USER MOD reduce.3.24.130724 H: found=0, std=0, add=1111, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1106 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 16 THR OG1 : rot 180:sc= 1.07 USER MOD Set 1.2: A 128 THR OG1 : rot -112:sc= 0.99 USER MOD Single : A 1 GLY N :NH3+ -115:sc= 0.0904 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot -20:sc= 0.632 USER MOD Single : A 8 SER OG : rot -141:sc= 0.347 USER MOD Single : A 12 GLN : amide:sc= -0.0175 K(o=-0.017,f=-3.2!) USER MOD Single : A 14 GLN : amide:sc= -0.0414 K(o=-0.041,f=-1.2!) USER MOD Single : A 19 HIS : no HD1:sc= -0.803 K(o=-0.79,f=-6.7!) USER MOD Single : A 20 SER OG : rot 150:sc= 0 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 22 GLN : amide:sc= -0.0316 K(o=-0.032,f=-0.76) USER MOD Single : A 24 ASN : amide:sc= -2.24 X(o=-2.2,f=-2.6) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 HIS : no HD1:sc= -0.0255 X(o=-0.026,f=-0.0064) USER MOD Single : A 33 CYS SG : rot 180:sc= -1.55! USER MOD Single : A 35 ASN : amide:sc= -0.691 K(o=-0.69,f=-3.3!) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 MET CE :methyl -121:sc= -1.51 (180deg=-3.33!) USER MOD Single : A 51 TYR OH : rot 180:sc= -1.38 USER MOD Single : A 56 LYS NZ :NH3+ 174:sc= -1.22 (180deg=-1.32) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 136:sc= 0.0405 (180deg=0) USER MOD Single : A 64 THR OG1 : rot 122:sc= 0.614 USER MOD Single : A 65 HIS : no HD1:sc=-0.00446 X(o=-0.0045,f=-0.014) USER MOD Single : A 67 SER OG : rot 160:sc= -0.928 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 ASN : amide:sc= -0.683! C(o=-0.68!,f=-4.5!) USER MOD Single : A 77 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 SER OG : rot 180:sc= -0.722 USER MOD Single : A 82 SER OG : rot 43:sc= 0.842 USER MOD Single : A 84 SER OG : rot 180:sc= 0.00433 USER MOD Single : A 89 GLN : amide:sc= -3.91! C(o=-3.9!,f=-5.4!) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 ASN : amide:sc= -0.388 X(o=-0.39,f=-0.31) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot -4:sc= 1.1 USER MOD Single : A 106 LYS NZ :NH3+ 161:sc= -0.0271 (180deg=-0.277) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00575) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 GLN : amide:sc= -5.37! C(o=-5.4!,f=-11!) USER MOD Single : A 131 TYR OH : rot 26:sc= 0.194 USER MOD Single : A 134 THR OG1 : rot -46:sc= 0.00285 USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 22.711 -4.295 -4.560 1.00 0.00 N ATOM 2 CA GLY A 1 22.483 -3.726 -3.245 1.00 0.00 C ATOM 3 C GLY A 1 21.713 -2.421 -3.303 1.00 0.00 C ATOM 4 O GLY A 1 21.556 -1.833 -4.373 1.00 0.00 O ATOM 0 H1 GLY A 1 22.202 -5.198 -4.641 1.00 0.00 H new ATOM 0 H2 GLY A 1 22.366 -3.637 -5.288 1.00 0.00 H new ATOM 0 H3 GLY A 1 23.729 -4.458 -4.696 1.00 0.00 H new ATOM 0 HA2 GLY A 1 21.934 -4.442 -2.633 1.00 0.00 H new ATOM 0 HA3 GLY A 1 23.442 -3.557 -2.754 1.00 0.00 H new ATOM 8 N SER A 2 21.231 -1.969 -2.150 1.00 0.00 N ATOM 9 CA SER A 2 20.469 -0.728 -2.075 1.00 0.00 C ATOM 10 C SER A 2 21.040 0.197 -1.004 1.00 0.00 C ATOM 11 O SER A 2 20.566 0.217 0.132 1.00 0.00 O ATOM 12 CB SER A 2 18.998 -1.025 -1.776 1.00 0.00 C ATOM 13 OG SER A 2 18.271 0.171 -1.555 1.00 0.00 O ATOM 0 H SER A 2 21.354 -2.443 -1.255 1.00 0.00 H new ATOM 0 HA SER A 2 20.543 -0.227 -3.040 1.00 0.00 H new ATOM 0 HB2 SER A 2 18.558 -1.573 -2.609 1.00 0.00 H new ATOM 0 HB3 SER A 2 18.924 -1.667 -0.898 1.00 0.00 H new ATOM 0 HG SER A 2 17.334 -0.046 -1.368 1.00 0.00 H new ATOM 19 N SER A 3 22.063 0.961 -1.375 1.00 0.00 N ATOM 20 CA SER A 3 22.702 1.885 -0.446 1.00 0.00 C ATOM 21 C SER A 3 22.575 3.324 -0.938 1.00 0.00 C ATOM 22 O SER A 3 22.437 3.573 -2.134 1.00 0.00 O ATOM 23 CB SER A 3 24.178 1.524 -0.269 1.00 0.00 C ATOM 24 OG SER A 3 24.329 0.390 0.567 1.00 0.00 O ATOM 0 H SER A 3 22.466 0.958 -2.312 1.00 0.00 H new ATOM 0 HA SER A 3 22.197 1.802 0.516 1.00 0.00 H new ATOM 0 HB2 SER A 3 24.626 1.324 -1.242 1.00 0.00 H new ATOM 0 HB3 SER A 3 24.714 2.370 0.161 1.00 0.00 H new ATOM 0 HG SER A 3 25.281 0.179 0.663 1.00 0.00 H new ATOM 30 N GLY A 4 22.622 4.268 -0.003 1.00 0.00 N ATOM 31 CA GLY A 4 22.510 5.671 -0.359 1.00 0.00 C ATOM 32 C GLY A 4 21.071 6.107 -0.552 1.00 0.00 C ATOM 33 O GLY A 4 20.610 6.266 -1.682 1.00 0.00 O ATOM 0 H GLY A 4 22.736 4.087 0.994 1.00 0.00 H new ATOM 0 HA2 GLY A 4 22.969 6.278 0.421 1.00 0.00 H new ATOM 0 HA3 GLY A 4 23.069 5.856 -1.277 1.00 0.00 H new ATOM 37 N SER A 5 20.359 6.299 0.554 1.00 0.00 N ATOM 38 CA SER A 5 18.962 6.714 0.501 1.00 0.00 C ATOM 39 C SER A 5 18.839 8.228 0.647 1.00 0.00 C ATOM 40 O SER A 5 19.819 8.917 0.931 1.00 0.00 O ATOM 41 CB SER A 5 18.159 6.017 1.601 1.00 0.00 C ATOM 42 OG SER A 5 18.212 4.609 1.457 1.00 0.00 O ATOM 0 H SER A 5 20.726 6.174 1.497 1.00 0.00 H new ATOM 0 HA SER A 5 18.560 6.426 -0.470 1.00 0.00 H new ATOM 0 HB2 SER A 5 18.552 6.301 2.577 1.00 0.00 H new ATOM 0 HB3 SER A 5 17.122 6.351 1.565 1.00 0.00 H new ATOM 0 HG SER A 5 17.693 4.187 2.173 1.00 0.00 H new ATOM 48 N SER A 6 17.628 8.739 0.451 1.00 0.00 N ATOM 49 CA SER A 6 17.376 10.171 0.557 1.00 0.00 C ATOM 50 C SER A 6 15.893 10.446 0.791 1.00 0.00 C ATOM 51 O SER A 6 15.059 9.548 0.682 1.00 0.00 O ATOM 52 CB SER A 6 17.845 10.888 -0.711 1.00 0.00 C ATOM 53 OG SER A 6 19.206 10.602 -0.984 1.00 0.00 O ATOM 0 H SER A 6 16.806 8.182 0.218 1.00 0.00 H new ATOM 0 HA SER A 6 17.938 10.551 1.410 1.00 0.00 H new ATOM 0 HB2 SER A 6 17.229 10.580 -1.556 1.00 0.00 H new ATOM 0 HB3 SER A 6 17.712 11.964 -0.595 1.00 0.00 H new ATOM 0 HG SER A 6 19.642 10.276 -0.169 1.00 0.00 