3.1: A 14 GLN : amide:sc= 0.467 K(o=1.2,f=-0.88) USER MOD Set 3.2: A 17 THR OG1 : rot 142:sc= 0.693 USER MOD Set 4.1: A 2 SER OG : rot 180:sc= 0.663 USER MOD Set 4.2: A 5 SER OG : rot 180:sc= 0.312 USER MOD Single : A 1 GLY N :NH3+ -117:sc= 0.0958 (180deg=0) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= 1.22 K(o=1.2,f=-1.3!) USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ -148:sc= 1.32 (180deg=1.06) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 38 GLN : amide:sc= 0.973 K(o=0.97,f=0) USER MOD Single : A 44 ASN : amide:sc= 0.801 K(o=0.8,f=-0.67) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 HIS : no HD1:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 49 LYS NZ :NH3+ -166:sc= 2.46 (180deg=1.72) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 GLN : amide:sc= 0.784 K(o=0.78,f=-0.011) USER MOD Single : A 57 GLN : amide:sc= 0 X(o=0,f=-0.3) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 72 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 MET CE :methyl -145:sc= -0.134 (180deg=-1.99!) USER MOD Single : A 79 MET CE :methyl 145:sc= -0.546 (180deg=-2.45!) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot 30:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 176:sc= 1.12 (180deg=1.11) USER MOD Single : A 90 ASN : amide:sc= 0.374 X(o=0.37,f=-0.041) USER MOD Single : A 91 LYS NZ :NH3+ 176:sc= 3.32 (180deg=3.21) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 96 ASN : amide:sc= 0.358 K(o=0.36,f=-6.7!) USER MOD Single : A 98 ASN : amide:sc= 0.168 K(o=0.17,f=-2.7!) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -9.004 -9.455 17.916 1.00 0.00 N ATOM 2 CA GLY A 1 -7.691 -9.796 17.322 1.00 0.00 C ATOM 3 C GLY A 1 -6.972 -8.567 16.775 1.00 0.00 C ATOM 4 O GLY A 1 -7.499 -7.455 16.830 1.00 0.00 O ATOM 0 H1 GLY A 1 -8.995 -9.682 18.931 1.00 0.00 H new ATOM 0 H2 GLY A 1 -9.189 -8.439 17.790 1.00 0.00 H new ATOM 0 H3 GLY A 1 -9.751 -10.004 17.445 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -7.066 -10.275 18.076 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -7.834 -10.519 16.519 1.00 0.00 H new ATOM 10 N SER A 2 -5.764 -8.766 16.237 1.00 0.00 N ATOM 11 CA SER A 2 -4.902 -7.716 15.666 1.00 0.00 C ATOM 12 C SER A 2 -4.229 -8.169 14.366 1.00 0.00 C ATOM 13 O SER A 2 -3.876 -9.343 14.208 1.00 0.00 O ATOM 14 CB SER A 2 -3.827 -7.315 16.682 1.00 0.00 C ATOM 15 OG SER A 2 -3.005 -6.260 16.195 1.00 0.00 O ATOM 0 H SER A 2 -5.342 -9.693 16.183 1.00 0.00 H new ATOM 0 HA SER A 2 -5.538 -6.862 15.435 1.00 0.00 H new ATOM 0 HB2 SER A 2 -4.304 -7.004 17.612 1.00 0.00 H new ATOM 0 HB3 SER A 2 -3.207 -8.180 16.915 1.00 0.00 H new ATOM 0 HG SER A 2 -2.333 -6.031 16.870 1.00 0.00 H new ATOM 21 N SER A 3 -3.998 -7.216 13.462 1.00 0.00 N ATOM 22 CA SER A 3 -3.186 -7.355 12.240 1.00 0.00 C ATOM 23 C SER A 3 -2.112 -6.257 12.219 1.00 0.00 C ATOM 24 O SER A 3 -1.922 -5.557 11.223 1.00 0.00 O ATOM 25 CB SER A 3 -4.073 -7.323 10.984 1.00 0.00 C ATOM 26 OG SER A 3 -5.070 -8.337 11.021 1.00 0.00 O ATOM 0 H SER A 3 -4.388 -6.279 13.562 1.00 0.00 H new ATOM 0 HA SER A 3 -2.686 -8.324 12.241 1.00 0.00 H new ATOM 0 HB2 SER A 3 -4.550 -6.346 10.899 1.00 0.00 H new ATOM 0 HB3 SER A 3 -3.453 -7.453 10.097 1.00 0.00 H new ATOM 0 HG SER A 3 -5.617 -8.288 10.209 1.00 0.00 H new ATOM 32 N GLY A 4 -1.446 -6.052 13.363 1.00 0.00 N ATOM 33 CA GLY A 4 -0.590 -4.883 13.598 1.00 0.00 C ATOM 34 C GLY A 4 -1.436 -3.621 13.805 1.00 0.00 C ATOM 35 O GLY A 4 -1.088 -2.547 13.315 1.00 0.00 O ATOM 0 H GLY A 4 -1.486 -6.695 14.154 1.00 0.00 H new ATOM 0 HA2 GLY A 4 0.035 -5.055 14.474 1.00 0.00 H new ATOM 0 HA3 GLY A 4 0.081 -4.742 12.751 1.00 0.00 H new ATOM 39 N SER A 5 -2.597 -3.773 14.452 1.00 0.00 N ATOM 40 CA SER A 5 -3.636 -2.744 14.617 1.00 0.00 C ATOM 41 C SER A 5 -3.926 -2.419 16.089 1.00 0.00 C ATOM 42 O SER A 5 -4.163 -1.255 16.419 1.00 0.00 O ATOM 43 CB SER A 5 -4.910 -3.178 13.882 1.00 0.00 C ATOM 44 OG SER A 5 -5.279 -4.510 14.215 1.00 0.00 O ATOM 0 H SER A 5 -2.852 -4.655 14.896 1.00 0.00 H new ATOM 0 HA SER A 5 -3.260 -1.821 14.177 1.00 0.00 H new ATOM 0 HB2 SER A 5 -5.725 -2.500 14.135 1.00 0.00 H new ATOM 0 HB3 SER A 5 -4.754 -3.101 12.806 1.00 0.00 H new ATOM 0 HG SER A 5 -6.095 -4.754 13.731 1.00 0.00 H new ATOM 50 N SER A 6 -3.821 -3.401 16.993 1.00 0.00 N ATOM 51 CA SER A 6 -3.844 -3.183 18.456 1.00 0.00 C ATOM 52 C SER A 6 -2.495 -2.687 19.015 1.00 0.00 C ATOM 53 O SER A 6 -2.412 -2.291 20.180 1.00 0.00 O ATOM 54 CB SER A 6 -4.270 -4.461 19.190 1.00 0.00 C ATOM 55 OG SER A 6 -5.549 -4.902 18.759 1.00 0.00 O ATOM 0 H SER A 6 -3.716 -4.382 16.733 1.00 0.00 H new ATOM 0 HA SER A 6 -4.576 -2.395 18.633 1.00 0.00 H new ATOM 0 HB2 SER A 6 -3.534 -5.246 19.015 1.00 0.00 H new ATOM 0 HB3 SER A 6 -4.290 -4.277 20.264 1.00 0.00 H new ATOM 0 HG SER A 6 -5.793 -5.719 19.242 1.00 0.00 H new ATOM 61 N GLY A 7 -1.439 -2.690 18.195 1.00 0.00 N ATOM 62 CA GLY A 7 -0.119 -2.131 18.504 1.00 0.00 C ATOM 63 C GLY A 7 0.907 -2.362 17.378 1.00 0.00 C ATOM 64 O GLY A 7 0.637 -3.148 16.463 1.00 0.00 O ATOM 0 H GLY A 7 -1.482 -3.098 17.261 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -0.217 -1.061 18.686 1.00 0.00 H new ATOM 0 HA3 GLY A 7 0.253 -2.579 19.426 1.00 0.00 H new ATOM 68 N PRO A 8 2.060 -1.665 17.414 1.00 0.00 N ATOM 69 CA PRO A 8 3.031 -1.611 16.316 1.00 0.00 C ATOM 70 C PRO A 8 4.086 -2.732 16.346 1.00 0.00 C ATOM 71 O PRO A 8 4.187 -3.491 17.318 1.00 0.00 O ATOM 72 CB PRO A 8 3.690 -0.235 16.482 1.00 0.00 C ATOM 73 CG PRO A 8 3.744 -0.072 17.999 1.00 0.00 C ATOM 74 CD PRO A 8 2.424 -0.699 18.445 1.00 0.00 C ATOM 0 HA PRO A 8 2.535 -1.755 15.356 1.00 0.00 H new ATOM 0 HB2 PRO A 8 4.684 -0.205 16.036 1.00 0.00 H new ATOM 0 HB3 PRO A 8 3.105 0.554 16.010 1.00 0.00 H new ATOM 0 HG2 PRO A 8 4.603 -0.584 18.432 1.00 0.00 H new ATOM 0 HG3 PRO A 8 3.816 0.975 18.293 1.00 0.00 H new ATOM 0 HD2 PRO A 8 2.533 -1.187 19.414 1.00 0.00 H new ATOM 0 HD3 PRO A 8 1.651 0.061 18.556 1.00 0.00 H new ATOM 82 N ILE A 9 4.917 -2.800 15.300 1.00 0.00 N ATOM 83 CA ILE A 9 6.137 -3.629 15.248 1.00 0.00 C ATOM 84 C ILE A 9 7.350 -2.855 15.811 1.00 0.00 C ATOM 85 O ILE A 9 7.400 -1.625 15.758 1.00 0.00 O ATOM 86 CB ILE A 9 6.376 -4.175 13.813 1.00 0.00 C ATOM 87 CG1 ILE A 9 7.485 -5.247 13.694 1.00 0.00 C ATOM 88 CG2 ILE A 9 6.708 -3.059 12.804 1.00 0.00 C ATOM 89 CD1 ILE A 9 7.342 -6.443 14.641 1.00 0.00 C ATOM 0 H ILE A 9 4.760 -2.269 14.443 1.00 0.00 H new ATOM 0 HA ILE A 9 6.000 -4.500 15.889 1.00 0.00 H new ATOM 0 HB ILE A 9 5.421 -4.645 13.578 1.00 0.00 H new ATOM 0 HG12 ILE A 9 7.502 -5.616 12.669 1.00 0.00 H new ATOM 0 HG13 ILE A 9 8.449 -4.772 13.878 1.00 0.00 H new ATOM 0 HG21 ILE A 9 6.866 -3.495 11.818 1.00 0.00 H new ATOM 0 HG22 ILE A 9 5.881 -2.351 12.759 1.00 0.00 H new ATOM 0 HG23 ILE A 9 7.613 -2.540 13.120 1.00 0.00 H new ATOM 0 HD11 ILE A 9 8.168 -7.136 14.479 1.00 0.00 H new ATOM 0 HD12 ILE A 9 7.359 -6.094 15.673 1.00 0.00 H new ATOM 0 HD13 ILE A 9 6.398 -6.951 14.445 1.00 0.00 H new ATOM 101 N SER A 10 8.364 -3.571 16.306 1.00 0.00 N ATOM 102 CA SER A 10 9.639 -2.997 16.783 1.00 0.00 C ATOM 103 C SER A 10 10.564 -2.488 15.658 1.00 0.00 C ATOM 104 O SER A 10 11.595 -1.870 15.931 1.00 0.00 O ATOM 105 CB SER A 10 10.396 -4.036 17.622 1.00 0.00 C ATOM 106 OG SER A 10 9.565 -4.563 18.647 1.00 0.00 O ATOM 0 H SER A 10 8.327 -4.587 16.391 1.00 0.00 H new ATOM 0 HA SER A 10 9.367 -2.127 17.381 1.00 0.00 H new ATOM 0 HB2 SER A 10 10.744 -4.844 16.979 1.00 0.00 H new ATOM 0 HB3 SER A 10 11.280 -3.577 18.065 1.00 0.00 H new ATOM 0 HG SER A 10 10.067 -5.224 19.168 1.00 0.00 H new ATOM 112 N GLU A 11 10.224 -2.746 14.391 1.00 0.00 N ATOM 113 CA GLU A 11 11.010 -2.384 13.203 1.00 0.00 C ATOM 114 C GLU A 11 10.818 -0.901 12.827 1.00 0.00 C ATOM 115 O GLU A 11 10.041 -0.563 11.930 1.00 0.00 O ATOM 116 CB GLU A 11 10.663 -3.360 12.060 1.00 0.00 C ATOM 117 CG GLU A 11 11.559 -3.232 10.817 1.00 0.00 C ATOM 118 CD GLU A 11 13.023 -3.609 11.117 1.00 0.00 C ATOM 119 OE1 GLU A 11 13.820 -2.709 11.478 1.00 0.00 O ATOM 120 OE2 GLU A 11 13.387 -4.803 10.994 1.00 0.00 O ATOM 0 H GLU A 11 9.359 -3.232 14.154 1.00 0.00 H new ATOM 0 HA GLU A 11 12.074 -2.484 13.416 1.00 0.00 H new ATOM 0 HB2 GLU A 11 10.731 -4.380 12.438 1.00 0.00 H new ATOM 0 HB3 GLU A 11 9.627 -3.198 11.763 1.00 0.00 H new ATOM 0 HG2 GLU A 11 11.174 -3.875 10.025 1.00 0.00 H new ATOM 0 HG3 GLU A 11 11.518 -2.208 10.444 1.00 0.00 H new ATOM 127 N ARG A 12 11.526 -0.015 13.542 1.00 0.00 N ATOM 128 CA ARG A 12 11.612 1.445 13.331 1.00 0.00 C ATOM 129 C ARG A 12 10.243 2.129 13.159 1.00 0.00 C ATOM 130 O ARG A 12 9.609 2.473 14.157 1.00 0.00 O ATOM 131 CB ARG A 12 12.660 1.742 12.234 1.00 0.00 C ATOM 132 CG ARG A 12 13.032 3.232 12.135 1.00 0.00 C ATOM 133 CD ARG A 12 14.081 3.503 11.049 1.00 0.00 C ATOM 134 NE ARG A 12 15.397 2.915 11.377 1.00 0.00 N ATOM 135 CZ ARG A 12 16.463 2.886 10.596 1.00 0.00 C ATOM 136 NH1 ARG A 12 16.464 3.403 9.399 1.00 0.00 N ATOM 137 NH2 ARG A 12 17.568 2.330 11.009 1.00 0.00 N ATOM 0 H ARG A 12 12.092 -0.314 14.336 1.00 0.00 H new ATOM 0 HA ARG A 12 11.974 1.918 14.244 1.00 0.00 H new ATOM 0 HB2 ARG A 12 13.561 1.162 12.435 1.00 0.00 H new ATOM 0 HB3 ARG A 12 12.274 1.406 11.272 1.00 0.00 H new ATOM 0 HG2 ARG A 12 12.135 3.814 11.923 1.00 0.00 H new ATOM 0 HG3 ARG A 12 13.413 3.573 13.098 1.00 0.00 H new ATOM 0 HD2 ARG A 12 13.731 3.097 10.100 1.00 0.00 H new ATOM 0 HD3 ARG A 12 14.190 4.579 10.914 1.00 0.00 H new ATOM 0 HE ARG A 12 15.492 2.489 12.299 1.00 0.00 H new ATOM 0 HH11 ARG A 12 15.622 3.850 9.036 1.00 0.00 H new ATOM 0 HH12 ARG A 12 17.307 3.361 8.826 1.00 0.00 H new ATOM 0 HH21 ARG A 12 17.613 1.914 11.939 1.00 0.00 H new ATOM 0 HH22 ARG A 12 18.387 2.311 10.402 1.00 0.00 H new ATOM 151 N ASN A 13 9.790 2.318 11.917 1.00 0.00 N ATOM 152 CA ASN A 13 8.512 2.937 11.545 1.00 0.00 C ATOM 153 C ASN A 13 7.786 2.157 10.421 1.00 0.00 C ATOM 154 O ASN A 13 7.023 2.745 9.653 1.00 0.00 O ATOM 155 CB ASN A 13 8.751 4.424 11.192 1.00 0.00 C ATOM 156 CG ASN A 13 9.117 5.271 12.401 1.00 0.00 C ATOM 157 OD1 ASN A 13 10.279 5.524 12.688 1.00 0.00 O ATOM 158 ND2 ASN A 13 8.145 5.740 13.148 1.00 0.00 N ATOM 0 H ASN A 13 10.331 2.029 11.102 1.00 0.00 H new ATOM 0 HA ASN A 13 7.835 2.893 12.398 1.00 0.00 H new ATOM 0 HB2 ASN A 13 9.549 4.492 10.453 1.00 0.00 H new ATOM 0 HB3 ASN A 13 7.852 4.831 10.729 1.00 0.00 H new ATOM 0 HD21 ASN A 13 8.360 6.313 13.964 1.00 0.00 H new ATOM 0 HD22 ASN A 13 7.175 5.532 12.912 1.00 0.00 H new ATOM 165 N GLN A 14 8.002 0.838 10.294 1.00 0.00 N ATOM 166 CA GLN A 14 7.430 0.027 9.199 1.00 0.00 C ATOM 167 C GLN A 14 5.886 -0.022 9.209 1.00 0.00 C ATOM 168 O GLN A 14 5.267 -0.310 8.184 1.00 0.00 O ATOM 169 CB GLN A 14 8.056 -1.383 9.206 1.00 0.00 C ATOM 170 CG GLN A 14 8.050 -2.066 7.827 1.00 0.00 C ATOM 171 CD GLN A 14 8.896 -1.328 6.789 1.00 0.00 C ATOM 172 OE1 GLN A 14 8.395 -0.636 5.912 1.00 0.00 O ATOM 173 NE2 GLN A 14 10.208 -1.433 6.846 1.00 0.00 N ATOM 0 H GLN A 14 8.576 0.302 10.944 1.00 0.00 H new ATOM 0 HA GLN A 14 7.687 0.521 8.262 1.00 0.00 H new ATOM 0 HB2 GLN A 14 9.083 -1.314 9.563 1.00 0.00 H new ATOM 0 HB3 GLN A 14 7.514 -2.009 9.915 1.00 0.00 H new ATOM 0 HG2 GLN A 14 8.421 -3.085 7.931 1.00 0.00 H new ATOM 0 HG3 GLN A 14 7.023 -2.136 7.467 1.00 0.00 H new ATOM 0 HE21 GLN A 14 10.643 -2.005 7.570 1.00 0.00 H new ATOM 0 HE22 GLN A 14 10.789 -0.942 6.166 1.00 0.00 H new ATOM 182 N ASP A 15 5.248 0.333 10.330 1.00 0.00 N ATOM 183 CA ASP A 15 3.800 0.575 10.434 1.00 0.00 C ATOM 184 C ASP A 15 3.298 1.645 9.438 1.00 0.00 C ATOM 