H new ATOM 59 N GLY A 7 15.573 11.696 1.113 1.00 0.00 N ATOM 60 CA GLY A 7 14.192 12.068 1.357 1.00 0.00 C ATOM 61 C GLY A 7 13.355 12.054 0.094 1.00 0.00 C ATOM 62 O GLY A 7 13.847 12.375 -0.988 1.00 0.00 O ATOM 0 H GLY A 7 16.245 12.457 1.209 1.00 0.00 H new ATOM 0 HA2 GLY A 7 13.758 11.382 2.084 1.00 0.00 H new ATOM 0 HA3 GLY A 7 14.160 13.064 1.799 1.00 0.00 H new ATOM 66 N SER A 8 12.087 11.679 0.230 1.00 0.00 N ATOM 67 CA SER A 8 11.181 11.618 -0.911 1.00 0.00 C ATOM 68 C SER A 8 10.487 12.960 -1.125 1.00 0.00 C ATOM 69 O SER A 8 9.613 13.365 -0.358 1.00 0.00 O ATOM 70 CB SER A 8 10.138 10.518 -0.704 1.00 0.00 C ATOM 71 OG SER A 8 9.639 10.049 -1.944 1.00 0.00 O ATOM 0 H SER A 8 11.664 11.413 1.119 1.00 0.00 H new ATOM 0 HA SER A 8 11.769 11.387 -1.799 1.00 0.00 H new ATOM 0 HB2 SER A 8 10.582 9.691 -0.151 1.00 0.00 H new ATOM 0 HB3 SER A 8 9.316 10.901 -0.099 1.00 0.00 H new ATOM 0 HG SER A 8 8.676 9.885 -1.868 1.00 0.00 H new ATOM 77 N PRO A 9 10.884 13.667 -2.193 1.00 0.00 N ATOM 78 CA PRO A 9 10.312 14.974 -2.534 1.00 0.00 C ATOM 79 C PRO A 9 8.870 14.868 -3.018 1.00 0.00 C ATOM 80 O PRO A 9 8.101 15.825 -2.924 1.00 0.00 O ATOM 81 CB PRO A 9 11.219 15.473 -3.662 1.00 0.00 C ATOM 82 CG PRO A 9 11.780 14.236 -4.274 1.00 0.00 C ATOM 83 CD PRO A 9 11.920 13.246 -3.151 1.00 0.00 C ATOM 0 HA PRO A 9 10.274 15.640 -1.672 1.00 0.00 H new ATOM 0 HB2 PRO A 9 10.658 16.056 -4.392 1.00 0.00 H new ATOM 0 HB3 PRO A 9 12.009 16.118 -3.278 1.00 0.00 H new ATOM 0 HG2 PRO A 9 11.121 13.852 -5.053 1.00 0.00 H new ATOM 0 HG3 PRO A 9 12.744 14.435 -4.742 1.00 0.00 H new ATOM 0 HD2 PRO A 9 11.759 12.224 -3.494 1.00 0.00 H new ATOM 0 HD3 PRO A 9 12.915 13.280 -2.707 1.00 0.00 H new ATOM 91 N LEU A 10 8.509 13.698 -3.534 1.00 0.00 N ATOM 92 CA LEU A 10 7.157 13.467 -4.032 1.00 0.00 C ATOM 93 C LEU A 10 6.196 13.179 -2.884 1.00 0.00 C ATOM 94 O LEU A 10 5.089 13.714 -2.839 1.00 0.00 O ATOM 95 CB LEU A 10 7.150 12.301 -5.023 1.00 0.00 C ATOM 96 CG LEU A 10 8.227 12.336 -6.108 1.00 0.00 C ATOM 97 CD1 LEU A 10 8.256 11.022 -6.874 1.00 0.00 C ATOM 98 CD2 LEU A 10 7.992 13.503 -7.056 1.00 0.00 C ATOM 0 H LEU A 10 9.133 12.895 -3.618 1.00 0.00 H new ATOM 0 HA LEU A 10 6.824 14.371 -4.542 1.00 0.00 H new ATOM 0 HB2 LEU A 10 7.258 11.373 -4.462 1.00 0.00 H new ATOM 0 HB3 LEU A 10 6.175 12.269 -5.508 1.00 0.00 H new ATOM 0 HG LEU A 10 9.195 12.474 -5.627 1.00 0.00 H new ATOM 0 HD11 LEU A 10 9.028 11.065 -7.642 1.00 0.00 H new ATOM 0 HD12 LEU A 10 8.473 10.205 -6.186 1.00 0.00 H new ATOM 0 HD13 LEU A 10 7.287 10.853 -7.343 1.00 0.00 H new ATOM 0 HD21 LEU A 10 8.768 13.512 -7.821 1.00 0.00 H new ATOM 0 HD22 LEU A 10 7.016 13.396 -7.530 1.00 0.00 H new ATOM 0 HD23 LEU A 10 8.023 14.438 -6.497 1.00 0.00 H new ATOM 110 N GLY A 11 6.628 12.331 -1.955 1.00 0.00 N ATOM 111 CA GLY A 11 5.794 11.989 -0.818 1.00 0.00 C ATOM 112 C GLY A 11 5.952 10.541 -0.398 1.00 0.00 C ATOM 113 O GLY A 11 6.972 9.914 -0.682 1.00 0.00 O ATOM 0 H GLY A 11 7.540 11.875 -1.970 1.00 0.00 H new ATOM 0 HA2 GLY A 11 6.046 12.637 0.021 1.00 0.00 H new ATOM 0 HA3 GLY A 11 4.750 12.180 -1.066 1.00 0.00 H new ATOM 117 N GLN A 12 4.941 10.009 0.281 1.00 0.00 N ATOM 118 CA GLN A 12 4.974 8.627 0.743 1.00 0.00 C ATOM 119 C GLN A 12 3.563 8.076 0.915 1.00 0.00 C ATOM 120 O GLN A 12 2.588 8.828 0.911 1.00 0.00 O ATOM 121 CB GLN A 12 5.737 8.527 2.065 1.00 0.00 C ATOM 122 CG GLN A 12 7.170 9.028 1.980 1.00 0.00 C ATOM 123 CD GLN A 12 7.904 8.925 3.303 1.00 0.00 C ATOM 124 OE1 GLN A 12 7.745 7.952 4.039 1.00 0.00 O ATOM 125 NE2 GLN A 12 8.714 9.931 3.611 1.00 0.00 N ATOM 0 H GLN A 12 4.089 10.514 0.523 1.00 0.00 H new ATOM 0 HA GLN A 12 5.488 8.031 -0.011 1.00 0.00 H new ATOM 0 HB2 GLN A 12 5.206 9.099 2.826 1.00 0.00 H new ATOM 0 HB3 GLN A 12 5.743 7.488 2.394 1.00 0.00 H new ATOM 0 HG2 GLN A 12 7.707 8.454 1.225 1.00 0.00 H new ATOM 0 HG3 GLN A 12 7.169 10.067 1.649 1.00 0.00 H new ATOM 0 HE21 GLN A 12 8.816 10.718 2.971 1.00 0.00 H new ATOM 0 HE22 GLN A 12 9.235 9.916 4.488 1.00 0.00 H new ATOM 134 N ILE A 13 3.461 6.759 1.063 1.00 0.00 N ATOM 135 CA ILE A 13 2.168 6.108 1.237 1.00 0.00 C ATOM 136 C ILE A 13 2.293 4.858 2.101 1.00 0.00 C ATOM 137 O ILE A 13 3.134 3.997 1.845 1.00 0.00 O ATOM 138 CB ILE A 13 1.546 5.722 -0.118 1.00 0.00 C ATOM 139 CG1 ILE A 13 0.155 5.120 0.088 1.00 0.00 C ATOM 140 CG2 ILE A 13 2.449 4.743 -0.855 1.00 0.00 C ATOM 141 CD1 ILE A 13 -0.751 5.266 -1.115 1.00 0.00 C ATOM 0 H ILE A 13 4.258 6.122 1.066 1.00 0.00 H new ATOM 0 HA ILE A 13 1.517 6.827 1.735 1.00 0.00 H new ATOM 0 HB ILE A 13 1.446 6.622 -0.725 1.00 0.00 H new ATOM 0 HG12 ILE A 13 0.258 4.062 0.329 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -0.315 5.598 0.947 1.00 0.00 H new ATOM 0 HG21 ILE A 13 1.996 4.479 -1.811 1.00 0.00 H new ATOM 0 HG22 ILE A 13 3.421 5.205 -1.029 1.00 0.00 H new ATOM 0 HG23 ILE A 13 2.577 3.843 -0.254 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -1.720 4.817 -0.897 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -0.884 6.323 -1.344 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -0.302 4.763 -1.972 1.00 0.00 H new ATOM 153 N GLN A 14 1.450 4.766 3.124 1.00 0.00 N ATOM 154 CA GLN A 14 1.466 3.620 4.026 1.00 0.00 C ATOM 155 C GLN A 14 0.375 2.621 3.656 1.00 0.00 C ATOM 156 O GLN A 14 -0.815 2.923 3.746 1.00 0.00 O ATOM 157 CB GLN A 14 1.283 4.081 5.473 1.00 0.00 C ATOM 158 CG GLN A 14 1.833 3.102 6.497 1.00 0.00 C ATOM 159 CD GLN A 14 1.388 3.423 7.910 1.00 0.00 C ATOM 160 OE1 GLN A 14 0.310 3.979 8.122 1.00 0.00 O ATOM 161 NE2 GLN A 14 2.217 3.075 8.887 1.00 0.00 N ATOM 0 H GLN A 14 0.748 5.471 3.349 1.00 0.00 H new ATOM 0 HA GLN A 14 2.433 3.126 3.929 1.00 0.00 H new ATOM 0 HB2 GLN A 14 1.775 5.045 5.603 1.00 0.00 H new ATOM 0 HB3 GLN A 14 0.221 4.236 5.665 1.00 0.00 H new ATOM 0 HG2 GLN A 14 1.511 2.093 6.239 1.00 0.00 H new ATOM 0 HG3 GLN A 14 2.922 3.110 6.453 1.00 0.00 H new ATOM 0 HE21 GLN A 14 3.101 2.616 8.667 1.00 0.00 H new ATOM 0 HE22 GLN A 14 1.970 3.267 9.858 1.00 0.00 H new ATOM 170 N LEU A 15 0.789 1.430 3.238 1.00 0.00 N ATOM 171 CA LEU A 15 -0.154 0.385 2.853 1.00 0.00 C ATOM 172 C LEU A 15 0.243 -0.957 3.460 1.00 0.00 C ATOM 173 O LEU A 15 1.408 -1.181 3.793 1.00 0.00 O ATOM 174 CB LEU A 15 -0.221 0.267 1.329 1.00 0.00 C ATOM 175 CG LEU A 15 -0.162 1.583 0.552 1.00 0.00 C ATOM 176 CD1 LEU A 15 0.224 1.329 -0.897 1.00 0.00 C ATOM 177 CD2 LEU A 15 -1.497 2.309 0.630 1.00 0.00 C ATOM 0 H LEU A 15 1.770 1.164 3.157 1.00 0.00 H new ATOM 0 HA LEU A 15 -1.138 0.659 3.234 1.00 0.00 H new ATOM 0 HB2 LEU A 15 0.602 -0.365 0.997 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -1.145 -0.247 1.064 1.00 0.00 H new ATOM 0 HG LEU A 15 0.600 2.217 1.005 1.00 0.00 H new ATOM 0 HD11 LEU A 15 0.261 2.276 -1.435 1.00 0.00 H new ATOM 0 HD12 LEU A 15 1.203 0.852 -0.934 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -0.515 0.677 -1.362 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -1.436 3.243 0.072 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -2.278 1.681 0.202 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -1.734 2.524 1.672 1.00 0.00 H new ATOM 189 N THR A 16 -0.733 -1.849 3.601 1.00 0.00 N ATOM 190 CA THR A 16 -0.485 -3.169 4.167 1.00 0.00 C ATOM 191 C THR A 16 -0.740 -4.265 3.139 1.00 0.00 C ATOM 192 O THR A 16 -1.889 -4.576 2.822 1.00 0.00 O ATOM 193 CB THR A 16 -1.369 -3.425 5.403 1.00 0.00 C ATOM 194 OG1 THR A 16 -1.080 -2.459 6.420 1.00 0.00 O ATOM 195 CG2 THR A 16 -1.143 -4.827 5.949 1.00 0.00 C ATOM 0 H THR A 16 -1.702 -1.681 3.331 1.00 0.00 H new ATOM 0 HA THR A 16 0.563 -3.193 4.467 1.00 0.00 H new ATOM 0 HB THR A 16 -2.412 -3.334 5.102 1.00 0.00 H new ATOM 0 HG1 THR A 16 -1.646 -2.628 7.202 1.00 0.00 H new ATOM 0 HG21 THR A 16 -1.778 -4.985 6.821 1.00 0.00 H new ATOM 0 HG22 THR A 16 -1.391 -5.561 5.182 1.00 0.00 H new ATOM 0 HG23 THR A 16 -0.098 -4.942 6.236 1.00 0.00 H new ATOM 203 N ILE A 17 0.336 -4.847 2.622 1.00 0.00 N ATOM 204 CA ILE A 17 0.228 -5.909 1.630 1.00 0.00 C ATOM 205 C ILE A 17 0.379 -7.282 2.277 1.00 0.00 C ATOM 206 O ILE A 17 1.436 -7.613 2.816 1.00 0.00 O ATOM 207 CB ILE A 17 1.288 -5.756 0.523 1.00 0.00 C ATOM 208 CG1 ILE A 17 1.331 -4.310 0.025 1.00 0.00 C ATOM 209 CG2 ILE A 17 0.994 -6.709 -0.626 1.00 0.00 C ATOM 210 CD1 ILE A 17 2.488 -4.027 -0.908 1.00 0.00 C ATOM 0 H ILE A 17 1.293 -4.601 2.874 1.00 0.00 H new ATOM 0 HA ILE A 17 -0.764 -5.826 1.185 1.00 0.00 H new ATOM 0 HB ILE A 17 2.264 -6.007 0.937 1.00 0.00 H new ATOM 0 HG12 ILE A 17 0.397 -4.083 -0.488 1.00 0.00 H new ATOM 0 HG13 ILE A 17 1.394 -3.640 0.883 1.00 0.00 H new ATOM 0 HG21 ILE A 17 1.751 -6.589 -1.401 1.00 0.00 H new ATOM 0 HG22 ILE A 17 1.008 -7.736 -0.260 1.00 0.00 H new ATOM 0 HG23 ILE A 17 0.011 -6.486 -1.042 1.00 0.00 H new ATOM 0 HD11 ILE A 17 2.456 -2.984 -1.221 1.00 0.00 H new ATOM 0 HD12 ILE A 17 3.428 -4.222 -0.392 1.00 0.00 H new ATOM 0 HD13 ILE A 17 2.415 -4.671 -1.784 1.00 0.00 H new ATOM 222 N ARG A 18 -0.683 -8.078 2.218 1.00 0.00 N ATOM 223 CA ARG A 18 -0.669 -9.416 2.797 1.00 0.00 C ATOM 224 C ARG A 18 -1.566 -10.362 2.004 1.00 0.00 C ATOM 225 O ARG A 18 -2.780 -10.167 1.932 1.00 0.00 O ATOM 226 CB ARG A 18 -1.124 -9.368 4.257 1.00 0.00 C ATOM 227 CG ARG A 18 -1.109 -10.723 4.945 1.00 0.00 C ATOM 228 CD ARG A 18 -2.122 -10.785 6.077 1.00 0.00 C ATOM 229 NE ARG A 18 -1.778 -9.879 7.170 1.00 0.00 N ATOM 230 CZ ARG A 18 -2.626 -9.531 8.131 1.00 0.00 C ATOM 231 NH1 ARG A 18 -3.862 -10.011 8.135 1.00 0.00 N ATOM 232 NH2 ARG A 18 -2.239 -8.702 9.092 1.00 0.00 N ATOM 0 H ARG A 18 -1.565 -7.820 1.775 1.00 0.00 H new ATOM 0 HA ARG A 18 0.353 -9.792 2.754 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -0.479 -8.683 4.807 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -2.133 -8.959 4.301 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -1.327 -11.504 4.217 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -0.112 -10.922 5.337 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -3.110 -10.531 5.693 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -2.180 -11.805 6.456 1.00 0.00 H new ATOM 0 HE ARG A 18 -0.835 -9.492 7.197 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -4.164 -10.649 7.399 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -4.511 -9.742 8.874 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -1.289 -8.331 9.093 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -2.892 -8.436 9.829 1.00 0.00 H new ATOM 246 N HIS A 19 -0.961 -11.385 1.411 1.00 0.00 N ATOM 247 CA HIS A 19 -1.705 -12.362 0.623 1.00 0.00 C ATOM 248 C HIS A 19 -2.002 -13.611 1.446 1.00 0.00 C ATOM 249 O HIS A 19 -1.092 -14.356 1.813 1.00 0.00 O ATOM 250 CB HIS A 19 -0.920 -12.739 -0.634 1.00 0.00 C ATOM 251 CG HIS A 19 -1.578 -13.806 -1.453 1.00 0.00 C ATOM 252 ND1 HIS A 19 -1.660 -15.122 -1.049 1.00 0.00 N ATOM 253 CD2 HIS A 19 -2.190 -13.745 -2.659 1.00 0.00 C ATOM 254 CE1 HIS A 19 -2.292 -15.825 -1.972 1.00 0.00 C ATOM 255 NE2 HIS A 19 -2.624 -15.013 -2.960 1.00 0.00 N ATOM 0 H HIS A 19 0.043 -11.560 1.461 1.00 0.00 H new ATOM 0 HA HIS A 19 -2.652 -11.909 0.328 1.00 0.00 H new ATOM 0 HB2 HIS A 19 -0.787 -11.850 -1.250 