185 O ASP A 15 2.138 1.603 9.031 1.00 0.00 O ATOM 186 CB ASP A 15 3.469 1.048 11.860 1.00 0.00 C ATOM 187 CG ASP A 15 3.169 -0.099 12.826 1.00 0.00 C ATOM 188 OD1 ASP A 15 4.121 -0.746 13.317 1.00 0.00 O ATOM 189 OD2 ASP A 15 1.968 -0.325 13.102 1.00 0.00 O ATOM 0 H ASP A 15 5.736 0.464 11.216 1.00 0.00 H new ATOM 0 HA ASP A 15 3.301 -0.364 10.196 1.00 0.00 H new ATOM 0 HB2 ASP A 15 4.307 1.628 12.246 1.00 0.00 H new ATOM 0 HB3 ASP A 15 2.609 1.716 11.823 1.00 0.00 H new ATOM 194 N ALA A 16 4.149 2.590 9.024 1.00 0.00 N ATOM 195 CA ALA A 16 3.808 3.626 8.048 1.00 0.00 C ATOM 196 C ALA A 16 3.850 3.136 6.584 1.00 0.00 C ATOM 197 O ALA A 16 3.485 3.886 5.679 1.00 0.00 O ATOM 198 CB ALA A 16 4.710 4.841 8.293 1.00 0.00 C ATOM 0 H ALA A 16 5.108 2.656 9.364 1.00 0.00 H new ATOM 0 HA ALA A 16 2.767 3.911 8.197 1.00 0.00 H new ATOM 0 HB1 ALA A 16 4.469 5.624 7.574 1.00 0.00 H new ATOM 0 HB2 ALA A 16 4.549 5.215 9.304 1.00 0.00 H new ATOM 0 HB3 ALA A 16 5.754 4.549 8.176 1.00 0.00 H new ATOM 204 N THR A 17 4.252 1.886 6.330 1.00 0.00 N ATOM 205 CA THR A 17 4.198 1.254 5.002 1.00 0.00 C ATOM 206 C THR A 17 3.020 0.281 4.936 1.00 0.00 C ATOM 207 O THR A 17 2.822 -0.537 5.837 1.00 0.00 O ATOM 208 CB THR A 17 5.525 0.557 4.638 1.00 0.00 C ATOM 209 OG1 THR A 17 6.620 1.406 4.906 1.00 0.00 O ATOM 210 CG2 THR A 17 5.626 0.186 3.152 1.00 0.00 C ATOM 0 H THR A 17 4.631 1.273 7.052 1.00 0.00 H new ATOM 0 HA THR A 17 4.047 2.038 4.260 1.00 0.00 H new ATOM 0 HB THR A 17 5.546 -0.349 5.243 1.00 0.00 H new ATOM 0 HG1 THR A 17 7.366 0.877 5.258 1.00 0.00 H new ATOM 0 HG21 THR A 17 6.583 -0.301 2.963 1.00 0.00 H new ATOM 0 HG22 THR A 17 4.815 -0.494 2.891 1.00 0.00 H new ATOM 0 HG23 THR A 17 5.552 1.089 2.546 1.00 0.00 H new ATOM 218 N VAL A 18 2.238 0.344 3.857 1.00 0.00 N ATOM 219 CA VAL A 18 1.153 -0.605 3.551 1.00 0.00 C ATOM 220 C VAL A 18 1.573 -1.565 2.441 1.00 0.00 C ATOM 221 O VAL A 18 2.338 -1.196 1.551 1.00 0.00 O ATOM 222 CB VAL A 18 -0.186 0.092 3.224 1.00 0.00 C ATOM 223 CG1 VAL A 18 -0.583 1.068 4.334 1.00 0.00 C ATOM 224 CG2 VAL A 18 -0.183 0.882 1.916 1.00 0.00 C ATOM 0 H VAL A 18 2.340 1.073 3.151 1.00 0.00 H new ATOM 0 HA VAL A 18 0.974 -1.183 4.457 1.00 0.00 H new ATOM 0 HB VAL A 18 -0.897 -0.729 3.129 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -1.529 1.545 4.078 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -0.692 0.526 5.273 1.00 0.00 H new ATOM 0 HG13 VAL A 18 0.189 1.830 4.442 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -1.161 1.338 1.764 1.00 0.00 H new ATOM 0 HG22 VAL A 18 0.578 1.661 1.963 1.00 0.00 H new ATOM 0 HG23 VAL A 18 0.037 0.211 1.086 1.00 0.00 H new ATOM 234 N TYR A 19 1.058 -2.788 2.492 1.00 0.00 N ATOM 235 CA TYR A 19 1.135 -3.811 1.451 1.00 0.00 C ATOM 236 C TYR A 19 -0.137 -3.776 0.592 1.00 0.00 C ATOM 237 O TYR A 19 -1.237 -3.588 1.120 1.00 0.00 O ATOM 238 CB TYR A 19 1.309 -5.181 2.125 1.00 0.00 C ATOM 239 CG TYR A 19 1.063 -6.381 1.224 1.00 0.00 C ATOM 240 CD1 TYR A 19 -0.215 -6.976 1.182 1.00 0.00 C ATOM 241 CD2 TYR A 19 2.104 -6.903 0.433 1.00 0.00 C ATOM 242 CE1 TYR A 19 -0.448 -8.095 0.360 1.00 0.00 C ATOM 243 CE2 TYR A 19 1.879 -8.032 -0.377 1.00 0.00 C ATOM 244 CZ TYR A 19 0.601 -8.631 -0.417 1.00 0.00 C ATOM 245 OH TYR A 19 0.375 -9.726 -1.195 1.00 0.00 O ATOM 0 H TYR A 19 0.544 -3.114 3.311 1.00 0.00 H new ATOM 0 HA TYR A 19 1.986 -3.624 0.796 1.00 0.00 H new ATOM 0 HB2 TYR A 19 2.322 -5.247 2.522 1.00 0.00 H new ATOM 0 HB3 TYR A 19 0.629 -5.239 2.975 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -1.017 -6.572 1.782 1.00 0.00 H new ATOM 0 HD2 TYR A 19 3.078 -6.436 0.448 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -1.430 -8.543 0.324 1.00 0.00 H new ATOM 0 HE2 TYR A 19 2.685 -8.441 -0.969 1.00 0.00 H new ATOM 0 HH TYR A 19 1.199 -9.968 -1.667 1.00 0.00 H new ATOM 255 N VAL A 20 0.010 -4.007 -0.714 1.00 0.00 N ATOM 256 CA VAL A 20 -1.084 -4.155 -1.683 1.00 0.00 C ATOM 257 C VAL A 20 -0.842 -5.408 -2.529 1.00 0.00 C ATOM 258 O VAL A 20 0.084 -5.441 -3.337 1.00 0.00 O ATOM 259 CB VAL A 20 -1.217 -2.919 -2.597 1.00 0.00 C ATOM 260 CG1 VAL A 20 -2.489 -3.047 -3.445 1.00 0.00 C ATOM 261 CG2 VAL A 20 -1.286 -1.596 -1.822 1.00 0.00 C ATOM 0 H VAL A 20 0.930 -4.100 -1.145 1.00 0.00 H new ATOM 0 HA VAL A 20 -2.017 -4.250 -1.128 1.00 0.00 H new ATOM 0 HB VAL A 20 -0.321 -2.893 -3.217 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -2.585 -2.175 -4.091 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -2.429 -3.947 -4.057 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -3.358 -3.110 -2.790 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -1.379 -0.767 -2.524 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -2.151 -1.608 -1.158 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -0.378 -1.472 -1.232 1.00 0.00 H new ATOM 271 N GLY A 21 -1.674 -6.435 -2.366 1.00 0.00 N ATOM 272 CA GLY A 21 -1.624 -7.679 -3.141 1.00 0.00 C ATOM 273 C GLY A 21 -2.755 -7.781 -4.164 1.00 0.00 C ATOM 274 O GLY A 21 -3.854 -7.279 -3.933 1.00 0.00 O ATOM 0 H GLY A 21 -2.423 -6.427 -1.673 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -0.666 -7.743 -3.657 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -1.677 -8.529 -2.461 1.00 0.00 H new ATOM 278 N GLY A 22 -2.503 -8.460 -5.284 1.00 0.00 N ATOM 279 CA GLY A 22 -3.509 -8.755 -6.316 1.00 0.00 C ATOM 280 C GLY A 22 -3.588 -7.694 -7.418 1.00 0.00 C ATOM 281 O GLY A 22 -4.672 -7.388 -7.914 1.00 0.00 O ATOM 0 H GLY A 22 -1.579 -8.829 -5.507 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -3.281 -9.720 -6.768 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -4.486 -8.848 -5.842 1.00 0.00 H new ATOM 285 N LEU A 23 -2.445 -7.110 -7.784 1.00 0.00 N ATOM 286 CA LEU A 23 -2.322 -6.008 -8.734 1.00 0.00 C ATOM 287 C LEU A 23 -2.513 -6.492 -10.174 1.00 0.00 C ATOM 288 O LEU A 23 -2.175 -7.629 -10.516 1.00 0.00 O ATOM 289 CB LEU A 23 -0.942 -5.345 -8.570 1.00 0.00 C ATOM 290 CG LEU A 23 -0.663 -4.738 -7.185 1.00 0.00 C ATOM 291 CD1 LEU A 23 0.726 -4.112 -7.187 1.00 0.00 C ATOM 292 CD2 LEU A 23 -1.684 -3.669 -6.804 1.00 0.00 C ATOM 0 H LEU A 23 -1.544 -7.406 -7.410 1.00 0.00 H new ATOM 0 HA LEU A 23 -3.105 -5.279 -8.525 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -0.173 -6.087 -8.784 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -0.844 -4.559 -9.319 1.00 0.00 H new ATOM 0 HG LEU A 23 -0.732 -5.542 -6.453 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.931 -3.679 -6.208 1.00 0.00 H new ATOM 0 HD12 LEU A 23 1.470 -4.877 -7.409 1.00 0.00 H new ATOM 0 HD13 LEU A 23 0.772 -3.331 -7.946 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -1.444 -3.271 -5.818 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -1.657 -2.863 -7.537 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -2.681 -4.109 -6.785 1.00 0.00 H new ATOM 304 N ASP A 24 -3.025 -5.613 -11.028 1.00 0.00 N ATOM 305 CA ASP A 24 -3.170 -5.863 -12.462 1.00 0.00 C ATOM 306 C ASP A 24 -1.909 -5.445 -13.247 1.00 0.00 C ATOM 307 O ASP A 24 -1.145 -4.587 -12.804 1.00 0.00 O ATOM 308 CB ASP A 24 -4.434 -5.143 -12.955 1.00 0.00 C ATOM 309 CG ASP A 24 -4.678 -5.359 -14.451 1.00 0.00 C ATOM 310 OD1 ASP A 24 -5.275 -6.391 -14.828 1.00 0.00 O ATOM 311 OD2 ASP A 24 -4.240 -4.503 -15.254 1.00 0.00 O ATOM 0 H ASP A 24 -3.357 -4.692 -10.742 1.00 0.00 H new ATOM 0 HA ASP A 24 -3.280 -6.933 -12.639 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -5.296 -5.501 -12.393 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -4.343 -4.076 -12.754 1.00 0.00 H new ATOM 316 N GLU A 25 -1.683 -6.013 -14.434 1.00 0.00 N ATOM 317 CA GLU A 25 -0.521 -5.701 -15.287 1.00 0.00 C ATOM 318 C GLU A 25 -0.404 -4.215 -15.699 1.00 0.00 C ATOM 319 O GLU A 25 0.695 -3.762 -16.033 1.00 0.00 O ATOM 320 CB GLU A 25 -0.515 -6.624 -16.518 1.00 0.00 C ATOM 321 CG GLU A 25 -1.697 -6.409 -17.476 1.00 0.00 C ATOM 322 CD GLU A 25 -1.613 -7.375 -18.674 1.00 0.00 C ATOM 323 OE1 GLU A 25 -1.032 -7.002 -19.723 1.00 0.00 O ATOM 324 OE2 GLU A 25 -2.131 -8.516 -18.580 1.00 0.00 O ATOM 0 H GLU A 25 -2.306 -6.711 -14.840 1.00 0.00 H new ATOM 0 HA GLU A 25 0.363 -5.888 -14.678 1.00 0.00 H new ATOM 0 HB2 GLU A 25 0.414 -6.472 -17.067 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -0.520 -7.660 -16.180 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -2.635 -6.564 -16.943 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -1.699 -5.379 -17.833 1.00 0.00 H new ATOM 331 N LYS A 26 -1.498 -3.440 -15.638 1.00 0.00 N ATOM 332 CA LYS A 26 -1.514 -1.987 -15.895 1.00 0.00 C ATOM 333 C LYS A 26 -1.076 -1.129 -14.693 1.00 0.00 C ATOM 334 O LYS A 26 -0.820 0.063 -14.863 1.00 0.00 O ATOM 335 CB LYS A 26 -2.907 -1.576 -16.405 1.00 0.00 C ATOM 336 CG LYS A 26 -3.220 -2.218 -17.767 1.00 0.00 C ATOM 337 CD LYS A 26 -4.585 -1.802 -18.337 1.00 0.00 C ATOM 338 CE LYS A 26 -5.795 -2.218 -17.486 1.00 0.00 C ATOM 339 NZ LYS A 26 -5.886 -3.691 -17.309 1.00 0.00 N ATOM 0 H LYS A 26 -2.418 -3.812 -15.403 1.00 0.00 H new ATOM 0 HA LYS A 26 -0.764 -1.789 -16.661 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -3.664 -1.873 -15.679 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -2.958 -0.491 -16.493 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -2.439 -1.945 -18.477 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -3.193 -3.303 -17.664 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -4.598 -0.719 -18.456 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -4.694 -2.233 -19.332 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -5.729 -1.741 -16.508 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -6.709 -1.855 -17.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -6.885 -3.971 -17.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -5.449 -4.166 -18.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -5.388 -3.968 -16.439 1.00 0.00 H new ATOM 353 N VAL A 27 -0.961 -1.707 -13.493 1.00 0.00 N ATOM 354 CA VAL A 27 -0.490 -1.011 -12.278 1.00 0.00 C ATOM 355 C VAL A 27 1.019 -0.736 -12.348 1.00 0.00 C ATOM 356 O VAL A 27 1.797 -1.615 -12.720 1.00 0.00 O ATOM 357 CB VAL A 27 -0.837 -1.810 -11.004 1.00 0.00 C ATOM 358 CG1 VAL A 27 -0.332 -1.118 -9.732 1.00 0.00 C ATOM 359 CG2 VAL A 27 -2.356 -2.002 -10.855 1.00 0.00 C ATOM 0 H VAL A 27 -1.195 -2.686 -13.330 1.00 0.00 H new ATOM 0 HA VAL A 27 -1.009 -0.054 -12.228 1.00 0.00 H new ATOM 0 HB VAL A 27 -0.342 -2.774 -11.119 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -0.599 -1.717 -8.861 1.00 0.00 H new ATOM 0 HG12 VAL A 27 0.752 -1.013 -9.781 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -0.789 -0.132 -9.648 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -2.564 -2.569 -9.947 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.842 -1.028 -10.794 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -2.740 -2.546 -11.718 1.00 0.00 H new ATOM 369 N SER A 28 1.431 0.471 -11.940 1.00 0.00 N ATOM 370 CA SER A 28 2.845 0.869 -11.776 1.00 0.00 C ATOM 371 C SER A 28 3.071 1.610 -10.450 1.00 0.00 C ATOM 372 O SER A 28 2.124 2.108 -9.845 1.00 0.00 O ATOM 373 CB SER A 28 3.292 1.757 -12.947 1.00 0.00 C ATOM 374 OG SER A 28 3.185 1.087 -14.193 1.00 0.00 O ATOM 0 H SER A 28 0.779 1.220 -11.708 1.00 0.00 H new ATOM 0 HA SER A 28 3.442 -0.043 -11.765 1.00 0.00 H new ATOM 0 HB2 SER A 28 2.684 2.662 -12.968 1.00 0.00 H new ATOM 0 HB3 SER A 28 4.324 2.070 -12.791 1.00 0.00 H new ATOM 0 HG SER A 28 3.477 1.685 -14.912 1.00 0.00 H new ATOM 380 N GLU A 29 4.321 1.745 -9.998 1.00 0.00 N ATOM 381 CA GLU A 29 4.646 2.452 -8.744 1.00 0.00 C ATOM 382 C GLU A 29 4.121 