1.00 0.00 H new ATOM 0 HB3 HIS A 19 0.075 -13.077 -0.344 1.00 0.00 H new ATOM 0 HD2 HIS A 19 -2.314 -12.864 -3.271 1.00 0.00 H new ATOM 0 HE1 HIS A 19 -2.502 -16.883 -1.927 1.00 0.00 H new ATOM 0 HE2 HIS A 19 -3.122 -15.284 -3.808 1.00 0.00 H new ATOM 263 N SER A 20 -3.280 -13.835 1.734 1.00 0.00 N ATOM 264 CA SER A 20 -3.696 -14.992 2.518 1.00 0.00 C ATOM 265 C SER A 20 -3.718 -16.252 1.658 1.00 0.00 C ATOM 266 O SER A 20 -4.347 -16.284 0.600 1.00 0.00 O ATOM 267 CB SER A 20 -5.079 -14.752 3.126 1.00 0.00 C ATOM 268 OG SER A 20 -5.442 -15.806 4.000 1.00 0.00 O ATOM 0 H SER A 20 -4.046 -13.230 1.436 1.00 0.00 H new ATOM 0 HA SER A 20 -2.973 -15.134 3.321 1.00 0.00 H new ATOM 0 HB2 SER A 20 -5.082 -13.807 3.670 1.00 0.00 H new ATOM 0 HB3 SER A 20 -5.819 -14.664 2.331 1.00 0.00 H new ATOM 0 HG SER A 20 -6.026 -15.459 4.706 1.00 0.00 H new ATOM 274 N SER A 21 -3.025 -17.288 2.119 1.00 0.00 N ATOM 275 CA SER A 21 -2.961 -18.550 1.391 1.00 0.00 C ATOM 276 C SER A 21 -4.306 -19.269 1.431 1.00 0.00 C ATOM 277 O SER A 21 -4.795 -19.747 0.408 1.00 0.00 O ATOM 278 CB SER A 21 -1.872 -19.448 1.981 1.00 0.00 C ATOM 279 OG SER A 21 -2.023 -19.580 3.384 1.00 0.00 O ATOM 0 H SER A 21 -2.500 -17.278 2.993 1.00 0.00 H new ATOM 0 HA SER A 21 -2.717 -18.330 0.352 1.00 0.00 H new ATOM 0 HB2 SER A 21 -1.915 -20.432 1.514 1.00 0.00 H new ATOM 0 HB3 SER A 21 -0.891 -19.031 1.756 1.00 0.00 H new ATOM 0 HG SER A 21 -1.316 -20.160 3.736 1.00 0.00 H new ATOM 285 N GLN A 22 -4.896 -19.341 2.619 1.00 0.00 N ATOM 286 CA GLN A 22 -6.184 -20.003 2.793 1.00 0.00 C ATOM 287 C GLN A 22 -7.258 -19.337 1.939 1.00 0.00 C ATOM 288 O GLN A 22 -8.003 -20.010 1.226 1.00 0.00 O ATOM 289 CB GLN A 22 -6.600 -19.978 4.265 1.00 0.00 C ATOM 290 CG GLN A 22 -5.656 -20.747 5.176 1.00 0.00 C ATOM 291 CD GLN A 22 -6.284 -21.085 6.514 1.00 0.00 C ATOM 292 OE1 GLN A 22 -7.460 -21.441 6.589 1.00 0.00 O ATOM 293 NE2 GLN A 22 -5.500 -20.975 7.581 1.00 0.00 N ATOM 0 H GLN A 22 -4.504 -18.950 3.475 1.00 0.00 H new ATOM 0 HA GLN A 22 -6.078 -21.039 2.470 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -6.654 -18.943 4.602 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -7.602 -20.396 4.358 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -5.348 -21.668 4.680 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -4.755 -20.157 5.341 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -4.531 -20.676 7.473 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -5.867 -21.189 8.508 1.00 0.00 H new ATOM 302 N ARG A 23 -7.331 -18.012 2.015 1.00 0.00 N ATOM 303 CA ARG A 23 -8.314 -17.256 1.249 1.00 0.00 C ATOM 304 C ARG A 23 -7.837 -17.037 -0.183 1.00 0.00 C ATOM 305 O ARG A 23 -8.643 -16.899 -1.102 1.00 0.00 O ATOM 306 CB ARG A 23 -8.586 -15.908 1.919 1.00 0.00 C ATOM 307 CG ARG A 23 -9.708 -15.952 2.943 1.00 0.00 C ATOM 308 CD ARG A 23 -9.199 -16.386 4.309 1.00 0.00 C ATOM 309 NE ARG A 23 -8.573 -15.284 5.035 1.00 0.00 N ATOM 310 CZ ARG A 23 -8.305 -15.320 6.336 1.00 0.00 C ATOM 311 NH1 ARG A 23 -8.606 -16.396 7.049 1.00 0.00 N ATOM 312 NH2 ARG A 23 -7.734 -14.277 6.925 1.00 0.00 N ATOM 0 H ARG A 23 -6.721 -17.440 2.599 1.00 0.00 H new ATOM 0 HA ARG A 23 -9.238 -17.834 1.221 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -7.674 -15.564 2.407 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -8.834 -15.174 1.152 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -10.169 -14.968 3.021 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -10.483 -16.641 2.606 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -10.028 -16.782 4.896 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -8.479 -17.195 4.187 1.00 0.00 H new ATOM 0 HE ARG A 23 -8.328 -14.441 4.515 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -9.045 -17.200 6.599 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -8.399 -16.421 8.047 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -7.501 -13.448 6.379 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -7.528 -14.305 7.924 1.00 0.00 H new ATOM 326 N ASN A 24 -6.520 -17.006 -0.365 1.00 0.00 N ATOM 327 CA ASN A 24 -5.935 -16.802 -1.685 1.00 0.00 C ATOM 328 C ASN A 24 -6.394 -15.476 -2.285 1.00 0.00 C ATOM 329 O ASN A 24 -6.807 -15.416 -3.443 1.00 0.00 O ATOM 330 CB ASN A 24 -6.315 -17.955 -2.617 1.00 0.00 C ATOM 331 CG ASN A 24 -6.103 -19.312 -1.975 1.00 0.00 C ATOM 332 OD1 ASN A 24 -6.991 -19.839 -1.304 1.00 0.00 O ATOM 333 ND2 ASN A 24 -4.922 -19.884 -2.178 1.00 0.00 N ATOM 0 H ASN A 24 -5.838 -17.120 0.385 1.00 0.00 H new ATOM 0 HA ASN A 24 -4.851 -16.774 -1.574 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -7.360 -17.853 -2.908 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -5.722 -17.891 -3.529 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -4.721 -20.797 -1.771 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -4.216 -19.410 -2.741 1.00 0.00 H new ATOM 340 N LYS A 25 -6.317 -14.415 -1.489 1.00 0.00 N ATOM 341 CA LYS A 25 -6.721 -13.089 -1.939 1.00 0.00 C ATOM 342 C LYS A 25 -5.675 -12.044 -1.564 1.00 0.00 C ATOM 343 O LYS A 25 -4.904 -12.234 -0.622 1.00 0.00 O ATOM 344 CB LYS A 25 -8.075 -12.712 -1.333 1.00 0.00 C ATOM 345 CG LYS A 25 -9.180 -13.707 -1.645 1.00 0.00 C ATOM 346 CD LYS A 25 -10.552 -13.060 -1.561 1.00 0.00 C ATOM 347 CE LYS A 25 -11.640 -14.092 -1.305 1.00 0.00 C ATOM 348 NZ LYS A 25 -11.950 -14.886 -2.526 1.00 0.00 N ATOM 0 H LYS A 25 -5.978 -14.448 -0.528 1.00 0.00 H new ATOM 0 HA LYS A 25 -6.810 -13.114 -3.025 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -7.969 -12.627 -0.252 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -8.368 -11.729 -1.702 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -9.030 -14.117 -2.644 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -9.127 -14.542 -0.946 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.557 -12.318 -0.762 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -10.763 -12.530 -2.490 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -11.323 -14.763 -0.506 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -12.543 -13.589 -0.