3.908 -8.692 1.00 0.00 C ATOM 383 O GLU A 29 3.517 4.266 -7.678 1.00 0.00 O ATOM 384 CB GLU A 29 6.167 2.395 -8.490 1.00 0.00 C ATOM 385 CG GLU A 29 6.580 1.120 -7.742 1.00 0.00 C ATOM 386 CD GLU A 29 7.890 0.496 -8.262 1.00 0.00 C ATOM 387 OE1 GLU A 29 8.797 0.212 -7.446 1.00 0.00 O ATOM 388 OE2 GLU A 29 7.992 0.205 -9.479 1.00 0.00 O ATOM 0 H GLU A 29 5.136 1.371 -10.484 1.00 0.00 H new ATOM 0 HA GLU A 29 4.122 1.931 -7.943 1.00 0.00 H new ATOM 0 HB2 GLU A 29 6.695 2.443 -9.442 1.00 0.00 H new ATOM 0 HB3 GLU A 29 6.471 3.268 -7.912 1.00 0.00 H new ATOM 0 HG2 GLU A 29 6.693 1.351 -6.683 1.00 0.00 H new ATOM 0 HG3 GLU A 29 5.779 0.385 -7.825 1.00 0.00 H new ATOM 395 N PRO A 30 4.221 4.735 -9.759 1.00 0.00 N ATOM 396 CA PRO A 30 3.612 6.069 -9.775 1.00 0.00 C ATOM 397 C PRO A 30 2.084 6.062 -9.608 1.00 0.00 C ATOM 398 O PRO A 30 1.535 7.006 -9.034 1.00 0.00 O ATOM 399 CB PRO A 30 4.019 6.695 -11.113 1.00 0.00 C ATOM 400 CG PRO A 30 5.327 5.984 -11.446 1.00 0.00 C ATOM 401 CD PRO A 30 5.060 4.571 -10.938 1.00 0.00 C ATOM 0 HA PRO A 30 3.968 6.643 -8.919 1.00 0.00 H new ATOM 0 HB2 PRO A 30 3.264 6.530 -11.881 1.00 0.00 H new ATOM 0 HB3 PRO A 30 4.157 7.773 -11.028 1.00 0.00 H new ATOM 0 HG2 PRO A 30 5.539 6.000 -12.515 1.00 0.00 H new ATOM 0 HG3 PRO A 30 6.180 6.443 -10.945 1.00 0.00 H new ATOM 0 HD2 PRO A 30 4.559 3.969 -11.696 1.00 0.00 H new ATOM 0 HD3 PRO A 30 5.991 4.060 -10.690 1.00 0.00 H new ATOM 409 N LEU A 31 1.391 4.996 -10.038 1.00 0.00 N ATOM 410 CA LEU A 31 -0.041 4.830 -9.778 1.00 0.00 C ATOM 411 C LEU A 31 -0.281 4.594 -8.288 1.00 0.00 C ATOM 412 O LEU A 31 -1.077 5.300 -7.680 1.00 0.00 O ATOM 413 CB LEU A 31 -0.619 3.662 -10.599 1.00 0.00 C ATOM 414 CG LEU A 31 -2.144 3.504 -10.448 1.00 0.00 C ATOM 415 CD1 LEU A 31 -2.873 4.616 -11.188 1.00 0.00 C ATOM 416 CD2 LEU A 31 -2.565 2.167 -11.044 1.00 0.00 C ATOM 0 H LEU A 31 1.807 4.232 -10.571 1.00 0.00 H new ATOM 0 HA LEU A 31 -0.550 5.745 -10.081 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -0.379 3.814 -11.651 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -0.133 2.736 -10.292 1.00 0.00 H new ATOM 0 HG LEU A 31 -2.398 3.552 -9.389 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -3.949 4.487 -11.070 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -2.576 5.581 -10.778 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -2.617 4.577 -12.247 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -3.643 2.046 -10.942 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -2.295 2.138 -12.100 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -2.058 1.358 -10.518 1.00 0.00 H new ATOM 428 N LEU A 32 0.437 3.640 -7.689 1.00 0.00 N ATOM 429 CA LEU A 32 0.305 3.344 -6.259 1.00 0.00 C ATOM 430 C LEU A 32 0.686 4.529 -5.368 1.00 0.00 C ATOM 431 O LEU A 32 0.240 4.606 -4.231 1.00 0.00 O ATOM 432 CB LEU A 32 1.165 2.137 -5.859 1.00 0.00 C ATOM 433 CG LEU A 32 0.867 0.823 -6.582 1.00 0.00 C ATOM 434 CD1 LEU A 32 1.564 -0.309 -5.836 1.00 0.00 C ATOM 435 CD2 LEU A 32 -0.625 0.510 -6.611 1.00 0.00 C ATOM 0 H LEU A 32 1.119 3.057 -8.174 1.00 0.00 H new ATOM 0 HA LEU A 32 -0.751 3.121 -6.103 1.00 0.00 H new ATOM 0 HB2 LEU A 32 2.211 2.391 -6.029 1.00 0.00 H new ATOM 0 HB3 LEU A 32 1.047 1.973 -4.788 1.00 0.00 H new ATOM 0 HG LEU A 32 1.222 0.919 -7.608 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.362 -1.255 -6.339 1.00 0.00 H new ATOM 0 HD12 LEU A 32 2.639 -0.128 -5.822 1.00 0.00 H new ATOM 0 HD13 LEU A 32 1.190 -0.355 -4.813 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -0.789 -0.432 -7.134 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -1.000 0.428 -5.591 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -1.155 1.310 -7.129 1.00 0.00 H new ATOM 447 N TRP A 33 1.480 5.465 -5.877 1.00 0.00 N ATOM 448 CA TRP A 33 1.744 6.737 -5.214 1.00 0.00 C ATOM 449 C TRP A 33 0.535 7.671 -5.320 1.00 0.00 C ATOM 450 O TRP A 33 -0.122 7.964 -4.322 1.00 0.00 O ATOM 451 CB TRP A 33 3.021 7.348 -5.799 1.00 0.00 C ATOM 452 CG TRP A 33 3.699 8.407 -4.988 1.00 0.00 C ATOM 453 CD1 TRP A 33 3.129 9.454 -4.348 1.00 0.00 C ATOM 454 CD2 TRP A 33 5.129 8.525 -4.746 1.00 0.00 C ATOM 455 NE1 TRP A 33 4.111 10.195 -3.710 1.00 0.00 N ATOM 456 CE2 TRP A 33 5.367 9.671 -3.933 1.00 0.00 C ATOM 457 CE3 TRP A 33 6.245 7.767 -5.150 1.00 0.00 C ATOM 458 CZ2 TRP A 33 6.658 10.048 -3.540 1.00 0.00 C ATOM 459 CZ3 TRP A 33 7.548 8.137 -4.765 1.00 0.00 C ATOM 460 CH2 TRP A 33 7.755 9.276 -3.965 1.00 0.00 C ATOM 0 H TRP A 33 1.963 5.361 -6.769 1.00 0.00 H new ATOM 0 HA TRP A 33 1.905 6.576 -4.148 1.00 0.00 H new ATOM 0 HB2 TRP A 33 3.735 6.542 -5.969 1.00 0.00 H new ATOM 0 HB3 TRP A 33 2.779 7.771 -6.774 1.00 0.00 H new ATOM 0 HD1 TRP A 33 2.072 9.678 -4.336 1.00 0.00 H new ATOM 0 HE1 TRP A 33 3.928 11.025 -3.146 1.00 0.00 H new ATOM 0 HE3 TRP A 33 6.100 6.890 -5.763 1.00 0.00 H new ATOM 0 HZ2 TRP A 33 6.809 10.919 -2.920 1.00 0.00 H new ATOM 0 HZ3 TRP A 33 8.392 7.544 -5.085 1.00 0.00 H new ATOM 0 HH2 TRP A 33 8.757 9.558 -3.677 1.00 0.00 H new ATOM 471 N GLU A 34 0.213 8.122 -6.534 1.00 0.00 N ATOM 472 CA GLU A 34 -0.808 9.155 -6.774 1.00 0.00 C ATOM 473 C GLU A 34 -2.238 8.732 -6.403 1.00 0.00 C ATOM 474 O GLU A 34 -3.035 9.570 -5.978 1.00 0.00 O ATOM 475 CB GLU A 34 -0.764 9.605 -8.243 1.00 0.00 C ATOM 476 CG GLU A 34 0.541 10.343 -8.556 1.00 0.00 C ATOM 477 CD GLU A 34 0.470 11.047 -9.925 1.00 0.00 C ATOM 478 OE1 GLU A 34 0.071 12.236 -9.980 1.00 0.00 O ATOM 479 OE2 GLU A 34 0.817 10.423 -10.960 1.00 0.00 O ATOM 0 H GLU A 34 0.655 7.781 -7.388 1.00 0.00 H new ATOM 0 HA GLU A 34 -0.556 9.981 -6.109 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -0.860 8.737 -8.895 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -1.613 10.256 -8.452 1.00 0.00 H new ATOM 0 HG2 GLU A 34 0.742 11.078 -7.776 1.00 0.00 H new ATOM 0 HG3 GLU A 34 1.371 9.637 -8.550 1.00 0.00 H new ATOM 486 N LEU A 35 -2.559 7.440 -6.501 1.00 0.00 N ATOM 487 CA LEU A 35 -3.854 6.892 -6.080 1.00 0.00 C ATOM 488 C LEU A 35 -4.016 6.934 -4.550 1.00 0.00 C ATOM 489 O LEU A 35 -5.115 7.169 -4.052 1.00 0.00 O ATOM 490 CB LEU A 35 -3.988 5.444 -6.599 1.00 0.00 C ATOM 491 CG LEU A 35 -5.432 4.925 -6.665 1.00 0.00 C ATOM 492 CD1 LEU A 35 -6.176 5.465 -7.887 1.00 0.00 C ATOM 493 CD2 LEU A 35 -5.445 3.398 -6.711 1.00 0.00 C ATOM 0 H LEU A 35 -1.923 6.737 -6.878 1.00 0.00 H new ATOM 0 HA LEU A 35 -4.646 7.508 -6.506 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -3.548 5.386 -7.594 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -3.407 4.785 -5.954 1.00 0.00 H new ATOM 0 HG LEU A 35 -5.940 5.277 -5.767 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -7.193 5.074 -7.896 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -6.206 6.554 -7.843 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -5.659 5.153 -8.795 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -6.475 3.044 -6.758 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -4.904 3.056 -7.593 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -4.966 3.003 -5.815 1.00 0.00 H new ATOM 505 N PHE A 36 -2.931 6.729 -3.798 1.00 0.00 N ATOM 506 CA PHE A 36 -2.927 6.615 -2.335 1.00 0.00 C ATOM 507 C PHE A 36 -2.753 7.963 -1.617 1.00 0.00 C ATOM 508 O PHE A 36 -3.032 8.050 -0.420 1.00 0.00 O ATOM 509 CB PHE A 36 -1.872 5.584 -1.921 1.00 0.00 C ATOM 510 CG PHE A 36 -2.328 4.133 -2.024 1.00 0.00 C ATOM 511 CD1 PHE A 36 -2.489 3.512 -3.279 1.00 0.00 C ATOM 512 CD2 PHE A 36 -2.594 3.390 -0.857 1.00 0.00 C ATOM 513 CE1 PHE A 36 -2.921 2.175 -3.367 1.00 0.00 C ATOM 514 CE2 PHE A 36 -3.040 2.058 -0.941 1.00 0.00 C ATOM 515 CZ PHE A 36 -3.213 1.453 -2.198 1.00 0.00 C ATOM 0 H PHE A 36 -2.000 6.635 -4.203 1.00 0.00 H new ATOM 0 HA PHE A 36 -3.910 6.269 -2.016 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -0.988 5.718 -2.544 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -1.571 5.784 -0.893 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -2.279 4.067 -4.181 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -2.454 3.847 0.111 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -3.028 1.704 -4.333 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -3.249 1.501 -0.040 1.00 0.00 H new ATOM 0 HZ PHE A 36 -3.569 0.436 -2.265 1.00 0.00 H new ATOM 525 N LEU A 37 -2.407 9.038 -2.340 1.00 0.00 N ATOM 526 CA LEU A 37 -2.422 10.423 -1.837 1.00 0.00 C ATOM 527 C LEU A 37 -3.783 10.861 -1.252 1.00 0.00 C ATOM 528 O LEU A 37 -3.854 11.804 -0.462 1.00 0.00 O ATOM 529 CB LEU A 37 -2.010 11.376 -2.976 1.00 0.00 C ATOM 530 CG LEU A 37 -0.517 11.373 -3.341 1.00 0.00 C ATOM 531 CD1 LEU A 37 -0.260 12.365 -4.475 1.00 0.00 C ATOM 532 CD2 LEU A 37 0.364 11.777 -2.159 1.00 0.00 C ATOM 0 H LEU A 37 -2.102 8.969 -3.311 1.00 0.00 H new ATOM 0 HA LEU A 37 -1.712 10.468 -1.011 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -2.583 11.117 -3.866 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -2.295 12.390 -2.697 1.00 0.00 H new ATOM 0 HG LEU A 37 -0.265 10.356 -3.640 1.00 0.00 H new ATOM 0 HD11 LEU A 37 0.800 12.359 -4.730 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -0.845 12.078 -5.349 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -0.551 13.366 -4.156 1.00 0.00 H new ATOM 0 HD21 LEU A 37 1.411 11.761 -2.463 1.00 0.00 H new ATOM 0 HD22 LEU A 37 0.096 12.782 -1.833 1.00 0.00 H new ATOM 0 HD23 LEU A 37 0.214 11.077 -1.337 1.00 0.00 H new ATOM 544 N GLN A 38 -4.859 10.157 -1.613 1.00 0.00 N ATOM 545 CA GLN A 38 -6.214 10.334 -1.071 1.00 0.00 C ATOM 546 C GLN A 38 -6.312 9.950 0.414 1.00 0.00 C ATOM 547 O GLN A 38 -7.103 10.539 1.155 1.00 0.00 O ATOM 548 CB GLN A 38 -7.213 9.480 -1.870 1.00 0.00 C ATOM 549 CG GLN A 38 -7.138 9.759 -3.372 1.00 0.00 C ATOM 550 CD GLN A 38 -8.180 8.967 -4.158 1.00 0.00 C ATOM 551 OE1 GLN A 38 -9.304 9.403 -4.379 1.00 0.00 O ATOM 552 NE2 GLN A 38 -7.854 7.770 -4.595 1.00 0.00 N ATOM 0 H GLN A 38 -4.811 9.420 -2.317 1.00 0.00 H new ATOM 0 HA GLN A 38 -6.453 11.394 -1.160 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -7.013 8.424 -1.688 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -8.224 9.679 -1.515 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -7.284 10.824 -3.550 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -6.142 9.508 -3.737 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -6.921 7.398 -4.416 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -8.534 7.213 -5.113 1.00 0.00 H new ATOM 561 N ALA A 39 -5.509 8.975 0.857 1.00 0.00 N ATOM 562 CA ALA A 39 -5.447 8.563 2.258 1.00 0.00 C ATOM 563 C ALA A 39 -4.637 9.550 3.119 1.00 0.00 C ATOM 564 O ALA A 39 -5.076 9.953 4.198 1.00 0.00 O ATOM 565 CB ALA A 39 -4.831 7.167 2.328 1.00 0.00 C ATOM 0 H ALA A 39 -4.882 8.449 0.248 1.00 0.00 H new ATOM 0 HA ALA A 39 -6.459 8.553 2.662 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -4.778 6.845 3.368 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.448 6.468 1.763 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -3.827 7.190 1.903 1.00 0.00 H new ATOM 571 N GLY A 40 -3.463 9.947 2.626 1.00 0.00 N ATOM 572 CA GLY A 40 -2.542 10.878 3.277 1.00 0.00 C ATOM 573 C GLY A 40 -1.268 11.118 2.452 1.00 0.00 C ATOM 574 O GLY A 40 -1.169 10.633 1.323 1.00 0.00 O ATOM 0 H GLY A 40 -3.115 9.615 1.727 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -3.048 11.829 3.443 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -2.268 10.488 4.257 1.00 0.00 H new ATOM 578 N PRO A 41 -0.278 11.850 2.988 1.00 0.00 N ATOM 579 CA PRO A 41 0.971 12.155 2.291 1.00 0.00 C ATOM 580 C PRO A 41 1.819 10.893 2.062 1.00 0.00 C ATOM 