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -12.696 -15.578 -2.310 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -12.276 -14.249 -3.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -11.094 -15.386 -2.841 1.00 0.00 H new ATOM 362 N LEU A 26 -5.655 -10.942 -2.304 1.00 0.00 N ATOM 363 CA LEU A 26 -4.704 -9.865 -2.048 1.00 0.00 C ATOM 364 C LEU A 26 -5.398 -8.667 -1.408 1.00 0.00 C ATOM 365 O LEU A 26 -6.125 -7.929 -2.075 1.00 0.00 O ATOM 366 CB LEU A 26 -4.022 -9.440 -3.349 1.00 0.00 C ATOM 367 CG LEU A 26 -2.871 -8.444 -3.209 1.00 0.00 C ATOM 368 CD1 LEU A 26 -1.606 -9.152 -2.748 1.00 0.00 C ATOM 369 CD2 LEU A 26 -2.630 -7.718 -4.524 1.00 0.00 C ATOM 0 H LEU A 26 -6.286 -10.770 -3.087 1.00 0.00 H new ATOM 0 HA LEU A 26 -3.949 -10.237 -1.355 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -3.644 -10.333 -3.846 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -4.775 -9.004 -4.005 1.00 0.00 H new ATOM 0 HG LEU A 26 -3.145 -7.706 -2.455 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -0.797 -8.427 -2.654 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -1.785 -9.624 -1.782 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -1.328 -9.913 -3.478 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -1.807 -7.013 -4.405 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -2.378 -8.442 -5.299 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -3.532 -7.178 -4.812 1.00 0.00 H new ATOM 381 N ILE A 27 -5.168 -8.477 -0.113 1.00 0.00 N ATOM 382 CA ILE A 27 -5.768 -7.366 0.614 1.00 0.00 C ATOM 383 C ILE A 27 -4.814 -6.179 0.689 1.00 0.00 C ATOM 384 O ILE A 27 -3.701 -6.294 1.202 1.00 0.00 O ATOM 385 CB ILE A 27 -6.168 -7.780 2.043 1.00 0.00 C ATOM 386 CG1 ILE A 27 -7.306 -8.802 2.001 1.00 0.00 C ATOM 387 CG2 ILE A 27 -6.575 -6.558 2.854 1.00 0.00 C ATOM 388 CD1 ILE A 27 -6.829 -10.236 1.938 1.00 0.00 C ATOM 0 H ILE A 27 -4.570 -9.078 0.454 1.00 0.00 H new ATOM 0 HA ILE A 27 -6.663 -7.075 0.064 1.00 0.00 H new ATOM 0 HB ILE A 27 -5.307 -8.242 2.526 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -7.931 -8.674 2.885 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -7.934 -8.598 1.134 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -6.855 -6.867 3.861 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -5.738 -5.861 2.907 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -7.424 -6.070 2.375 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -7.689 -10.905 1.911 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -6.228 -10.381 1.040 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -6.225 -10.458 2.818 1.00 0.00 H new ATOM 400 N VAL A 28 -5.259 -5.036 0.176 1.00 0.00 N ATOM 401 CA VAL A 28 -4.446 -3.826 0.187 1.00 0.00 C ATOM 402 C VAL A 28 -5.176 -2.680 0.879 1.00 0.00 C ATOM 403 O VAL A 28 -6.168 -2.162 0.366 1.00 0.00 O ATOM 404 CB VAL A 28 -4.067 -3.391 -1.241 1.00 0.00 C ATOM 405 CG1 VAL A 28 -3.112 -2.207 -1.203 1.00 0.00 C ATOM 406 CG2 VAL A 28 -3.457 -4.554 -2.008 1.00 0.00 C ATOM 0 H VAL A 28 -6.178 -4.923 -0.252 1.00 0.00 H new ATOM 0 HA VAL A 28 -3.537 -4.061 0.740 1.00 0.00 H new ATOM 0 HB VAL A 28 -4.974 -3.079 -1.760 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -2.855 -1.914 -2.221 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -3.590 -1.370 -0.694 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -2.205 -2.488 -0.667 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -3.195 -4.229 -3.015 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -2.560 -4.899 -1.493 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -4.178 -5.369 -2.066 1.00 0.00 H new ATOM 416 N VAL A 29 -4.678 -2.288 2.047 1.00 0.00 N ATOM 417 CA VAL A 29 -5.282 -1.202 2.810 1.00 0.00 C ATOM 418 C VAL A 29 -4.590 0.125 2.519 1.00 0.00 C ATOM 419 O VAL A 29 -3.384 0.169 2.277 1.00 0.00 O ATOM 420 CB VAL A 29 -5.222 -1.478 4.324 1.00 0.00 C ATOM 421 CG1 VAL A 29 -5.988 -0.412 5.092 1.00 0.00 C ATOM 422 CG2 VAL A 29 -5.765 -2.864 4.634 1.00 0.00 C ATOM 0 H VAL A 29 -3.858 -2.706 2.486 1.00 0.00 H new ATOM 0 HA VAL A 29 -6.325 -1.140 2.501 1.00 0.00 H new ATOM 0 HB VAL A 29 -4.180 -1.442 4.642 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -5.934 -0.624 6.160 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -5.549 0.566 4.893 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -7.031 -0.413 4.774 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -5.715 -3.042 5.708 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -6.801 -2.931 4.303 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -5.168 -3.613 4.114 1.00 0.00 H new ATOM 432 N VAL A 30 -5.362 1.207 2.543 1.00 0.00 N ATOM 433 CA VAL A 30 -4.823 2.537 2.283 1.00 0.00 C ATOM 434 C VAL A 30 -5.166 3.499 3.415 1.00 0.00 C ATOM 435 O VAL A 30 -6.252 4.081 3.442 1.00 0.00 O ATOM 436 CB VAL A 30 -5.358 3.109 0.957 1.00 0.00 C ATOM 437 CG1 VAL A 30 -4.507 4.284 0.501 1.00 0.00 C ATOM 438 CG2 VAL A 30 -5.403 2.027 -0.111 1.00 0.00 C ATOM 0 H VAL A 30 -6.363 1.189 2.740 1.00 0.00 H new ATOM 0 HA VAL A 30 -3.740 2.433 2.214 