581 O PRO A 41 2.349 10.297 3.004 1.00 0.00 O ATOM 582 CB PRO A 41 1.679 13.198 3.166 1.00 0.00 C ATOM 583 CG PRO A 41 1.130 12.920 4.564 1.00 0.00 C ATOM 584 CD PRO A 41 -0.307 12.484 4.295 1.00 0.00 C ATOM 0 HA PRO A 41 0.794 12.545 1.289 1.00 0.00 H new ATOM 0 HB2 PRO A 41 2.762 13.084 3.130 1.00 0.00 H new ATOM 0 HB3 PRO A 41 1.455 14.214 2.841 1.00 0.00 H new ATOM 0 HG2 PRO A 41 1.699 12.141 5.072 1.00 0.00 H new ATOM 0 HG3 PRO A 41 1.170 13.807 5.196 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -0.657 11.791 5.060 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -0.985 13.338 4.303 1.00 0.00 H new ATOM 592 N VAL A 42 1.962 10.504 0.791 1.00 0.00 N ATOM 593 CA VAL A 42 2.820 9.396 0.338 1.00 0.00 C ATOM 594 C VAL A 42 4.242 9.909 0.090 1.00 0.00 C ATOM 595 O VAL A 42 4.446 10.955 -0.532 1.00 0.00 O ATOM 596 CB VAL A 42 2.254 8.699 -0.915 1.00 0.00 C ATOM 597 CG1 VAL A 42 3.166 7.559 -1.387 1.00 0.00 C ATOM 598 CG2 VAL A 42 0.865 8.101 -0.661 1.00 0.00 C ATOM 0 H VAL A 42 1.471 10.963 0.024 1.00 0.00 H new ATOM 0 HA VAL A 42 2.845 8.645 1.127 1.00 0.00 H new ATOM 0 HB VAL A 42 2.191 9.474 -1.679 1.00 0.00 H new ATOM 0 HG11 VAL A 42 2.735 7.091 -2.272 1.00 0.00 H new ATOM 0 HG12 VAL A 42 4.151 7.958 -1.631 1.00 0.00 H new ATOM 0 HG13 VAL A 42 3.261 6.817 -0.594 1.00 0.00 H new ATOM 0 HG21 VAL A 42 0.504 7.620 -1.570 1.00 0.00 H new ATOM 0 HG22 VAL A 42 0.927 7.364 0.140 1.00 0.00 H new ATOM 0 HG23 VAL A 42 0.175 8.894 -0.372 1.00 0.00 H new ATOM 608 N VAL A 43 5.219 9.153 0.585 1.00 0.00 N ATOM 609 CA VAL A 43 6.652 9.493 0.634 1.00 0.00 C ATOM 610 C VAL A 43 7.472 8.651 -0.350 1.00 0.00 C ATOM 611 O VAL A 43 8.473 9.129 -0.886 1.00 0.00 O ATOM 612 CB VAL A 43 7.184 9.273 2.070 1.00 0.00 C ATOM 613 CG1 VAL A 43 8.561 9.905 2.294 1.00 0.00 C ATOM 614 CG2 VAL A 43 6.263 9.863 3.141 1.00 0.00 C ATOM 0 H VAL A 43 5.029 8.235 0.987 1.00 0.00 H new ATOM 0 HA VAL A 43 6.758 10.539 0.347 1.00 0.00 H new ATOM 0 HB VAL A 43 7.238 8.188 2.165 1.00 0.00 H new ATOM 0 HG11 VAL A 43 8.884 9.719 3.318 1.00 0.00 H new ATOM 0 HG12 VAL A 43 9.280 9.467 1.601 1.00 0.00 H new ATOM 0 HG13 VAL A 43 8.500 10.980 2.122 1.00 0.00 H new ATOM 0 HG21 VAL A 43 6.687 9.678 4.128 1.00 0.00 H new ATOM 0 HG22 VAL A 43 6.164 10.937 2.984 1.00 0.00 H new ATOM 0 HG23 VAL A 43 5.281 9.394 3.075 1.00 0.00 H new ATOM 624 N ASN A 44 7.068 7.393 -0.564 1.00 0.00 N ATOM 625 CA ASN A 44 7.764 6.395 -1.382 1.00 0.00 C ATOM 626 C ASN A 44 6.805 5.244 -1.794 1.00 0.00 C ATOM 627 O ASN A 44 5.750 5.051 -1.185 1.00 0.00 O ATOM 628 CB ASN A 44 8.985 5.921 -0.560 1.00 0.00 C ATOM 629 CG ASN A 44 9.735 4.739 -1.144 1.00 0.00 C ATOM 630 OD1 ASN A 44 10.109 4.730 -2.308 1.00 0.00 O ATOM 631 ND2 ASN A 44 9.967 3.710 -0.361 1.00 0.00 N ATOM 0 H ASN A 44 6.209 7.028 -0.153 1.00 0.00 H new ATOM 0 HA ASN A 44 8.110 6.815 -2.326 1.00 0.00 H new ATOM 0 HB2 ASN A 44 9.679 6.755 -0.455 1.00 0.00 H new ATOM 0 HB3 ASN A 44 8.648 5.658 0.443 1.00 0.00 H new ATOM 0 HD21 ASN A 44 10.463 2.895 -0.723 1.00 0.00 H new ATOM 0 HD22 ASN A 44 9.652 3.726 0.609 1.00 0.00 H new ATOM 638 N THR A 45 7.183 4.455 -2.801 1.00 0.00 N ATOM 639 CA THR A 45 6.486 3.237 -3.273 1.00 0.00 C ATOM 640 C THR A 45 7.482 2.132 -3.637 1.00 0.00 C ATOM 641 O THR A 45 8.621 2.420 -4.012 1.00 0.00 O ATOM 642 CB THR A 45 5.614 3.497 -4.516 1.00 0.00 C ATOM 643 OG1 THR A 45 6.257 4.352 -5.439 1.00 0.00 O ATOM 644 CG2 THR A 45 4.261 4.104 -4.170 1.00 0.00 C ATOM 0 H THR A 45 8.025 4.650 -3.343 1.00 0.00 H new ATOM 0 HA THR A 45 5.851 2.928 -2.443 1.00 0.00 H new ATOM 0 HB THR A 45 5.458 2.515 -4.964 1.00 0.00 H new ATOM 0 HG1 THR A 45 5.675 4.493 -6.215 1.00 0.00 H new ATOM 0 HG21 THR A 45 3.690 4.265 -5.084 1.00 0.00 H new ATOM 0 HG22 THR A 45 3.714 3.425 -3.516 1.00 0.00 H new ATOM 0 HG23 THR A 45 4.409 5.057 -3.662 1.00 0.00 H new ATOM 652 N HIS A 46 7.057 0.865 -3.574 1.00 0.00 N ATOM 653 CA HIS A 46 7.873 -0.283 -3.985 1.00 0.00 C ATOM 654 C HIS A 46 7.018 -1.348 -4.682 1.00 0.00 C ATOM 655 O HIS A 46 5.975 -1.726 -4.160 1.00 0.00 O ATOM 656 CB HIS A 46 8.576 -0.875 -2.748 1.00 0.00 C ATOM 657 CG HIS A 46 9.776 -1.709 -3.118 1.00 0.00 C ATOM 658 ND1 HIS A 46 9.731 -2.995 -3.664 1.00 0.00 N ATOM 659 CD2 HIS A 46 11.079 -1.317 -3.022 1.00 0.00 C ATOM 660 CE1 HIS A 46 11.009 -3.351 -3.877 1.00 0.00 C ATOM 661 NE2 HIS A 46 11.839 -2.363 -3.500 1.00 0.00 N ATOM 0 H HIS A 46 6.131 0.606 -3.234 1.00 0.00 H new ATOM 0 HA HIS A 46 8.622 0.055 -4.701 1.00 0.00 H new ATOM 0 HB2 HIS A 46 8.888 -0.066 -2.088 1.00 0.00 H new ATOM 0 HB3 HIS A 46 7.869 -1.488 -2.189 1.00 0.00 H new ATOM 0 HD2 HIS A 46 11.444 -0.373 -2.645 1.00 0.00 H new ATOM 0 HE1 HIS A 46 11.325 -4.297 -4.292 1.00 0.00 H new ATOM 0 HE2 HIS A 46 12.857 -2.384 -3.558 1.00 0.00 H new ATOM 669 N MET A 47 7.441 -1.861 -5.836 1.00 0.00 N ATOM 670 CA MET A 47 6.832 -3.034 -6.485 1.00 0.00 C ATOM 671 C MET A 47 7.933 -4.007 -6.931 1.00 0.00 C ATOM 672 O MET A 47 8.623 -3.715 -7.913 1.00 0.00 O ATOM 673 CB MET A 47 5.945 -2.617 -7.670 1.00 0.00 C ATOM 674 CG MET A 47 4.619 -2.006 -7.200 1.00 0.00 C ATOM 675 SD MET A 47 3.575 -1.284 -8.493 1.00 0.00 S ATOM 676 CE MET A 47 3.271 -2.754 -9.489 1.00 0.00 C ATOM 0 H MET A 47 8.226 -1.473 -6.358 1.00 0.00 H new ATOM 0 HA MET A 47 6.188 -3.538 -5.764 1.00 0.00 H new ATOM 0 HB2 MET A 47 6.479 -1.895 -8.288 1.00 0.00 H new ATOM 0 HB3 MET A 47 5.743 -3.486 -8.297 1.00 0.00 H new ATOM 0 HG2 MET A 47 4.047 -2.780 -6.688 1.00 0.00 H new ATOM 0 HG3 MET A 47 4.839 -1.233 -6.464 1.00 0.00 H new ATOM 0 HE1 MET A 47 2.408 -2.585 -10.133 1.00 0.00 H new ATOM 0 HE2 MET A 47 4.146 -2.965 -10.103 1.00 0.00 H new ATOM 0 HE3 MET A 47 3.074 -3.603 -8.834 1.00 0.00 H new ATOM 686 N PRO A 48 8.117 -5.154 -6.251 1.00 0.00 N ATOM 687 CA PRO A 48 9.105 -6.165 -6.633 1.00 0.00 C ATOM 688 C PRO A 48 8.905 -6.694 -8.063 1.00 0.00 C ATOM 689 O PRO A 48 7.769 -6.889 -8.511 1.00 0.00 O ATOM 690 CB PRO A 48 8.988 -7.266 -5.573 1.00 0.00 C ATOM 691 CG PRO A 48 8.518 -6.493 -4.341 1.00 0.00 C ATOM 692 CD PRO A 48 7.551 -5.480 -4.947 1.00 0.00 C ATOM 0 HA PRO A 48 10.109 -5.741 -6.659 1.00 0.00 H new ATOM 0 HB2 PRO A 48 8.274 -8.036 -5.865 1.00 0.00 H new ATOM 0 HB3 PRO A 48 9.942 -7.765 -5.399 1.00 0.00 H new ATOM 0 HG2 PRO A 48 8.027 -7.142 -3.616 1.00 0.00 H new ATOM 0 HG3 PRO A 48 9.346 -6.007 -3.825 1.00 0.00 H new ATOM 0 HD2 PRO A 48 6.550 -5.899 -5.045 1.00 0.00 H new ATOM 0 HD3 PRO A 48 7.465 -4.592 -4.321 1.00 0.00 H new ATOM 700 N LYS A 49 10.013 -6.908 -8.789 1.00 0.00 N ATOM 701 CA LYS A 49 10.036 -7.278 -10.217 1.00 0.00 C ATOM 702 C LYS A 49 10.564 -8.697 -10.455 1.00 0.00 C ATOM 703 O LYS A 49 11.481 -9.163 -9.777 1.00 0.00 O ATOM 704 CB LYS A 49 10.870 -6.273 -11.040 1.00 0.00 C ATOM 705 CG LYS A 49 10.506 -4.784 -10.900 1.00 0.00 C ATOM 706 CD LYS A 49 9.038 -4.457 -11.220 1.00 0.00 C ATOM 707 CE LYS A 49 8.770 -2.948 -11.360 1.00 0.00 C ATOM 708 NZ LYS A 49 9.215 -2.175 -10.171 1.00 0.00 N ATOM 0 H LYS A 49 10.948 -6.826 -8.388 1.00 0.00 H new ATOM 0 HA LYS A 49 8.999 -7.249 -10.551 1.00 0.00 H new ATOM 0 HB2 LYS A 49 11.917 -6.394 -10.762 1.00 0.00 H new ATOM 0 HB3 LYS A 49 10.786 -6.545 -12.092 1.00 0.00 H new ATOM 0 HG2 LYS A 49 10.723 -4.463 -9.881 1.00 0.00 H new ATOM 0 HG3 LYS A 49 11.148 -4.202 -11.561 1.00 0.00 H new ATOM 0 HD2 LYS A 49 8.755 -4.957 -12.146 1.00 0.00 H new ATOM 0 HD3 LYS A 49 8.402 -4.861 -10.432 1.00 0.00 H new ATOM 0 HE2 LYS A 49 9.283 -2.572 -12.245 1.00 0.00 H new ATOM 0 HE3 LYS A 49 7.704 -2.785 -11.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 8.807 -1.219 -10.206 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 8.897 -2.656 -9.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 10.253 -2.108 -10.169 1.00 0.00 H new ATOM 722 N ASP A 50 10.019 -9.360 -11.472 1.00 0.00 N ATOM 723 CA ASP A 50 10.490 -10.643 -12.001 1.00 0.00 C ATOM 724 C ASP A 50 11.882 -10.511 -12.659 1.00 0.00 C ATOM 725 O ASP A 50 12.149 -9.546 -13.379 1.00 0.00 O ATOM 726 CB ASP A 50 9.441 -11.156 -13.000 1.00 0.00 C ATOM 727 CG ASP A 50 9.841 -12.512 -13.591 1.00 0.00 C ATOM 728 OD1 ASP A 50 10.681 -12.519 -14.518 1.00 0.00 O ATOM 729 OD2 ASP A 50 9.364 -13.560 -13.092 1.00 0.00 O ATOM 0 H ASP A 50 9.204 -9.006 -11.972 1.00 0.00 H new ATOM 0 HA ASP A 50 10.608 -11.358 -11.186 1.00 0.00 H new ATOM 0 HB2 ASP A 50 8.476 -11.246 -12.501 1.00 0.00 H new ATOM 0 HB3 ASP A 50 9.318 -10.430 -13.804 1.00 0.00 H new ATOM 734 N ARG A 51 12.772 -11.489 -12.441 1.00 0.00 N ATOM 735 CA ARG A 51 14.182 -11.450 -12.888 1.00 0.00 C ATOM 736 C ARG A 51 14.437 -11.867 -14.351 1.00 0.00 C ATOM 737 O ARG A 51 15.598 -11.967 -14.754 1.00 0.00 O ATOM 738 CB ARG A 51 15.071 -12.204 -11.878 1.00 0.00 C ATOM 739 CG ARG A 51 14.864 -13.728 -11.875 1.00 0.00 C ATOM 740 CD ARG A 51 15.756 -14.397 -10.821 1.00 0.00 C ATOM 741 NE ARG A 51 15.593 -15.866 -10.828 1.00 0.00 N ATOM 742 CZ ARG A 51 14.718 -16.584 -10.143 1.00 0.00 C ATOM 743 NH1 ARG A 51 13.849 -16.042 -9.336 1.00 0.00 N ATOM 744 NH2 ARG A 51 14.698 -17.880 -10.260 1.00 0.00 N ATOM 0 H ARG A 51 12.534 -12.346 -11.941 1.00 0.00 H new ATOM 0 HA ARG A 51 14.465 -10.397 -12.899 1.00 0.00 H new ATOM 0 HB2 ARG A 51 16.117 -11.991 -12.100 1.00 0.00 H new ATOM 0 HB3 ARG A 51 14.873 -11.819 -10.878 1.00 0.00 H new ATOM 0 HG2 ARG A 51 13.818 -13.957 -11.671 1.00 0.00 H new ATOM 0 HG3 ARG A 51 15.092 -14.133 -12.861 1.00 0.00 H new ATOM 0 HD2 ARG A 51 16.799 -14.145 -11.012 1.00 0.00 H new ATOM 0 HD3 ARG A 51 15.509 -14.007 -9.833 1.00 0.00 H new ATOM 0 HE ARG A 51 16.229 -16.387 -11.431 1.00 0.00 H new ATOM 0 HH11 ARG A 51 13.828 -15.029 -9.215 1.00 0.00 H new ATOM 0 HH12 ARG A 51 13.191 -16.631 -8.826 1.00 0.00 H new ATOM 0 HH21 ARG A 51 15.359 -18.346 -10.882 1.00 0.00 H new ATOM 0 HH22 ARG A 51 14.022 -18.430 -9.730 1.00 0.00 H new ATOM 758 N VAL A 52 13.391 -12.121 -15.142 1.00 0.00 N ATOM 759 CA VAL A 52 13.464 -12.651 -16.520 1.00 0.00 C ATOM 760 C VAL A 52 12.595 -11.829 -17.479 1.00 0.00 C ATOM 761 O VAL A 52 13.016 -11.555 -18.604 1.00 0.00 O ATOM 762 CB VAL A 52 13.039 -14.139 -16.568 1.00 0.00 C ATOM 763 CG1 VAL A 52 13.279 -14.750 -17.955 1.00 0.00 C ATOM 764 CG2 VAL A 52 13.803 -15.002 -15.553 1.00 0.00 C ATOM 0 H VAL A 52 12.432 -11.960 -14.836 1.00 0.00 H new ATOM 0 HA VAL A 52 14.503 -12.574 -16.841 1.00 0.00 H new ATOM 0 HB VAL A 52 11.976 -14.140 -16.325 1.00 0.00 H new ATOM 0 HG11 VAL A 52 12.969 -15.795 -17.951 1.00 0.00 H new ATOM 0 HG12 VAL A 52 12.700 -14.203 -18.699 1.00 0.00 H new ATOM 0 HG13 VAL A 52 14.339 -14.687 -18.202 1.00 0.00 H new ATOM 0 HG21 VAL A 52 13.467 -16.036 -15.629 1.00 0.00 H new ATOM 0 HG22 VAL A 52 14.871 -14.952 -15.764 1.00 0.00 H new ATOM 0 HG23 VAL A 52 13.614 -14.632 -14.545 1.00 0.00 H new ATOM 774 N THR A 53 11.411 -11.389 -17.036 1.00 0.00 N ATOM 775 CA THR A 53 10.462 -10.587 -17.829 1.00 0.00 C ATOM 776 C THR A 53 10.429 -9.125 -17.389 1.00 0.00 C ATOM 777 O THR A 53 9.930 -8.263 -18.116 1.00 0.00 O ATOM 778 CB THR A 53 9.034 -11.158 -17.770 1.00 0.00 C ATOM 779 OG1 THR A 53 8.494 -10.993 -16.474 1.00 0.00 O ATOM 780 CG2 THR A 53 8.967 -12.642 -18.134 1.00 0.00 C ATOM 0 H THR A 53 11.075 -11.584 -16.093 1.00 0.00 H new ATOM 0 HA THR A 53 10.825 -10.637 -18.856 1.00 0.00 H new ATOM 0 HB THR A 53 8.456 -10.602 -18.508 1.00 0.00 H new ATOM 0 HG1 THR A 53 7.585 -11.359 -16.449 1.00 0.00 H new ATOM 0 HG21 THR A 53 7.934 -12.985 -18.074 1.00 0.00 H new ATOM 0 HG22 THR A 53 9.338 -12.785 -19.149 1.00 0.00 H new ATOM 0 HG23 THR A 53 9.581 -13.215 -17.439 1.00 0.00 H new ATOM 788 N GLY A 54 10.949 -8.836 -16.191 1.00 0.00 N ATOM 789 CA GLY A 54 11.047 -7.493 -15.627 1.00 0.00 C ATOM 790 C GLY A 54 9.713 -6.868 -15.188 1.00 0.00 C ATOM 791 O GLY A 54 9.690 -5.712 -14.762 1.00 0.00 O ATOM 0 H GLY A 54 11.323 -9.555 -15.572 1.00 0.00 H new ATOM 0 HA2 GLY A 54 11.715 -7.526 -14.766 1.00 0.00 H new ATOM 0 HA3 GLY A 54 11.510 -6.839 -16.366 1.00 0.00 H new ATOM 795 N GLN A 55 8.604 -7.609 -15.285 1.00 0.00 N ATOM 796 CA GLN A 55 7.265 -7.168 -14.873 1.00 0.00 C ATOM 797 C GLN A 55 7.087 -7.299 -13.350 1.00 0.00 C ATOM 798 O GLN A 55 7.851 -8.009 -12.693 1.00 0.00 O ATOM 799 CB GLN A 55 6.188 -7.963 -15.636 1.00 0.00 C ATOM 800 CG GLN A 55 6.375 -8.005 -17.165 1.00 0.00 C ATOM 801 CD GLN A 55 6.573 -6.626 -17.795 1.00 0.00 C ATOM 802 OE1 GLN A 55 5.687 -5.781 -17.802 1.00 0.00 O ATOM 803 NE2 GLN A 55 7.739 -6.337 -18.337 1.00 0.00 N ATOM 0 H GLN A 55 8.612 -8.557 -15.662 1.00 0.00 H new ATOM 0 HA GLN A 55 7.151 -6.113 -15.123 1.00 0.00 H new ATOM 0 HB2 GLN A 55 6.175 -8.985 -15.258 1.00 0.00 H new ATOM 0 HB3 GLN A 55 5.213 -7.529 -15.416 1.00 0.00 H new ATOM 0 HG2 GLN A 55 7.236 -8.630 -17.400 1.00 0.00 H new ATOM 0 HG3 GLN A 55 5.504 -8.480 -17.616 1.00 0.00 H new ATOM 0 HE21 GLN A 55 8.487 -7.031 -18.339 1.00 0.00 H new ATOM 0 HE22 GLN A 55 7.894 -5.419 -18.755 1.00 0.00 H new ATOM 812 N HIS A 56 6.089 -6.631 -12.760 1.00 0.00 N ATOM 813 CA HIS A 56 5.832 -6.744 -11.316 1.00 0.00 C ATOM 814 C HIS A 56 5.305 -8.135 -10.915 1.00 0.00 C ATOM 815 O HIS A 56 4.689 -8.843 -11.715 1.00 0.00 O ATOM 816 CB HIS A 56 4.943 -5.596 -10.815 1.00 0.00 C ATOM 817 CG HIS A 56 3.482 -5.691 -11.188 1.00 0.00 C ATOM 818 ND1 HIS A 56 2.565 -6.579 -10.618 1.00 0.00 N ATOM 819 CD2 HIS A 56 2.819 -4.866 -12.050 1.00 0.00 C ATOM 820 CE1 HIS A 56 1.376 -6.282 -11.167 1.00 0.00 C ATOM 821 NE2 HIS A 56 1.497 -5.249 -12.015 1.00 0.00 N ATOM 0 H HIS A 56 5.449 -6.010 -13.255 1.00 0.00 H new ATOM 0 HA HIS A 56 6.791 -6.643 -10.808 1.00 0.00 H new ATOM 0 HB2 HIS A 56 5.020 -5.548 -9.729 1.00 0.00 H new ATOM 0 HB3 HIS A 56 5.339 -4.658 -11.204 1.00 0.00 H new ATOM 0 HD2 HIS A 56 3.247 -4.070 -12.642 1.00 0.00 H new ATOM 0 HE1 HIS A 56 0.453 -6.801 -10.956 1.00 0.00 H new ATOM 0 HE2 HIS A 56 0.738 -4.820 -12.544 1.00 0.00 H new ATOM 829 N GLN A 57 5.556 -8.532 -9.664 1.00 0.00 N ATOM 830 CA GLN A 57 5.253 -9.874 -9.139 1.00 0.00 C ATOM 831 C GLN A 57 3.802 -10.043 -8.624 1.00 0.00 C ATOM 832 O GLN A 57 3.507 -10.984 -7.884 1.00 0.00 O ATOM 833 CB GLN A 57 6.319 -10.266 -8.097 1.00 0.00 C ATOM 834 CG GLN A 57 7.713 -10.423 -8.730 1.00 0.00 C ATOM 835 CD GLN A 57 8.758 -10.853 -7.703 1.00 0.00 C ATOM 836 OE1 GLN A 57 9.534 -10.058 -7.193 1.00 0.00 O ATOM 837 NE2 GLN A 57 8.821 -12.122 -7.353 1.00 0.00 N ATOM 0 H GLN A 57 5.985 -7.919 -8.970 1.00 0.00 H new ATOM 0 HA GLN A 57 5.303 -10.575 -9.973 1.00 0.00 H new ATOM 0 HB2 GLN A 57 6.359 -9.507 -7.316 1.00 0.00 H new ATOM 0 HB3 GLN A 57 6.031 -11.202 -7.618 1.00 0.00 H new ATOM 0 HG2 GLN A 57 7.667 -11.160 -9.532 1.00 0.00 H new ATOM 0 HG3 GLN A 57 8.015 -9.478 -9.182 1.00 0.00 H new ATOM 0 HE21 GLN A 57 8.181 -12.798 -7.769 1.00 0.00 H new ATOM 0 HE22 GLN A 57 9.510 -12.428 -6.666 1.00 0.00 H new ATOM 846 N GLY A 58 2.882 -9.144 -8.997 1.00 0.00 N ATOM 847 CA GLY A 58 1.467 -9.165 -8.593 1.00 0.00 C ATOM 848 C GLY A 58 1.160 -8.449 -7.270 1.00 0.00 C ATOM 849 O GLY A 58 0.003 -8.428 -6.846 1.00 0.00 O ATOM 0 H GLY A 58 3.107 -8.358 -9.607 1.00 0.00 H new ATOM 0 HA2 GLY A 58 0.872 -8.707 -9.383 1.00 0.00 H new ATOM 0 HA3 GLY A 58 1.143 -10.203 -8.511 1.00 0.00 H new ATOM 853 N TYR A 59 2.163 -7.852 -6.620 1.00 0.00 N ATOM 854 CA TYR A 59 2.022 -7.099 -5.370 1.00 0.00 C ATOM 855 C TYR A 59 2.980 -5.898 -5.292 1.00 0.00 C ATOM 856 O TYR A 59 3.969 -5.810 -6.027 1.00 0.00 O ATOM 857 CB TYR A 59 2.197 -8.038 -4.165 1.00 0.00 C ATOM 858 CG TYR A 59 3.588 -8.620 -3.988 1.00 0.00 C ATOM 859 CD1 TYR A 59 4.496 -8.031 -3.085 1.00 0.00 C ATOM 860 CD2 TYR A 59 3.963 -9.769 -4.710 1.00 0.00 C ATOM 861 CE1 TYR A 59 5.770 -8.599 -2.894 1.00 0.00 C ATOM 862 CE2 TYR A 59 5.247 -10.323 -4.543 1.00 0.00 C ATOM 863 CZ TYR A 59 6.154 -9.741 -3.632 1.00 0.00 C ATOM 864 OH TYR A 59 7.387 -10.293 -3.463 1.00 0.00 O ATOM 0 H TYR A 59 3.125 -7.880 -6.959 1.00 0.00 H new ATOM 0 HA TYR A 59 1.015 -6.683 -5.348 1.00 0.00 H new ATOM 0 HB2 TYR A 59 1.932 -7.492 -3.259 1.00 0.00 H new ATOM 0 HB3 TYR A 59 1.487 -8.860 -4.261 1.00 0.00 H new ATOM 0 HD1 TYR A 59 4.214 -7.143 -2.539 1.00 0.00 H new ATOM 0 HD2 TYR A 59 3.264 -10.227 -5.394 1.00 0.00 H new ATOM 0 HE1 TYR A 59 6.455 -8.161 -2.183 1.00 0.00 H new ATOM 0 HE2 TYR A 59 5.538 -11.194 -5.112 1.00 0.00 H new ATOM 0 HH TYR A 59 7.480 -11.072 -4.050 1.00 0.00 H new ATOM 874 N GLY A 60 2.665 -4.963 -4.396 1.00 0.00 N ATOM 875 CA GLY A 60 3.384 -3.713 -4.173 1.00 0.00 C ATOM 876 C GLY A 60 3.224 -3.175 -2.749 1.00 0.00 C ATOM 877 O GLY A 60 2.576 -3.787 -1.897 1.00 0.00 O ATOM 0 H GLY A 60 1.861 -5.064 -3.776 1.00 0.00 H new ATOM 0 HA2 GLY A 60 4.443 -3.868 -4.380 1.00 0.00 H new ATOM 0 HA3 GLY A 60 3.027 -2.964 -4.880 1.00 0.00 H new ATOM 881 N PHE A 61 3.814 -2.008 -2.504 1.00 0.00 N ATOM 882 CA PHE A 61 3.839 -1.310 -1.221 1.00 0.00 C ATOM 883 C PHE A 61 3.765 0.212 -1.405 1.00 0.00 C ATOM 884 O PHE A 61 4.274 0.754 -2.394 1.00 0.00 O ATOM 885 CB PHE A 61 5.124 -1.646 -0.448 1.00 0.00 C ATOM 886 CG PHE A 61 5.373 -3.115 -0.155 1.00 0.00 C ATOM 887 CD1 PHE A 61 6.081 -3.910 -1.077 1.00 0.00 C ATOM 888 CD2 PHE A 61 4.936 -3.675 1.060 1.00 0.00 C ATOM 889 CE1 PHE A 61 6.347 -5.260 -0.788 1.00 0.00 C ATOM 890 CE2 PHE A 61 5.213 -5.023 1.355 1.00 0.00 C ATOM 891 CZ PHE A 61 5.915 -5.816 0.430 1.00 0.00 C ATOM 0 H PHE A 61 4.313 -1.497 -3.232 1.00 0.00 H new ATOM 0 HA PHE A 61 2.966 -1.644 -0.660 1.00 0.00 H new ATOM 0 HB2 PHE A 61 5.973 -1.262 -1.014 1.00 0.00 H new ATOM 0 HB3 PHE A 61 5.103 -1.108 0.500 1.00 0.00 H new ATOM 0 HD1 PHE A 61 6.420 -3.482 -2.008 1.00 0.00 H new ATOM 0 HD2 PHE A 61 4.388 -3.070 1.767 1.00 0.00 H new ATOM 0 HE1 PHE A 61 6.883 -5.870 -1.501 1.00 0.00 H new ATOM 0 HE2 PHE A 61 4.886 -5.449 2.292 1.00 0.00 H new ATOM 0 HZ PHE A 61 6.123 -6.852 0.655 1.00 0.00 H new ATOM 901 N VAL A 62 3.193 0.907 -0.417 1.00 0.00 N ATOM 902 CA VAL A 62 3.099 2.377 -0.365 1.00 0.00 C ATOM 903 C VAL A 62 3.532 2.871 1.015 1.00 0.00 C ATOM 904 O VAL A 62 3.063 2.364 2.031 1.00 0.00 O ATOM 905 CB VAL A 62 1.677 2.878 -0.698 1.00 0.00 C ATOM 906 CG1 VAL A 62 1.656 4.400 -0.851 1.00 0.00 C ATOM 907 CG2 VAL A 62 1.128 2.251 -1.983 1.00 0.00 C ATOM 0 H VAL A 62 2.770 0.454 0.393 1.00 0.00 H new ATOM 0 HA VAL A 62 3.767 2.784 -1.124 1.00 0.00 H new ATOM 0 HB VAL A 62 1.044 2.577 0.137 1.00 0.00 H new ATOM 0 HG11 VAL A 62 0.643 4.728 -1.085 1.00 0.00 H new ATOM 0 HG12 VAL A 62 1.981 4.864 0.080 1.00 0.00 H new ATOM 0 HG13 VAL A 62 2.328 4.694 -1.657 1.00 0.00 H new ATOM 0 HG21 VAL A 62 0.126 2.634 -2.175 1.00 0.00 H new ATOM 0 HG22 VAL A 62 1.780 2.504 -2.819 1.00 0.00 H new ATOM 0 HG23 VAL A 62 1.087 1.168 -1.870 1.00 0.00 H new ATOM 917 N GLU A 63 4.429 3.851 1.064 1.00 0.00 N ATOM 918 CA GLU A 63 5.003 4.399 2.296 1.00 0.00 C ATOM 919 C GLU A 63 4.427 5.788 2.587 1.00 0.00 C ATOM 920 O GLU A 63 4.594 6.716 1.796 1.00 0.00 O ATOM 921 CB GLU A 63 6.527 4.442 2.142 1.00 0.00 C ATOM 922 CG GLU A 63 7.270 4.814 3.433 1.00 0.00 C ATOM 923 CD GLU A 63 8.804 4.802 3.248 1.00 0.00 C ATOM 924 OE1 GLU A 63 9.334 4.039 2.400 1.00 0.00 O ATOM 925 OE2 GLU A 63 9.499 5.572 3.954 1.00 0.00 O ATOM 0 H GLU A 63 4.790 4.302 0.223 1.00 0.00 H new ATOM 0 HA GLU A 63 4.747 3.765 3.145 1.00 0.00 H new ATOM 0 HB2 GLU A 63 6.876 3.467 1.801 1.00 0.00 H new ATOM 0 HB3 GLU A 63 6.784 5.162 1.365 1.00 0.00 H new ATOM 0 HG2 GLU A 63 6.953 5.804 3.760 1.00 0.00 H new ATOM 0 HG3 GLU A 63 6.996 4.114 4.223 1.00 0.00 H new ATOM 932 N PHE A 64 3.768 5.940 3.732 1.00 0.00 N ATOM 933 CA PHE A 64 3.197 7.198 4.209 1.00 0.00 C ATOM 934 C PHE A 64 4.127 7.931 5.181 1.00 0.00 C ATOM 935 O PHE A 64 5.046 7.346 5.761 1.00 0.00 O ATOM 936 CB PHE A 64 1.833 6.924 4.852 1.00 0.00 C ATOM 937 CG PHE A 64 0.767 6.577 3.839 1.00 0.00 C ATOM 938 CD1 PHE A 64 0.060 7.616 3.209 1.00 0.00 C ATOM 939 CD2 PHE A 64 0.509 5.236 3.492 1.00 0.00 C ATOM 940 CE1 PHE A 64 -0.921 7.315 2.252 1.00 0.00 C ATOM 941 CE2 PHE A 64 -0.474 4.938 2.532 1.00 0.00 C ATOM 942 CZ PHE A 64 -1.193 5.980 1.921 1.00 0.00 C ATOM 0 H PHE A 64 3.611 5.165 4.376 1.00 0.00 H new ATOM 0 HA PHE A 64 3.070 7.859 3.352 1.00 0.00 H new ATOM 0 HB2 PHE A 64 1.930 6.105 5.565 1.00 0.00 H new ATOM 0 HB3 PHE A 64 1.519 7.802 5.416 1.00 0.00 H new ATOM 0 HD1 PHE A 64 0.272 8.645 3.461 1.00 0.00 H new ATOM 0 HD2 PHE A 64 1.065 4.439 3.962 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -1.467 8.112 1.770 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -0.676 3.911 2.265 1.00 0.00 H new ATOM 0 HZ PHE A 64 -1.958 5.751 1.194 1.00 0.00 H new ATOM 952 N LEU A 65 3.864 9.225 5.382 1.00 0.00 N ATOM 953 CA LEU A 65 4.610 10.054 6.333 1.00 0.00 C ATOM 954 C LEU A 65 4.428 9.582 7.788 1.00 0.00 C ATOM 955 O LEU A 65 5.376 9.640 8.575 1.00 0.00 O ATOM 956 CB LEU A 65 4.158 11.513 6.158 1.00 0.00 C ATOM 957 CG LEU A 65 5.112 12.536 6.795 1.00 0.00 C ATOM 958 CD1 LEU A 65 6.382 12.717 5.963 1.00 0.00 C ATOM 959 CD2 LEU A 65 4.419 13.897 6.895 1.00 0.00 C ATOM 0 H LEU A 65 3.126 9.728 4.889 1.00 0.00 H new ATOM 0 HA LEU A 65 5.676 9.965 6.123 1.00 0.00 H new ATOM 0 HB2 LEU A 65 4.065 11.730 5.094 1.00 0.00 H new ATOM 0 HB3 LEU A 65 3.167 11.632 6.596 1.00 0.00 H new ATOM 0 HG LEU A 65 5.380 12.158 7.782 1.00 0.00 H new ATOM 0 HD11 LEU A 65 7.032 13.448 6.445 1.00 0.00 H new ATOM 0 HD12 LEU A 65 6.904 11.763 5.884 1.00 0.00 H new ATOM 0 HD13 LEU A 65 6.117 13.069 4.966 1.00 0.00 H new ATOM 0 HD21 LEU A 65 5.099 14.619 7.347 1.00 0.00 H new ATOM 0 HD22 LEU A 65 4.139 14.237 5.898 1.00 0.00 H new ATOM 0 HD23 LEU A 65 3.525 13.805 7.511 1.00 0.00 H new ATOM 971 N SER A 66 3.231 9.084 8.122 1.00 0.00 N ATOM 972 CA SER A 66 2.865 8.643 9.474 1.00 0.00 C ATOM 973 C SER A 66 1.992 7.392 9.459 1.00 0.00 C ATOM 974 O SER A 66 1.316 7.066 8.482 1.00 0.00 O ATOM 975 CB SER A 66 2.147 9.762 10.248 1.00 0.00 C ATOM 976 OG SER A 66 2.840 11.001 10.184 1.00 0.00 O ATOM 0 H SER A 66 2.475 8.974 7.447 1.00 0.00 H new ATOM 0 HA SER A 66 3.799 8.397 9.979 1.00 0.00 H new ATOM 0 HB2 SER A 66 1.142 9.890 9.845 1.00 0.00 H new ATOM 0 HB3 SER A 66 2.037 9.465 11.291 1.00 0.00 H new ATOM 0 HG SER A 66 2.345 11.679 10.689 1.00 0.00 H new ATOM 982 N GLU A 67 2.002 6.686 10.580 1.00 0.00 N ATOM 983 CA GLU A 67 1.328 5.407 10.772 1.00 0.00 C ATOM 984 C GLU A 67 -0.205 5.520 10.688 1.00 0.00 C ATOM 985 O GLU A 67 -0.860 4.644 10.127 1.00 0.00 O ATOM 986 CB GLU A 67 1.740 4.861 12.143 1.00 0.00 C ATOM 987 CG GLU A 67 3.226 4.476 12.262 1.00 0.00 C ATOM 988 CD GLU A 67 4.224 5.631 12.496 1.00 0.00 C ATOM 989 OE1 GLU A 67 5.449 5.362 12.475 1.00 0.00 O ATOM 990 OE2 GLU A 67 3.812 6.797 12.710 1.00 0.00 O ATOM 0 H GLU A 67 2.499 6.999 11.414 1.00 0.00 H new ATOM 0 HA GLU A 67 1.628 4.734 9.969 1.00 0.00 H new ATOM 0 HB2 GLU A 67 1.511 5.610 12.901 1.00 0.00 H new ATOM 0 HB3 GLU A 67 1.132 3.984 12.367 1.00 0.00 H new ATOM 0 HG2 GLU A 67 3.329 3.766 13.082 1.00 0.00 H new ATOM 0 HG3 GLU A 67 3.517 3.954 11.350 1.00 0.00 H new ATOM 997 N GLU A 68 -0.783 6.623 11.173 1.00 0.00 N ATOM 998 CA GLU A 68 -2.230 6.878 11.095 1.00 0.00 C ATOM 999 C GLU A 68 -2.729 7.114 9.655 1.00 0.00 C ATOM 1000 O GLU A 68 -3.883 6.819 9.343 1.00 0.00 O ATOM 