1.00 0.00 H new ATOM 0 HB VAL A 30 -6.374 3.468 1.120 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -4.900 4.675 -0.437 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -4.531 5.067 1.259 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -3.479 3.953 0.354 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -5.784 2.449 -1.041 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -4.399 1.635 -0.274 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -6.059 1.220 0.216 1.00 0.00 H new ATOM 448 N HIS A 31 -4.234 3.664 4.347 1.00 0.00 N ATOM 449 CA HIS A 31 -4.436 4.558 5.482 1.00 0.00 C ATOM 450 C HIS A 31 -4.546 6.007 5.019 1.00 0.00 C ATOM 451 O HIS A 31 -5.627 6.594 5.035 1.00 0.00 O ATOM 452 CB HIS A 31 -3.289 4.415 6.482 1.00 0.00 C ATOM 453 CG HIS A 31 -3.103 3.016 6.985 1.00 0.00 C ATOM 454 ND1 HIS A 31 -3.890 2.460 7.970 1.00 0.00 N ATOM 455 CD2 HIS A 31 -2.213 2.059 6.631 1.00 0.00 C ATOM 456 CE1 HIS A 31 -3.492 1.222 8.202 1.00 0.00 C ATOM 457 NE2 HIS A 31 -2.476 0.954 7.402 1.00 0.00 N ATOM 0 H HIS A 31 -3.331 3.190 4.339 1.00 0.00 H new ATOM 0 HA HIS A 31 -5.370 4.279 5.970 1.00 0.00 H new ATOM 0 HB2 HIS A 31 -2.364 4.749 6.012 1.00 0.00 H new ATOM 0 HB3 HIS A 31 -3.472 5.076 7.329 1.00 0.00 H new ATOM 0 HD2 HIS A 31 -1.440 2.148 5.882 1.00 0.00 H new ATOM 0 HE1 HIS A 31 -3.924 0.544 8.923 1.00 0.00 H new ATOM 0 HE2 HIS A 31 -1.969 0.070 7.363 1.00 0.00 H new ATOM 465 N ALA A 32 -3.419 6.579 4.608 1.00 0.00 N ATOM 466 CA ALA A 32 -3.389 7.959 4.139 1.00 0.00 C ATOM 467 C ALA A 32 -2.011 8.325 3.597 1.00 0.00 C ATOM 468 O ALA A 32 -1.010 7.700 3.948 1.00 0.00 O ATOM 469 CB ALA A 32 -3.785 8.906 5.262 1.00 0.00 C ATOM 0 H ALA A 32 -2.514 6.108 4.590 1.00 0.00 H new ATOM 0 HA ALA A 32 -4.108 8.056 3.325 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -3.758 9.933 4.898 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -4.793 8.667 5.601 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -3.088 8.797 6.093 1.00 0.00 H new ATOM 475 N CYS A 33 -1.968 9.338 2.740 1.00 0.00 N ATOM 476 CA CYS A 33 -0.713 9.786 2.148 1.00 0.00 C ATOM 477 C CYS A 33 -0.270 11.115 2.752 1.00 0.00 C ATOM 478 O CYS A 33 -1.096 11.909 3.204 1.00 0.00 O ATOM 479 CB CYS A 33 -0.861 9.926 0.632 1.00 0.00 C ATOM 480 SG CYS A 33 -1.603 8.487 -0.173 1.00 0.00 S ATOM 0 H CYS A 33 -2.788 9.865 2.439 1.00 0.00 H new ATOM 0 HA CYS A 33 0.049 9.037 2.364 1.00 0.00 H new ATOM 0 HB2 CYS A 33 -1.470 10.804 0.417 1.00 0.00 H new ATOM 0 HB3 CYS A 33 0.122 10.106 0.197 1.00 0.00 H new ATOM 0 HG CYS A 33 -1.688 8.701 -1.452 1.00 0.00 H new ATOM 486 N ARG A 34 1.038 11.350 2.758 1.00 0.00 N ATOM 487 CA ARG A 34 1.591 12.581 3.310 1.00 0.00 C ATOM 488 C ARG A 34 2.769 13.071 2.472 1.00 0.00 C ATOM 489 O ARG A 34 3.378 12.302 1.731 1.00 0.00 O ATOM 490 CB ARG A 34 2.036 12.362 4.757 1.00 0.00 C ATOM 491 CG ARG A 34 3.286 11.506 4.886 1.00 0.00 C ATOM 492 CD ARG A 34 3.424 10.930 6.287 1.00 0.00 C ATOM 493 NE ARG A 34 4.774 10.435 6.544 1.00 0.00 N ATOM 494 CZ ARG A 34 5.830 11.226 6.698 1.00 0.00 C ATOM 495 NH1 ARG A 34 5.693 12.543 6.621 1.00 0.00 N ATOM 496 NH2 ARG A 34 7.026 10.700 6.930 1.00 0.00 N ATOM 0 H ARG A 34 1.735 10.704 2.387 1.00 0.00 H new ATOM 0 HA ARG A 34 0.811 13.342 3.289 1.00 0.00 H new ATOM 0 HB2 ARG A 34 2.219 13.330 5.223 1.00 0.00 H new ATOM 0 HB3 ARG A 34 1.224 11.891 5.311 1.00 0.00 H new ATOM 0 HG2 ARG A 34 3.249 10.694 4.160 1.00 0.00 H new ATOM 0 HG3 ARG A 34 4.165 12.106 4.650 1.00 0.00 H new ATOM 0 HD2 ARG A 34 3.173 11.696 7.020 1.00 0.00 H new ATOM 0 HD3 ARG A 34 2.709 10.118 6.417 1.00 0.00 H new ATOM 0 HE ARG A 34 4.913 9.427 6.609 1.00 0.00 H new ATOM 0 HH11 ARG A 34 4.775 12.951 6.443 1.00 0.00 H new ATOM 0 HH12 ARG A 34 6.506 13.148 6.740 1.00 0.00 H new ATOM 0 HH21 ARG A 34 7.135 9.688 6.990 1.00 0.00 H new ATOM 0 HH22 ARG A 34 7.836 11.308 7.048 1.00 0.00 H new ATOM 510 N ASN A 35 3.082 14.357 2.597 1.00 0.00 N ATOM 511 CA ASN A 35 4.186 14.950 1.850 1.00 0.00 C ATOM 512 C ASN A 35 3.935 14.864 0.348 1.00 0.00 C ATOM 513 O ASN A 35 4.818 14.480 -0.419 1.00 0.00 O ATOM 514 CB ASN A 35 5.500 14.249 2.200 1.00 0.00 C ATOM 515 CG ASN A 35 5.770 14.237 3.692 1.00 0.00 C ATOM 516 OD1 ASN A 35 4.940 14.677 4.488 1.00 0.00 O ATOM 517 ND2 ASN A 35 6.936 13.732 4.078 1.00 0.00 N ATOM 0 H ASN A 35 2.588 15.008 3.208 1.00 0.00 H new ATOM 0 HA ASN A 35 4.257 16.001 2.128 1.00 0.00 H new ATOM 0 HB2 ASN A 35 5.471 13.224 1.831 1.00 0.00 H new ATOM 0 HB3 ASN A 35 6.323 14.749 1.689 1.00 0.00 H new ATOM 0 HD21 ASN A 35 7.174 13.698 5.069 1.00 0.00 H new ATOM 0 HD22 ASN A 35 7.594 13.378 3.383 1.00 0.00 H new ATOM 524 N LEU A 36 2.725 15.226 -0.065 1.00 0.00 N ATOM 525 CA LEU A 36 2.357 15.192 -1.477 1.00 0.00 C ATOM 526 C LEU A 36 2.395 16.591 -2.083 1.00 0.00 C ATOM 527 O LEU A 36 1.432 17.351 -1.974 1.00 0.00 O ATOM 528 CB LEU A 36 0.962 14.587 -1.645 1.00 0.00 C ATOM 529 CG LEU A 36 0.875 13.064 -1.551 1.00 0.00 C ATOM 530 CD1 LEU A 36 -0.566 12.601 -1.706 1.00 0.00 C ATOM 531 CD2 LEU A 36 1.762 12.413 -2.603 1.00 0.00 C ATOM 0 H LEU A 36 1.983 15.546 0.557 1.00 0.00 H new ATOM 0 HA LEU A 36 3.082 14.570 -2.002 1.00 0.00 H new ATOM 0 HB2 LEU A 36 0.308 15.016 -0.886 1.00 0.00 H new ATOM 0 HB3 LEU A 36 0.569 14.894 -2.614 1.00 0.00 H new ATOM 0 HG LEU A 36 1.229 12.759 -0.566 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -0.608 11.514 -1.636 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -1.176 13.039 -0.916 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -0.947 12.918 -2.677 1.00 0.00 H new ATOM 0 