1001 CB GLU A 68 -2.611 8.042 12.028 1.00 0.00 C ATOM 1002 CG GLU A 68 -1.969 9.389 11.660 1.00 0.00 C ATOM 1003 CD GLU A 68 -2.377 10.481 12.669 1.00 0.00 C ATOM 1004 OE1 GLU A 68 -1.629 10.716 13.650 1.00 0.00 O ATOM 1005 OE2 GLU A 68 -3.446 11.114 12.491 1.00 0.00 O ATOM 0 H GLU A 68 -0.261 7.369 11.633 1.00 0.00 H new ATOM 0 HA GLU A 68 -2.737 5.974 11.433 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -3.695 8.157 12.022 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -2.324 7.783 13.047 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -0.884 9.288 11.645 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -2.276 9.682 10.656 1.00 0.00 H new ATOM 1012 N ASP A 69 -1.856 7.583 8.756 1.00 0.00 N ATOM 1013 CA ASP A 69 -2.154 7.725 7.327 1.00 0.00 C ATOM 1014 C ASP A 69 -2.124 6.363 6.610 1.00 0.00 C ATOM 1015 O ASP A 69 -2.948 6.109 5.728 1.00 0.00 O ATOM 1016 CB ASP A 69 -1.162 8.717 6.698 1.00 0.00 C ATOM 1017 CG ASP A 69 -1.361 10.147 7.224 1.00 0.00 C ATOM 1018 OD1 ASP A 69 -0.408 10.706 7.816 1.00 0.00 O ATOM 1019 OD2 ASP A 69 -2.456 10.724 7.024 1.00 0.00 O ATOM 0 H ASP A 69 -0.912 7.878 9.004 1.00 0.00 H new ATOM 0 HA ASP A 69 -3.165 8.117 7.211 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -0.143 8.392 6.909 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -1.281 8.710 5.615 1.00 0.00 H new ATOM 1024 N ALA A 70 -1.246 5.449 7.043 1.00 0.00 N ATOM 1025 CA ALA A 70 -1.200 4.073 6.559 1.00 0.00 C ATOM 1026 C ALA A 70 -2.411 3.261 7.058 1.00 0.00 C ATOM 1027 O ALA A 70 -3.089 2.616 6.258 1.00 0.00 O ATOM 1028 CB ALA A 70 0.138 3.464 6.999 1.00 0.00 C ATOM 0 H ALA A 70 -0.539 5.653 7.750 1.00 0.00 H new ATOM 0 HA ALA A 70 -1.263 4.051 5.471 1.00 0.00 H new ATOM 0 HB1 ALA A 70 0.201 2.433 6.650 1.00 0.00 H new ATOM 0 HB2 ALA A 70 0.958 4.042 6.573 1.00 0.00 H new ATOM 0 HB3 ALA A 70 0.207 3.484 8.087 1.00 0.00 H new ATOM 1034 N ASP A 71 -2.752 3.363 8.349 1.00 0.00 N ATOM 1035 CA ASP A 71 -3.945 2.736 8.940 1.00 0.00 C ATOM 1036 C ASP A 71 -5.244 3.152 8.218 1.00 0.00 C ATOM 1037 O ASP A 71 -6.154 2.338 8.051 1.00 0.00 O ATOM 1038 CB ASP A 71 -4.054 3.109 10.432 1.00 0.00 C ATOM 1039 CG ASP A 71 -3.001 2.467 11.359 1.00 0.00 C ATOM 1040 OD1 ASP A 71 -2.719 3.055 12.430 1.00 0.00 O ATOM 1041 OD2 ASP A 71 -2.515 1.345 11.079 1.00 0.00 O ATOM 0 H ASP A 71 -2.199 3.891 9.024 1.00 0.00 H new ATOM 0 HA ASP A 71 -3.828 1.658 8.827 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -3.980 4.193 10.523 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -5.045 2.826 10.787 1.00 0.00 H new ATOM 1046 N TYR A 72 -5.319 4.399 7.740 1.00 0.00 N ATOM 1047 CA TYR A 72 -6.463 4.913 6.981 1.00 0.00 C ATOM 1048 C TYR A 72 -6.467 4.448 5.519 1.00 0.00 C ATOM 1049 O TYR A 72 -7.528 4.126 4.987 1.00 0.00 O ATOM 1050 CB TYR A 72 -6.477 6.442 7.061 1.00 0.00 C ATOM 1051 CG TYR A 72 -7.732 7.057 6.469 1.00 0.00 C ATOM 1052 CD1 TYR A 72 -7.659 7.777 5.263 1.00 0.00 C ATOM 1053 CD2 TYR A 72 -8.975 6.890 7.111 1.00 0.00 C ATOM 1054 CE1 TYR A 72 -8.821 8.331 4.692 1.00 0.00 C ATOM 1055 CE2 TYR A 72 -10.142 7.439 6.544 1.00 0.00 C ATOM 1056 CZ TYR A 72 -10.069 8.162 5.333 1.00 0.00 C ATOM 1057 OH TYR A 72 -11.200 8.698 4.798 1.00 0.00 O ATOM 0 H TYR A 72 -4.578 5.087 7.871 1.00 0.00 H new ATOM 0 HA TYR A 72 -7.368 4.507 7.432 1.00 0.00 H new ATOM 0 HB2 TYR A 72 -6.387 6.746 8.104 1.00 0.00 H new ATOM 0 HB3 TYR A 72 -5.605 6.835 6.538 1.00 0.00 H new ATOM 0 HD1 TYR A 72 -6.706 7.906 4.772 1.00 0.00 H new ATOM 0 HD2 TYR A 72 -9.033 6.340 8.039 1.00 0.00 H new ATOM 0 HE1 TYR A 72 -8.758 8.884 3.766 1.00 0.00 H new ATOM 0 HE2 TYR A 72 -11.094 7.307 7.036 1.00 0.00 H new ATOM 0 HH TYR A 72 -11.966 8.483 5.370 1.00 0.00 H new ATOM 1067 N ALA A 73 -5.307 4.330 4.865 1.00 0.00 N ATOM 1068 CA ALA A 73 -5.226 3.828 3.492 1.00 0.00 C ATOM 1069 C ALA A 73 -5.733 2.378 3.391 1.00 0.00 C ATOM 1070 O ALA A 73 -6.452 2.028 2.455 1.00 0.00 O ATOM 1071 CB ALA A 73 -3.783 3.982 3.007 1.00 0.00 C ATOM 0 H ALA A 73 -4.404 4.578 5.270 1.00 0.00 H new ATOM 0 HA ALA A 73 -5.879 4.411 2.843 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -3.701 3.613 1.985 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -3.499 5.034 3.037 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -3.119 3.409 3.654 1.00 0.00 H new ATOM 1077 N ILE A 74 -5.457 1.565 4.417 1.00 0.00 N ATOM 1078 CA ILE A 74 -5.963 0.190 4.557 1.00 0.00 C ATOM 1079 C ILE A 74 -7.499 0.168 4.676 1.00 0.00 C ATOM 1080 O ILE A 74 -8.146 -0.730 4.138 1.00 0.00 O ATOM 1081 CB ILE A 74 -5.272 -0.482 5.768 1.00 0.00 C ATOM 1082 CG1 ILE A 74 -3.742 -0.536 5.550 1.00 0.00 C ATOM 1083 CG2 ILE A 74 -5.812 -1.904 6.010 1.00 0.00 C ATOM 1084 CD1 ILE A 74 -2.944 -0.736 6.838 1.00 0.00 C ATOM 0 H ILE A 74 -4.861 1.850 5.194 1.00 0.00 H new ATOM 0 HA ILE A 74 -5.721 -0.380 3.660 1.00 0.00 H new ATOM 0 HB ILE A 74 -5.493 0.120 6.649 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -3.511 -1.348 4.860 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -3.419 0.389 5.073 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -5.304 -2.345 6.868 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -6.883 -1.858 6.207 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -5.631 -2.517 5.127 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -1.879 -0.764 6.606 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -3.145 0.088 7.522 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -3.238 -1.676 7.306 1.00 0.00 H new ATOM 1096 N LYS A 75 -8.099 1.181 5.315 1.00 0.00 N ATOM 1097 CA LYS A 75 -9.557 1.330 5.451 1.00 0.00 C ATOM 1098 C LYS A 75 -10.252 1.676 4.125 1.00 0.00 C ATOM 1099 O LYS A 75 -11.353 1.177 3.884 1.00 0.00 O ATOM 1100 CB LYS A 75 -9.841 2.352 6.570 1.00 0.00 C ATOM 1101 CG LYS A 75 -11.333 2.634 6.778 1.00 0.00 C ATOM 1102 CD LYS A 75 -11.562 3.510 8.018 1.00 0.00 C ATOM 1103 CE LYS A 75 -13.036 3.907 8.198 1.00 0.00 C ATOM 1104 NZ LYS A 75 -13.901 2.750 8.553 1.00 0.00 N ATOM 0 H LYS A 75 -7.576 1.935 5.761 1.00 0.00 H new ATOM 0 HA LYS A 75 -9.989 0.369 5.731 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -9.416 1.984 7.504 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -9.332 3.287 6.335 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -11.738 3.132 5.897 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -11.872 1.693 6.889 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -11.223 2.974 8.904 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -10.954 4.411 7.939 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -13.112 4.665 8.978 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -13.402 4.360 7.276 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -14.884 3.072 8.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -13.853 2.036 7.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -13.572 2.332 9.447 1.00 0.00 H new ATOM 1118 N ILE A 76 -9.635 2.489 3.257 1.00 0.00 N ATOM 1119 CA ILE A 76 -10.283 3.022 2.043 1.00 0.00 C ATOM 1120 C ILE A 76 -9.918 2.328 0.720 1.00 0.00 C ATOM 1121 O ILE A 76 -10.606 2.566 -0.269 1.00 0.00 O ATOM 1122 CB ILE A 76 -10.064 4.542 1.913 1.00 0.00 C ATOM 1123 CG1 ILE A 76 -8.578 4.923 1.798 1.00 0.00 C ATOM 1124 CG2 ILE A 76 -10.735 5.284 3.081 1.00 0.00 C ATOM 1125 CD1 ILE A 76 -8.402 6.277 1.121 1.00 0.00 C ATOM 0 H ILE A 76 -8.670 2.798 3.374 1.00 0.00 H new ATOM 0 HA ILE A 76 -11.338 2.798 2.200 1.00 0.00 H new ATOM 0 HB ILE A 76 -10.534 4.853 0.980 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -8.130 4.950 2.791 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -8.048 4.159 1.230 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -10.570 6.356 2.973 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -11.805 5.079 3.075 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -10.305 4.944 4.023 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -7.341 6.516 1.056 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -8.828 6.241 0.118 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -8.911 7.044 1.704 1.00 0.00 H new ATOM 1137 N MET A 77 -8.863 1.504 0.674 1.00 0.00 N ATOM 1138 CA MET A 77 -8.368 0.843 -0.559 1.00 0.00 C ATOM 1139 C MET A 77 -8.522 -0.693 -0.590 1.00 0.00 C ATOM 1140 O MET A 77 -8.185 -1.329 -1.587 1.00 0.00 O ATOM 1141 CB MET A 77 -6.905 1.236 -0.784 1.00 0.00 C ATOM 1142 CG MET A 77 -6.761 2.707 -1.177 1.00 0.00 C ATOM 1143 SD MET A 77 -7.148 3.026 -2.916 1.00 0.00 S ATOM 1144 CE MET A 77 -6.457 4.690 -3.038 1.00 0.00 C ATOM 0 H MET A 77 -8.315 1.269 1.501 1.00 0.00 H new ATOM 0 HA MET A 77 -9.005 1.200 -1.369 1.00 0.00 H new ATOM 0 HB2 MET A 77 -6.335 1.046 0.125 1.00 0.00 H new ATOM 0 HB3 MET A 77 -6.477 0.608 -1.566 1.00 0.00 H new ATOM 0 HG2 MET A 77 -7.418 3.309 -0.550 1.00 0.00 H new ATOM 0 HG3 MET A 77 -5.741 3.032 -0.974 1.00 0.00 H new ATOM 0 HE1 MET A 77 -7.067 5.289 -3.714 1.00 0.00 H new ATOM 0 HE2 MET A 77 -6.447 5.153 -2.051 1.00 0.00 H new ATOM 0 HE3 MET A 77 -5.439 4.634 -3.422 1.00 0.00 H new ATOM 1154 N ASP A 78 -9.029 -1.311 0.476 1.00 0.00 N ATOM 1155 CA ASP A 78 -9.110 -2.779 0.605 1.00 0.00 C ATOM 1156 C ASP A 78 -10.335 -3.406 -0.098 1.00 0.00 C ATOM 1157 O ASP A 78 -11.440 -2.863 -0.057 1.00 0.00 O ATOM 1158 CB ASP A 78 -9.042 -3.171 2.084 1.00 0.00 C ATOM 1159 CG ASP A 78 -9.034 -4.690 2.275 1.00 0.00 C ATOM 1160 OD1 ASP A 78 -8.129 -5.360 1.721 1.00 0.00 O ATOM 1161 OD2 ASP A 78 -9.921 -5.214 2.985 1.00 0.00 O ATOM 0 H ASP A 78 -9.400 -0.810 1.284 1.00 0.00 H new ATOM 0 HA ASP A 78 -8.249 -3.192 0.079 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -8.144 -2.745 2.531 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -9.895 -2.744 2.612 1.00 0.00 H new ATOM 1166 N MET A 79 -10.133 -4.573 -0.728 1.00 0.00 N ATOM 1167 CA MET A 79 -11.112 -5.353 -1.516 1.00 0.00 C ATOM 1168 C MET A 79 -11.772 -4.590 -2.686 1.00 0.00 C ATOM 1169 O MET A 79 -12.836 -4.960 -3.185 1.00 0.00 O ATOM 1170 CB MET A 79 -12.094 -6.109 -0.601 1.00 0.00 C ATOM 1171 CG MET A 79 -11.416 -7.140 0.319 1.00 0.00 C ATOM 1172 SD MET A 79 -11.046 -8.781 -0.383 1.00 0.00 S ATOM 1173 CE MET A 79 -9.572 -8.479 -1.399 1.00 0.00 C ATOM 0 H MET A 79 -9.222 -5.031 -0.702 1.00 0.00 H new ATOM 0 HA MET A 79 -10.536 -6.112 -2.045 1.00 0.00 H new ATOM 0 HB2 MET A 79 -12.633 -5.387 0.013 1.00 0.00 H new ATOM 0 HB3 MET A 79 -12.834 -6.618 -1.219 1.00 0.00 H new ATOM 0 HG2 MET A 79 -10.481 -6.708 0.676 1.00 0.00 H new ATOM 0 HG3 MET A 79 -12.054 -7.283 1.191 1.00 0.00 H new ATOM 0 HE1 MET A 79 -8.919 -9.351 -1.361 1.00 0.00 H new ATOM 0 HE2 MET A 79 -9.872 -8.295 -2.431 1.00 0.00 H new ATOM 0 HE3 MET A 79 -9.038 -7.609 -1.016 1.00 0.00 H new ATOM 1183 N ILE A 80 -11.103 -3.534 -3.150 1.00 0.00 N ATOM 1184 CA ILE A 80 -11.460 -2.670 -4.278 1.00 0.00 C ATOM 1185 C ILE A 80 -10.864 -3.194 -5.590 1.00 0.00 C ATOM 1186 O ILE A 80 -9.807 -3.817 -5.591 1.00 0.00 O ATOM 1187 CB ILE A 80 -11.014 -1.246 -3.889 1.00 0.00 C ATOM 1188 CG1 ILE A 80 -12.107 -0.674 -2.965 1.00 0.00 C ATOM 1189 CG2 ILE A 80 -10.723 -0.319 -5.073 1.00 0.00 C ATOM 1190 CD1 ILE A 80 -11.660 0.530 -2.143 1.00 0.00 C ATOM 0 H ILE A 80 -10.230 -3.237 -2.714 1.00 0.00 H new ATOM 0 HA ILE A 80 -12.533 -2.661 -4.472 1.00 0.00 H new ATOM 0 HB ILE A 80 -10.051 -1.309 -3.382 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -12.967 -0.388 -3.571 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -12.442 -1.459 -2.287 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -10.417 0.659 -4.702 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -9.923 -0.744 -5.680 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -11.622 -0.212 -5.681 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -12.486 0.872 -1.520 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -10.820 0.246 -1.509 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -11.353 1.334 -2.812 1.00 0.00 H new ATOM 1202 N LYS A 81 -11.533 -2.961 -6.725 1.00 0.00 N ATOM 1203 CA LYS A 81 -11.204 -3.578 -8.021 1.00 0.00 C ATOM 1204 C LYS A 81 -10.414 -2.635 -8.936 1.00 0.00 C ATOM 1205 O LYS A 81 -10.929 -2.169 -9.955 1.00 0.00 O ATOM 1206 CB LYS A 81 -12.481 -4.143 -8.665 1.00 0.00 C ATOM 1207 CG LYS A 81 -13.137 -5.232 -7.796 1.00 0.00 C ATOM 1208 CD LYS A 81 -14.279 -5.967 -8.514 1.00 0.00 C ATOM 1209 CE LYS A 81 -13.747 -7.007 -9.511 1.00 0.00 C ATOM 1210 NZ LYS A 81 -14.846 -7.623 -10.302 1.00 0.00 N ATOM 0 H LYS A 81 -12.332 -2.328 -6.773 1.00 0.00 H new ATOM 0 HA LYS A 81 -10.527 -4.415 -7.851 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -13.192 -3.333 -8.829 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -12.240 -4.558 -9.644 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -12.379 -5.955 -7.496 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -13.522 -4.777 -6.883 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -14.914 -6.460 -7.778 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -14.903 -5.244 -9.040 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -13.034 -6.533 -10.186 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -13.206 -7.785 -8.