HD21 LEU A 36 1.688 11.329 -2.521 1.00 0.00 H new ATOM 0 HD22 LEU A 36 1.438 12.725 -3.596 1.00 0.00 H new ATOM 0 HD23 LEU A 36 2.797 12.718 -2.446 1.00 0.00 H new ATOM 543 N ILE A 37 3.510 16.922 -2.725 1.00 0.00 N ATOM 544 CA ILE A 37 3.671 18.228 -3.352 1.00 0.00 C ATOM 545 C ILE A 37 2.597 18.466 -4.408 1.00 0.00 C ATOM 546 O ILE A 37 2.419 17.660 -5.320 1.00 0.00 O ATOM 547 CB ILE A 37 5.058 18.371 -4.005 1.00 0.00 C ATOM 548 CG1 ILE A 37 5.260 17.290 -5.068 1.00 0.00 C ATOM 549 CG2 ILE A 37 6.151 18.295 -2.950 1.00 0.00 C ATOM 550 CD1 ILE A 37 4.794 17.703 -6.447 1.00 0.00 C ATOM 0 H ILE A 37 4.315 16.304 -2.825 1.00 0.00 H new ATOM 0 HA ILE A 37 3.572 18.973 -2.562 1.00 0.00 H new ATOM 0 HB ILE A 37 5.116 19.346 -4.490 1.00 0.00 H new ATOM 0 HG12 ILE A 37 6.318 17.030 -5.114 1.00 0.00 H new ATOM 0 HG13 ILE A 37 4.723 16.391 -4.766 1.00 0.00 H new ATOM 0 HG21 ILE A 37 7.125 18.398 -3.428 1.00 0.00 H new ATOM 0 HG22 ILE A 37 6.015 19.099 -2.227 1.00 0.00 H new ATOM 0 HG23 ILE A 37 6.097 17.334 -2.439 1.00 0.00 H new ATOM 0 HD11 ILE A 37 4.968 16.888 -7.149 1.00 0.00 H new ATOM 0 HD12 ILE A 37 3.729 17.935 -6.417 1.00 0.00 H new ATOM 0 HD13 ILE A 37 5.348 18.584 -6.770 1.00 0.00 H new ATOM 562 N ALA A 38 1.885 19.581 -4.278 1.00 0.00 N ATOM 563 CA ALA A 38 0.831 19.928 -5.223 1.00 0.00 C ATOM 564 C ALA A 38 1.387 20.728 -6.397 1.00 0.00 C ATOM 565 O ALA A 38 2.020 21.767 -6.208 1.00 0.00 O ATOM 566 CB ALA A 38 -0.269 20.711 -4.523 1.00 0.00 C ATOM 0 H ALA A 38 2.019 20.259 -3.528 1.00 0.00 H new ATOM 0 HA ALA A 38 0.410 19.002 -5.615 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -1.049 20.963 -5.241 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -0.694 20.105 -3.723 1.00 0.00 H new ATOM 0 HB3 ALA A 38 0.147 21.627 -4.103 1.00 0.00 H new ATOM 572 N PHE A 39 1.148 20.237 -7.608 1.00 0.00 N ATOM 573 CA PHE A 39 1.627 20.905 -8.812 1.00 0.00 C ATOM 574 C PHE A 39 1.317 22.399 -8.765 1.00 0.00 C ATOM 575 O PHE A 39 2.069 23.217 -9.295 1.00 0.00 O ATOM 576 CB PHE A 39 0.991 20.280 -10.056 1.00 0.00 C ATOM 577 CG PHE A 39 1.861 20.359 -11.278 1.00 0.00 C ATOM 578 CD1 PHE A 39 2.170 21.584 -11.845 1.00 0.00 C ATOM 579 CD2 PHE A 39 2.369 19.208 -11.859 1.00 0.00 C ATOM 580 CE1 PHE A 39 2.969 21.660 -12.971 1.00 0.00 C ATOM 581 CE2 PHE A 39 3.169 19.278 -12.984 1.00 0.00 C ATOM 582 CZ PHE A 39 3.470 20.505 -13.540 1.00 0.00 C ATOM 0 H PHE A 39 0.625 19.379 -7.782 1.00 0.00 H new ATOM 0 HA PHE A 39 2.708 20.777 -8.862 1.00 0.00 H new ATOM 0 HB2 PHE A 39 0.761 19.235 -9.850 1.00 0.00 H new ATOM 0 HB3 PHE A 39 0.044 20.780 -10.261 1.00 0.00 H new ATOM 0 HD1 PHE A 39 1.783 22.490 -11.403 1.00 0.00 H new ATOM 0 HD2 PHE A 39 2.137 18.245 -11.428 1.00 0.00 H new ATOM 0 HE1 PHE A 39 3.201 22.621 -13.405 1.00 0.00 H new ATOM 0 HE2 PHE A 39 3.558 18.373 -13.428 1.00 0.00 H new ATOM 0 HZ PHE A 39 4.096 20.562 -14.418 1.00 0.00 H new ATOM 592 N SER A 40 0.203 22.746 -8.128 1.00 0.00 N ATOM 593 CA SER A 40 -0.210 24.140 -8.015 1.00 0.00 C ATOM 594 C SER A 40 -0.692 24.450 -6.601 1.00 0.00 C ATOM 595 O SER A 40 -1.710 23.924 -6.152 1.00 0.00 O ATOM 596 CB SER A 40 -1.318 24.449 -9.024 1.00 0.00 C ATOM 597 OG SER A 40 -0.800 24.531 -10.340 1.00 0.00 O ATOM 0 H SER A 40 -0.429 22.081 -7.682 1.00 0.00 H new ATOM 0 HA SER A 40 0.654 24.769 -8.232 1.00 0.00 H new ATOM 0 HB2 SER A 40 -2.083 23.673 -8.978 1.00 0.00 H new ATOM 0 HB3 SER A 40 -1.802 25.390 -8.761 1.00 0.00 H new ATOM 0 HG SER A 40 -1.528 24.728 -10.966 1.00 0.00 H new ATOM 603 N GLU A 41 0.047 25.309 -5.906 1.00 0.00 N ATOM 604 CA GLU A 41 -0.305 25.689 -4.543 1.00 0.00 C ATOM 605 C GLU A 41 -1.818 25.812 -4.385 1.00 0.00 C ATOM 606 O GLU A 41 -2.388 25.360 -3.392 1.00 0.00 O ATOM 607 CB GLU A 41 0.366 27.013 -4.169 1.00 0.00 C ATOM 608 CG GLU A 41 1.834 26.868 -3.802 1.00 0.00 C ATOM 609 CD GLU A 41 2.551 28.202 -3.728 1.00 0.00 C ATOM 610 OE1 GLU A 41 3.008 28.688 -4.784 1.00 0.00 O ATOM 611 OE2 GLU A 41 2.655 28.760 -2.616 1.00 0.00 O ATOM 0 H GLU A 41 0.892 25.754 -6.264 1.00 0.00 H new ATOM 0 HA GLU A 41 0.051 24.907 -3.873 1.00 0.00 H new ATOM 0 HB2 GLU A 41 0.276 27.706 -5.006 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -0.168 27.457 -3.329 1.00 0.00 H new ATOM 0 HG2 GLU A 41 1.916 26.362 -2.840 1.00 0.00 H new ATOM 0 HG3 GLU A 41 2.328 26.235 -4.539 1.00 0.00 H new ATOM 618 N ASP A 42 -2.461 26.426 -5.372 1.00 0.00 N ATOM 619 CA ASP A 42 -3.908 26.609 -5.345 1.00 0.00 C ATOM 620 C ASP A 42 -4.597 25.397 -4.723 1.00 0.00 C ATOM 621 O ASP A 42 -5.473 25.538 -3.872 1.00 0.00 O ATOM 622 CB ASP A 42 -4.441 26.844 -6.759 1.00 0.00 C ATOM 623 CG ASP A 42 -5.956 26.835 -6.816 1.00 0.00 C ATOM 624 OD1 ASP A 42 -6.591 27.073 -5.767 1.00 0.00 O ATOM 625 OD2 ASP A 42 -6.506 26.591 -7.910 1.00 0.00 O ATOM 0 H ASP A 42 -2.003 26.806 -6.201 1.00 0.00 H new ATOM 0 HA ASP A 42 -4.127 27.484 -4.733 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -4.072 27.801 -7.129 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -4.051 26.073 -7.424 1.00 0.00 H new ATOM 630 N GLY A 43 -4.194 24.207 -5.157 1.00 0.00 N ATOM 631 CA GLY A 43 -4.784 22.988 -4.634 1.00 0.00 C ATOM 632 C GLY A 43 -4.769 21.857 -5.643 1.00 0.00 C ATOM 633 O GLY A 43 -4.928 22.084 -6.843 1.00 0.00 O ATOM 0 H GLY A 43 -3.470 24.065 -5.861 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -4.242 22.680 -3.740 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -5.812 23.187 -4.331 1.00 0.00 H new ATOM 637 N SER A 44 -4.576 20.635 -5.157 1.00 0.00 N ATOM 638 CA SER A 44 -4.536 19.465 -6.026 1.00 0.00 C