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -14.449 -8.320 -10.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -15.513 -8.097 -9.660 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -15.346 -6.884 -10.836 1.00 0.00 H new ATOM 1224 N LEU A 82 -9.152 -2.371 -8.588 1.00 0.00 N ATOM 1225 CA LEU A 82 -8.222 -1.587 -9.418 1.00 0.00 C ATOM 1226 C LEU A 82 -8.084 -2.244 -10.807 1.00 0.00 C ATOM 1227 O LEU A 82 -7.784 -3.437 -10.885 1.00 0.00 O ATOM 1228 CB LEU A 82 -6.869 -1.472 -8.681 1.00 0.00 C ATOM 1229 CG LEU A 82 -5.836 -0.534 -9.333 1.00 0.00 C ATOM 1230 CD1 LEU A 82 -6.372 0.888 -9.519 1.00 0.00 C ATOM 1231 CD2 LEU A 82 -4.598 -0.457 -8.438 1.00 0.00 C ATOM 0 H LEU A 82 -8.739 -2.697 -7.714 1.00 0.00 H new ATOM 0 HA LEU A 82 -8.603 -0.578 -9.578 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -7.057 -1.126 -7.665 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -6.432 -2.467 -8.603 1.00 0.00 H new ATOM 0 HG LEU A 82 -5.602 -0.944 -10.315 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -5.605 1.508 -9.982 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -7.254 0.864 -10.159 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -6.639 1.306 -8.548 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -3.861 0.205 -8.892 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -4.880 -0.069 -7.459 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -4.169 -1.453 -8.324 1.00 0.00 H new ATOM 1243 N TYR A 83 -8.361 -1.509 -11.895 1.00 0.00 N ATOM 1244 CA TYR A 83 -8.497 -2.085 -13.251 1.00 0.00 C ATOM 1245 C TYR A 83 -9.360 -3.380 -13.374 1.00 0.00 C ATOM 1246 O TYR A 83 -9.139 -4.187 -14.282 1.00 0.00 O ATOM 1247 CB TYR A 83 -7.110 -2.252 -13.899 1.00 0.00 C ATOM 1248 CG TYR A 83 -6.278 -0.990 -14.008 1.00 0.00 C ATOM 1249 CD1 TYR A 83 -6.708 0.072 -14.831 1.00 0.00 C ATOM 1250 CD2 TYR A 83 -5.043 -0.904 -13.339 1.00 0.00 C ATOM 1251 CE1 TYR A 83 -5.904 1.218 -14.983 1.00 0.00 C ATOM 1252 CE2 TYR A 83 -4.234 0.236 -13.498 1.00 0.00 C ATOM 1253 CZ TYR A 83 -4.660 1.302 -14.317 1.00 0.00 C ATOM 1254 OH TYR A 83 -3.870 2.400 -14.467 1.00 0.00 O ATOM 0 H TYR A 83 -8.498 -0.499 -11.865 1.00 0.00 H new ATOM 0 HA TYR A 83 -9.083 -1.353 -13.807 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -6.547 -2.987 -13.324 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -7.244 -2.664 -14.899 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -7.655 0.006 -15.345 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -4.716 -1.713 -12.703 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -6.238 2.033 -15.608 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -3.282 0.295 -12.991 1.00 0.00 H new ATOM 0 HH TYR A 83 -4.431 3.187 -14.631 1.00 0.00 H new ATOM 1264 N GLY A 84 -10.347 -3.613 -12.491 1.00 0.00 N ATOM 1265 CA GLY A 84 -11.258 -4.772 -12.557 1.00 0.00 C ATOM 1266 C GLY A 84 -10.744 -6.089 -11.937 1.00 0.00 C ATOM 1267 O GLY A 84 -11.253 -7.160 -12.271 1.00 0.00 O ATOM 0 H GLY A 84 -10.538 -2.995 -11.702 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -12.190 -4.502 -12.060 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -11.497 -4.958 -13.604 1.00 0.00 H new ATOM 1271 N LYS A 85 -9.763 -6.026 -11.025 1.00 0.00 N ATOM 1272 CA LYS A 85 -9.115 -7.125 -10.303 1.00 0.00 C ATOM 1273 C LYS A 85 -9.008 -6.716 -8.818 1.00 0.00 C ATOM 1274 O LYS A 85 -8.455 -5.651 -8.536 1.00 0.00 O ATOM 1275 CB LYS A 85 -7.734 -7.375 -10.933 1.00 0.00 C ATOM 1276 CG LYS A 85 -7.011 -8.580 -10.312 1.00 0.00 C ATOM 1277 CD LYS A 85 -5.625 -8.759 -10.945 1.00 0.00 C ATOM 1278 CE LYS A 85 -4.888 -9.935 -10.293 1.00 0.00 C ATOM 1279 NZ LYS A 85 -3.529 -10.115 -10.869 1.00 0.00 N ATOM 0 H LYS A 85 -9.370 -5.125 -10.752 1.00 0.00 H new ATOM 0 HA LYS A 85 -9.686 -8.051 -10.368 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -7.852 -7.539 -12.004 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -7.117 -6.484 -10.813 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -6.910 -8.436 -9.236 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -7.604 -9.483 -10.459 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -5.727 -8.934 -12.016 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -5.043 -7.845 -10.826 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -4.809 -9.766 -9.219 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -5.466 -10.849 -10.430 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -3.034 -10.874 -10.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -3.609 -10.368 -11.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -2.992 -9.229 -10.776 1.00 0.00 H new ATOM 1293 N PRO A 86 -9.578 -7.481 -7.871 1.00 0.00 N ATOM 1294 CA PRO A 86 -9.709 -7.059 -6.476 1.00 0.00 C ATOM 1295 C PRO A 86 -8.361 -7.066 -5.738 1.00 0.00 C ATOM 1296 O PRO A 86 -7.728 -8.116 -5.596 1.00 0.00 O ATOM 1297 CB PRO A 86 -10.752 -7.997 -5.856 1.00 0.00 C ATOM 1298 CG PRO A 86 -10.696 -9.247 -6.731 1.00 0.00 C ATOM 1299 CD PRO A 86 -10.329 -8.698 -8.109 1.00 0.00 C ATOM 0 HA PRO A 86 -10.037 -6.023 -6.397 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -10.514 -8.227 -4.817 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -11.746 -7.549 -5.864 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -9.952 -9.957 -6.370 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -11.653 -9.769 -6.748 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -9.735 -9.419 -8.670 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -11.223 -8.495 -8.698 1.00 0.00 H new ATOM 1307 N ILE A 87 -7.939 -5.898 -5.240 1.00 0.00 N ATOM 1308 CA ILE A 87 -6.719 -5.731 -4.439 1.00 0.00 C ATOM 1309 C ILE A 87 -6.989 -5.944 -2.942 1.00 0.00 C ATOM 1310 O ILE A 87 -8.014 -5.517 -2.410 1.00 0.00 O ATOM 1311 CB ILE A 87 -5.999 -4.388 -4.712 1.00 0.00 C ATOM 1312 CG1 ILE A 87 -6.876 -3.135 -4.496 1.00 0.00 C ATOM 1313 CG2 ILE A 87 -5.429 -4.397 -6.141 1.00 0.00 C ATOM 1314 CD1 ILE A 87 -6.076 -1.843 -4.289 1.00 0.00 C ATOM 0 H ILE A 87 -8.446 -5.025 -5.385 1.00 0.00 H new ATOM 0 HA ILE A 87 -6.031 -6.513 -4.761 1.00 0.00 H new ATOM 0 HB ILE A 87 -5.201 -4.313 -3.974 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -7.532 -3.010 -5.357 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -7.516 -3.297 -3.629 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -4.921 -3.452 -6.336 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -4.720 -5.218 -6.245 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -6.241 -4.527 -6.856 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -6.763 -1.009 -4.144 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -5.440 -1.946 -3.410 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -5.456 -1.655 -5.165 1.00 0.00 H new ATOM 1326 N ARG A 88 -6.048 -6.586 -2.247 1.00 0.00 N ATOM 1327 CA ARG A 88 -6.035 -6.778 -0.788 1.00 0.00 C ATOM 1328 C ARG A 88 -5.016 -5.822 -0.171 1.00 0.00 C ATOM 1329 O ARG A 88 -3.866 -5.807 -0.609 1.00 0.00 O ATOM 1330 CB ARG A 88 -5.706 -8.253 -0.490 1.00 0.00 C ATOM 1331 CG ARG A 88 -5.810 -8.643 0.993 1.00 0.00 C ATOM 1332 CD ARG A 88 -7.263 -8.738 1.476 1.00 0.00 C ATOM 1333 NE ARG A 88 -7.324 -9.173 2.884 1.00 0.00 N ATOM 1334 CZ ARG A 88 -7.498 -8.416 3.953 1.00 0.00 C ATOM 1335 NH1 ARG A 88 -7.673 -7.129 3.891 1.00 0.00 N ATOM 1336 NH2 ARG A 88 -7.500 -8.958 5.138 1.00 0.00 N ATOM 0 H ARG A 88 -5.237 -7.006 -2.702 1.00 0.00 H new ATOM 0 HA ARG A 88 -7.007 -6.554 -0.349 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -6.380 -8.886 -1.067 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -4.695 -8.464 -0.838 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -5.316 -9.602 1.149 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -5.277 -7.908 1.597 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -7.750 -7.768 1.370 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -7.813 -9.441 0.850 1.00 0.00 H new ATOM 0 HE ARG A 88 -7.220 -10.174 3.052 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -7.680 -6.658 2.986 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -7.803 -6.590 4.747 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -7.367 -9.964 5.239 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -7.634 -8.376 5.965 1.00 0.00 H new ATOM 1350 N VAL A 89 -5.417 -5.037 0.829 1.00 0.00 N ATOM 1351 CA VAL A 89 -4.570 -4.004 1.451 1.00 0.00 C ATOM 1352 C VAL A 89 -4.432 -4.251 2.953 1.00 0.00 C ATOM 1353 O VAL A 89 -5.406 -4.585 3.632 1.00 0.00 O ATOM 1354 CB VAL A 89 -5.081 -2.580 1.141 1.00 0.00 C ATOM 1355 CG1 VAL A 89 -4.102 -1.502 1.620 1.00 0.00 C ATOM 1356 CG2 VAL A 89 -5.254 -2.367 -0.367 1.00 0.00 C ATOM 0 H VAL A 89 -6.349 -5.097 1.239 1.00 0.00 H new ATOM 0 HA VAL A 89 -3.575 -4.077 1.012 1.00 0.00 H new ATOM 0 HB VAL A 89 -6.033 -2.491 1.664 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -4.501 -0.516 1.382 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -3.966 -1.587 2.698 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -3.142 -1.635 1.121 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -5.615 -1.355 -0.553 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -4.296 -2.508 -0.867 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -5.975 -3.086 -0.756 1.00 0.00 H new ATOM 1366 N ASN A 90 -3.212 -4.114 3.481 1.00 0.00 N ATOM 1367 CA ASN A 90 -2.914 -4.270 4.910 1.00 0.00 C ATOM 1368 C ASN A 90 -1.581 -3.603 5.301 1.00 0.00 C ATOM 1369 O ASN A 90 -0.914 -3.007 4.459 1.00 0.00 O ATOM 1370 CB ASN A 90 -2.938 -5.772 5.267 1.00 0.00 C ATOM 1371 CG ASN A 90 -3.818 -6.016 6.477 1.00 0.00 C ATOM 1372 OD1 ASN A 90 -3.351 -6.266 7.576 1.00 0.00 O ATOM 1373 ND2 ASN A 90 -5.113 -5.880 6.311 1.00 0.00 N ATOM 0 H ASN A 90 -2.391 -3.888 2.920 1.00 0.00 H new ATOM 0 HA ASN A 90 -3.681 -3.756 5.489 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -3.308 -6.348 4.419 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -1.925 -6.120 5.470 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -5.743 -5.983 7.107 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -5.489 -5.671 5.386 1.00 0.00 H new ATOM 1380 N LYS A 91 -1.171 -3.695 6.572 1.00 0.00 N ATOM 1381 CA LYS A 91 0.153 -3.232 7.035 1.00 0.00 C ATOM 1382 C LYS A 91 1.270 -4.047 6.363 1.00 0.00 C ATOM 1383 O LYS A 91 1.139 -5.263 6.219 1.00 0.00 O ATOM 1384 CB LYS A 91 0.248 -3.365 8.571 1.00 0.00 C ATOM 1385 CG LYS A 91 -0.855 -2.648 9.373 1.00 0.00 C ATOM 1386 CD LYS A 91 -0.761 -1.114 9.328 1.00 0.00 C ATOM 1387 CE LYS A 91 0.222 -0.545 10.350 1.00 0.00 C ATOM 1388 NZ LYS A 91 -0.394 -0.383 11.684 1.00 0.00 N ATOM 0 H LYS A 91 -1.746 -4.093 7.314 1.00 0.00 H new ATOM 0 HA LYS A 91 0.275 -2.184 6.760 1.00 0.00 H new ATOM 0 HB2 LYS A 91 0.228 -4.424 8.828 1.00 0.00 H new ATOM 0 HB3 LYS A 91 1.215 -2.978 8.892 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -1.828 -2.954 8.988 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -0.806 -2.975 10.412 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -0.457 -0.803 8.328 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -1.749 -0.690 9.507 1.00 0.00 H new ATOM 0 HE2 LYS A 91 1.086 -1.205 10.428 1.00 0.00 H new ATOM 0 HE3 LYS A 91 0.589 0.420 10.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 0.325 -0.059 12.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -1.160 0.319 11.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -0.782 -1.295 12.000 1.00 0.00 H new ATOM 1402 N ALA A 92 2.389 -3.411 6.001 1.00 0.00 N ATOM 1403 CA ALA A 92 3.574 -4.121 5.497 1.00 0.00 C ATOM 1404 C ALA A 92 4.218 -5.012 6.582 1.00 0.00 C ATOM 1405 O ALA A 92 4.764 -6.074 6.281 1.00 0.00 O ATOM 1406 CB ALA A 92 4.568 -3.094 4.947 1.00 0.00 C ATOM 0 H ALA A 92 2.501 -2.398 6.048 1.00 0.00 H new ATOM 0 HA ALA A 92 3.270 -4.795 4.696 1.00 0.00 H new ATOM 0 HB1 ALA A 92 5.452 -3.609 4.570 1.00 0.00 H new ATOM 0 HB2 ALA A 92 4.101 -2.534 4.137 1.00 0.00 H new ATOM 0 HB3 ALA A 92 4.859 -2.408 5.742 1.00 0.00 H new ATOM 1412 N SER A 93 4.101 -4.595 7.850 1.00 0.00 N ATOM 1413 CA SER A 93 4.424 -5.377 9.051 1.00 0.00 C ATOM 1414 C SER A 93 3.164 -5.537 9.908 1.00 0.00 C ATOM 1415 O SER A 93 2.930 -4.772 10.843 1.00 0.00 O ATOM 1416 CB SER A 93 5.560 -4.715 9.834 1.00 0.00 C ATOM 1417 OG SER A 93 6.783 -4.872 9.140 1.00 0.00 O ATOM 0 H SER A 93 3.763 -3.660 8.077 1.00 0.00 H new ATOM 0 HA SER A 93 4.770 -6.369 8.759 1.00 0.00 H new ATOM 0 HB2 SER A 93 5.346 -3.656 9.975 1.00 0.00 H new ATOM 0 HB3 SER A 93 5.636 -5.160 10.826 1.00 0.00 H new ATOM 0 HG SER A 93 7.504 -4.444 9.647 1.00 0.00 H new ATOM 1423 N ALA A 94 2.325 -6.522 9.575 1.00 0.00 N ATOM 1424 CA ALA A 94 1.040 -6.800 10.235 1.00 0.00 C ATOM 1425 C ALA A 94 1.192 -7.546 11.582 1.00 0.00 C ATOM 1426 O ALA A 94 0.505 -8.533 11.857 1.00 0.00 O ATOM 1427 CB ALA A 94 0.118 -7.495 9.223 1.00 0.00 C ATOM 0 H ALA A 94 2.525 -7.171 8.814 1.00 0.00 H new ATOM 0 HA ALA A 94 0.573 -5.861 10.533 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -0.842 -7.710 9.693 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -0.037 -6.842 8.364 1.00 0.00 H new ATOM 0 HB3 ALA A 94 0.577 -8.427 8.893 1.00 0.00 H new ATOM 1433 N HIS A 95 2.124 -7.077 12.418 1.00 0.00 N ATOM 1434 CA HIS A 95 2.519 -7.653 13.708 1.00 0.00 C ATOM 1435 C HIS A 95 2.376 -6.634 14.844 1.00 0.00 C ATOM 1436 O HIS A 95 2.642 -5.446 14.658 1.00 0.00 O ATOM 1437 CB HIS A 95 3.978 -8.132 13.635 1.00 0.00 C ATOM 1438 CG HIS A 95 4.170 -9.498 13.032 1.00 0.00 C ATOM 1439 ND1 HIS A 95 4.610 -10.623 13.738 1.00 0.00 N ATOM 1440 CD2 HIS A 95 3.988 -9.838 11.725 1.00 0.00 C ATOM 1441 CE1 HIS A 95 4.668 -11.620 12.837 1.00 0.00 C ATOM 1442 NE2 HIS A 95 4.302 -11.176 11.622 1.00 0.00 N ATOM 0 H HIS A 95 2.655 -6.234 12.199 1.00 0.00 H new ATOM 0 HA HIS A 95 1.858 -8.494 13.917 1.00 0.00 H new ATOM 0 HB2 HIS A 95 4.553 -7.411 13.054 1.00 0.00 H new ATOM 0 HB3 HIS A 95 4.395 -8.134 14.642 1.00 0.00 H new ATOM 0 HD2 HIS A 95 3.662 -9.187 10.927 1.00 0.00 H new ATOM 0 HE1 HIS A 95 4.966 -12.634 13.058 1.00 0.00 H new ATOM 0 HE2 HIS A 95 4.263 -11.734 10.769 1.00 0.00 H new ATOM 1450 N ASN A 96 2.021 -7.120 16.036 1.00 0.00 N ATOM 1451 CA ASN A 96 1.955 -6.339 17.272 1.00 0.00 C ATOM 1452 C ASN A 96 2.970 -6.875 18.298 1.00 0.00 C ATOM 1453 O ASN A 96 2.882 -8.032 18.717 1.00 0.00 O ATOM 1454 CB ASN A 96 0.509 -6.383 17.798 1.00 0.00 C ATOM 1455 CG ASN A 96 0.333 -5.656 19.121 1.00 0.00 C ATOM 1456 OD1 ASN A 96 1.175 -4.887 19.560 1.00 0.00 O ATOM 1457 ND2 ASN A 96 -0.766 -5.874 19.803 1.00 0.00 N ATOM 0 H ASN A 96 1.764 -8.098 16.171 1.00 0.00 H new ATOM 0 HA ASN A 96 2.223 -5.299 17.085 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -0.155 -5.940 17.056 1.00 0.00 H new ATOM 0 HB3 ASN A 96 0.204 -7.423 17.918 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -0.915 -5.403 20.695 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -1.472 -6.515 19.441 1.00 0.00 H new ATOM 1464 N LYS A 97 3.915 -6.022 18.710 1.00 0.00 N ATOM 1465 CA LYS A 97 4.967 -6.301 19.710 1.00 0.00 C ATOM 1466 C LYS A 97 4.770 -5.541 21.038 1.00 0.00 C ATOM 1467 O LYS A 97 5.652 -5.568 21.900 1.00 0.00 O ATOM 1468 CB LYS A 97 6.350 -6.076 19.051 1.00 0.00 C ATOM 1469 CG LYS A 97 7.038 -7.362 18.550 1.00 0.00 C ATOM 1470 CD LYS A 97 6.190 -8.259 17.630 1.00 0.00 C ATOM 1471 CE LYS A 97 7.060 -9.386 17.054 1.00 0.00 C ATOM 1472 NZ LYS A 97 6.256 -10.407 16.329 1.00 0.00 N ATOM 0 H LYS A 97 3.975 -5.073 18.342 1.00 0.00 H new ATOM 0 HA LYS A 97 4.899 -7.345 20.015 1.00 0.00 H new ATOM 0 HB2 LYS A 97 6.231 -5.392 18.211 1.00 0.00 H new ATOM 0 HB3 LYS A 97 7.005 -5.585 19.771 1.00 0.00 H new ATOM 0 HG2 LYS A 97 7.946 -7.082 18.017 1.00 0.00 H new ATOM 0 HG3 LYS A 97 7.345 -7.949 19.416 1.00 0.00 H new ATOM 0 HD2 LYS A 97 5.355 -8.682 18.188 1.00 0.00 H new ATOM 0 HD3 LYS A 97 5.765 -7.666 16.820 1.00 0.00 H new ATOM 0 HE2 LYS A 97 7.799 -8.960 16.376 1.00 0.00 H new ATOM 0 HE3 LYS A 97 7.610 -9.867 17.863 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 6.860 -11.220 16.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 5.471 -10.724 16.933 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 5.875 -9.992 15.455 1.00 0.00 H new ATOM 1486 N ASN A 98 3.616 -4.896 21.237 1.00 0.00 N ATOM 1487 CA ASN A 98 3.227 -4.277 22.510 1.00 0.00 C ATOM 1488 C ASN A 98 2.996 -5.339 23.615 1.00 0.00 C ATOM 1489 O ASN A 98 2.678 -6.498 23.327 1.00 0.00 O ATOM 1490 CB ASN A 98 1.986 -3.392 22.268 1.00 0.00 C ATOM 1491 CG ASN A 98 1.663 -2.434 23.407 1.00 0.00 C ATOM 1492 OD1 ASN A 98 2.454 -2.191 24.310 1.00 0.00 O ATOM 1493 ND2 ASN A 98 0.493 -1.839 23.389 1.00 0.00 N ATOM 0 H ASN A 98 2.913 -4.787 20.506 1.00 0.00 H new ATOM 0 HA ASN A 98 4.038 -3.648 22.877 1.00 0.00 H new ATOM 0 HB2 ASN A 98 2.139 -2.814 21.356 1.00 0.00 H new ATOM 0 HB3 ASN A 98 1.124 -4.036 22.096 1.00 0.00 H new ATOM 0 HD21 ASN A 98 0.246 -1.177 24.125 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -0.169 -2.038 22.639 1.00 0.00 H new ATOM 1500 N LEU A 99 3.152 -4.947 24.883 1.00 0.00 N ATOM 1501 CA LEU A 99 3.048 -5.833 26.050 1.00 0.00 C ATOM 1502 C LEU A 99 1.588 -6.116 26.461 1.00 0.00 C ATOM 1503 O LEU A 99 0.686 -5.311 26.216 1.00 0.00 O ATOM 1504 CB LEU A 99 3.853 -5.241 27.226 1.00 0.00 C ATOM 1505 CG LEU A 99 5.355 -5.019 26.955 1.00 0.00 C ATOM 1506 CD1 LEU A 99 6.017 -4.431 28.202 1.00 0.00 C ATOM 1507 CD2 LEU A 99 6.089 -6.312 26.592 1.00 0.00 C ATOM 0 H LEU A 99 3.359 -3.980 25.134 1.00 0.00 H new ATOM 0 HA LEU A 99 3.473 -6.797 25.769 1.00 0.00 H new ATOM 0 HB2 LEU A 99 3.407 -4.287 27.505 1.00 0.00 H new ATOM 0 HB3 LEU A 99 3.750 -5.904 28.085 1.00 0.00 H new ATOM 0 HG LEU A 99 5.424 -4.339 26.106 1.00 0.00 H new ATOM 0 HD11 LEU A 99 7.079 -4.274 28.011 1.00 0.00 H new ATOM 0 HD12 LEU A 99 5.548 -3.478 28.448 1.00 0.00 H new ATOM 0 HD13 LEU A 99 5.897 -5.121 29.037 1.00 0.00 H new ATOM 0 HD21 LEU A 99 7.142 -6.095 26.412 1.00 0.00 H new ATOM 0 HD22 LEU A 99 6.000 -7.023 27.413 1.00 0.00 H new ATOM 0 HD23 LEU A 99 5.648 -6.740 25.692 1.00 0.00 H new ATOM 1519 N SER A 100 1.370 -7.260 27.117 1.00 0.00 N ATOM 1520 CA SER A 100 0.079 -7.692 27.680 1.00 0.00 C ATOM 1521 C SER A 100 0.275 -8.615 28.897 1.00 0.00 C ATOM 1522 O SER A 100 1.342 -9.214 29.065 1.00 0.00 O ATOM 1523 CB SER A 100 -0.744 -8.401 26.597 1.00 0.00 C ATOM 1524 OG SER A 100 -2.081 -8.595 27.035 1.00 0.00 O ATOM 0 H SER A 100 2.114 -7.939 27.279 1.00 0.00 H new ATOM 0 HA SER A 100 -0.458 -6.808 28.023 1.00 0.00 H new ATOM 0 HB2 SER A 100 -0.737 -7.810 25.681 1.00 0.00 H new ATOM 0 HB3 SER A 100 -0.290 -9.363 26.358 1.00 0.00 H new ATOM 0 HG SER A 100 -2.593 -9.047 26.332 1.00 0.00 H new ATOM 1530 N GLY A 101 -0.749 -8.730 29.748 1.00 0.00 N ATOM 1531 CA GLY A 101 -0.763 -9.562 30.962 1.00 0.00 C ATOM 1532 C GLY A 101 0.225 -9.108 32.054 1.00 0.00 C ATOM 1533 O GLY A 101 1.247 -9.776 32.251 1.00 0.00 O ATOM 0 H GLY A 101 -1.626 -8.228 29.608 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -1.771 -9.561 31.377 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -0.533 -10.591 30.686 1.00 0.00 H new ATOM 1537 N PRO A 102 -0.048 -8.000 32.776 1.00 0.00 N ATOM 1538 CA PRO A 102 0.831 -7.477 33.829 1.00 0.00 C ATOM 1539 C PRO A 102 1.056 -8.447 35.005 1.00 0.00 C ATOM 1540 O PRO A 102 0.195 -9.271 35.329 1.00 0.00 O ATOM 1541 CB PRO A 102 0.181 -6.173 34.312 1.00 0.00 C ATOM 1542 CG PRO A 102 -0.686 -5.744 33.132 1.00 0.00 C ATOM 1543 CD PRO A 102 -1.161 -7.082 32.571 1.00 0.00 C ATOM 0 HA PRO A 102 1.829 -7.322 33.418 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -0.415 -6.331 35.211 1.00 0.00 H new ATOM 0 HB3 PRO A 102 0.929 -5.418 34.555 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -1.520 -5.117 33.447 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -0.118 -5.174 32.397 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -2.057 -7.429 33.086 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -1.413 -6.998 31.514 1.00 0.00 H new ATOM 1551 N SER A 103 2.203 -8.313 35.678 1.00 0.00 N ATOM 1552 CA SER A 103 2.544 -9.077 36.891 1.00 0.00 C ATOM 1553 C SER A 103 1.802 -8.557 38.135 1.00 0.00 C ATOM 1554 O SER A 103 1.413 -7.385 38.200 1.00 0.00 O ATOM 1555 CB SER A 103 4.062 -9.062 37.105 1.00 0.00 C ATOM 1556 OG SER A 103 4.433 -10.006 38.097 1.00 0.00 O ATOM 0 H SER A 103 2.935 -7.662 35.394 1.00 0.00 H new ATOM 0 HA SER A 103 2.215 -10.106 36.743 1.00 0.00 H new ATOM 0 HB2 SER A 103 4.570 -9.292 36.168 1.00 0.00 H new ATOM 0 HB3 SER A 103 4.383 -8.065 37.405 1.00 0.00 H new ATOM 0 HG SER A 103 5.405 -9.986 38.221 1.00 0.00 H new ATOM 1562 N SER A 104 1.604 -9.425 39.134 1.00 0.00 N ATOM 1563 CA SER A 104 0.940 -9.117 40.412 1.00 0.00 C ATOM 1564 C SER A 104 1.482 -9.985 41.564 1.00 0.00 C ATOM 1565 O SER A 104 2.055 -11.056 41.329 1.00 0.00 O ATOM 1566 CB SER A 104 -0.576 -9.305 40.263 1.00 0.00 C ATOM 1567 OG SER A 104 -1.260 -8.716 41.359 1.00 0.00 O ATOM 0 H SER A 104 1.911 -10.396 39.076 1.00 0.00 H new ATOM 0 HA SER A 104 1.155 -8.079 40.664 1.00 0.00 H new ATOM 0 HB2 SER A 104 -0.914 -8.854 39.330 1.00 0.00 H new ATOM 0 HB3 SER A 104 -0.813 -10.367 40.207 1.00 0.00 H new ATOM 0 HG SER A 104 -2.225 -8.843 41.248 1.00 0.00 H new ATOM 1573 N GLY A 105 1.314 -9.518 42.808 1.00 0.00 N ATOM 1574 CA GLY A 105 1.771 -10.179 44.046 1.00 0.00 C ATOM 1575 C GLY A 105 0.971 -11.434 44.406 1.00 0.00 C ATOM 1576 O GLY A 105 -0.264 -11.326 44.580 1.00 0.00 O ATOM 1577 OXT GLY A 105 1.588 -12.514 44.549 1.00 0.00 O ATOM 0 H GLY A 105 0.838 -8.635 42.991 1.00 0.00 H new ATOM 0 HA2 GLY A 105 2.822 -10.448 43.937 1.00 0.00 H new ATOM 0 HA3 GLY A 105 1.707 -9.469 44.871 1.00 0.00 H new TER 1581 GLY A 105