ATOM 639 C SER A 44 -5.430 18.354 -5.483 1.00 0.00 C ATOM 640 O SER A 44 -5.678 18.274 -4.280 1.00 0.00 O ATOM 641 CB SER A 44 -3.099 18.957 -6.165 1.00 0.00 C ATOM 642 OG SER A 44 -2.685 18.270 -4.997 1.00 0.00 O ATOM 0 H SER A 44 -4.445 20.430 -4.167 1.00 0.00 H new ATOM 0 HA SER A 44 -4.907 19.759 -7.008 1.00 0.00 H new ATOM 0 HB2 SER A 44 -3.027 18.293 -7.026 1.00 0.00 H new ATOM 0 HB3 SER A 44 -2.430 19.797 -6.353 1.00 0.00 H new ATOM 0 HG SER A 44 -1.764 17.954 -5.112 1.00 0.00 H new ATOM 648 N ASP A 45 -5.910 17.499 -6.379 1.00 0.00 N ATOM 649 CA ASP A 45 -6.776 16.391 -5.991 1.00 0.00 C ATOM 650 C ASP A 45 -6.037 15.061 -6.098 1.00 0.00 C ATOM 651 O ASP A 45 -6.148 14.339 -7.089 1.00 0.00 O ATOM 652 CB ASP A 45 -8.029 16.365 -6.868 1.00 0.00 C ATOM 653 CG ASP A 45 -8.500 17.755 -7.247 1.00 0.00 C ATOM 654 OD1 ASP A 45 -8.241 18.701 -6.474 1.00 0.00 O ATOM 655 OD2 ASP A 45 -9.127 17.897 -8.317 1.00 0.00 O ATOM 0 H ASP A 45 -5.714 17.551 -7.379 1.00 0.00 H new ATOM 0 HA ASP A 45 -7.072 16.539 -4.952 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -7.823 15.795 -7.774 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -8.828 15.845 -6.339 1.00 0.00 H new ATOM 660 N PRO A 46 -5.264 14.728 -5.054 1.00 0.00 N ATOM 661 CA PRO A 46 -4.491 13.483 -5.007 1.00 0.00 C ATOM 662 C PRO A 46 -5.381 12.253 -4.865 1.00 0.00 C ATOM 663 O PRO A 46 -6.379 12.277 -4.145 1.00 0.00 O ATOM 664 CB PRO A 46 -3.616 13.656 -3.763 1.00 0.00 C ATOM 665 CG PRO A 46 -4.368 14.610 -2.900 1.00 0.00 C ATOM 666 CD PRO A 46 -5.085 15.541 -3.839 1.00 0.00 C ATOM 0 HA PRO A 46 -3.925 13.320 -5.924 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -3.457 12.704 -3.256 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -2.632 14.048 -4.022 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -5.074 14.083 -2.259 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -3.692 15.160 -2.245 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -6.041 15.867 -3.429 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -4.500 16.439 -4.039 1.00 0.00 H new ATOM 674 N TYR A 47 -5.012 11.180 -5.556 1.00 0.00 N ATOM 675 CA TYR A 47 -5.779 9.940 -5.508 1.00 0.00 C ATOM 676 C TYR A 47 -4.878 8.733 -5.746 1.00 0.00 C ATOM 677 O TYR A 47 -3.992 8.763 -6.601 1.00 0.00 O ATOM 678 CB TYR A 47 -6.899 9.969 -6.550 1.00 0.00 C ATOM 679 CG TYR A 47 -6.432 9.641 -7.950 1.00 0.00 C ATOM 680 CD1 TYR A 47 -6.377 8.326 -8.395 1.00 0.00 C ATOM 681 CD2 TYR A 47 -6.044 10.646 -8.827 1.00 0.00 C ATOM 682 CE1 TYR A 47 -5.950 8.021 -9.673 1.00 0.00 C ATOM 683 CE2 TYR A 47 -5.617 10.351 -10.108 1.00 0.00 C ATOM 684 CZ TYR A 47 -5.572 9.037 -10.526 1.00 0.00 C ATOM 685 OH TYR A 47 -5.146 8.739 -11.800 1.00 0.00 O ATOM 0 H TYR A 47 -4.188 11.144 -6.155 1.00 0.00 H new ATOM 0 HA TYR A 47 -6.218 9.852 -4.514 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -7.673 9.259 -6.259 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -7.357 10.958 -6.551 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -6.673 7.528 -7.730 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -6.077 11.676 -8.502 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -5.912 6.993 -10.002 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -5.320 11.145 -10.778 1.00 0.00 H new ATOM 0 HH TYR A 47 -4.918 9.568 -12.271 1.00 0.00 H new ATOM 695 N VAL A 48 -5.110 7.669 -4.984 1.00 0.00 N ATOM 696 CA VAL A 48 -4.322 6.449 -5.112 1.00 0.00 C ATOM 697 C VAL A 48 -4.876 5.549 -6.210 1.00 0.00 C ATOM 698 O VAL A 48 -6.086 5.496 -6.431 1.00 0.00 O ATOM 699 CB VAL A 48 -4.286 5.663 -3.788 1.00 0.00 C ATOM 700 CG1 VAL A 48 -3.412 4.426 -3.926 1.00 0.00 C ATOM 701 CG2 VAL A 48 -3.794 6.550 -2.655 1.00 0.00 C ATOM 0 H VAL A 48 -5.838 7.627 -4.271 1.00 0.00 H new ATOM 0 HA VAL A 48 -3.308 6.753 -5.373 1.00 0.00 H new ATOM 0 HB VAL A 48 -5.299 5.338 -3.550 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -3.398 3.883 -2.981 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -3.814 3.782 -4.709 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -2.397 4.725 -4.187 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -3.775 5.978 -1.727 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -2.789 6.907 -2.882 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.465 7.402 -2.542 1.00 0.00 H new ATOM 711 N ARG A 49 -3.984 4.842 -6.896 1.00 0.00 N ATOM 712 CA ARG A 49 -4.384 3.944 -7.972 1.00 0.00 C ATOM 713 C ARG A 49 -3.809 2.547 -7.756 1.00 0.00 C ATOM 714 O ARG A 49 -2.627 2.392 -7.453 1.00 0.00 O ATOM 715 CB ARG A 49 -3.921 4.494 -9.322 1.00 0.00 C ATOM 716 CG ARG A 49 -4.722 3.967 -10.502 1.00 0.00 C ATOM 717 CD ARG A 49 -4.768 4.975 -11.639 1.00 0.00 C ATOM 718 NE ARG A 49 -4.971 4.330 -12.934 1.00 0.00 N ATOM 719 CZ ARG A 49 -4.890 4.971 -14.095 1.00 0.00 C ATOM 720 NH1 ARG A 49 -4.612 6.267 -14.122 1.00 0.00 N ATOM 721 NH2 ARG A 49 -5.087 4.315 -15.231 1.00 0.00 N ATOM 0 H ARG A 49 -2.979 4.874 -6.725 1.00 0.00 H new ATOM 0 HA ARG A 49 -5.472 3.875 -7.969 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -3.989 5.582 -9.304 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -2.870 4.243 -9.466 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -4.279 3.036 -10.857 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -5.737 3.734 -10.179 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -5.573 5.688 -11.459 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -3.838 5.542 -11.658 1.00 0.00 H new ATOM 0 HE ARG A 49 -5.187 3.333 -12.948 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -4.460 6.774 -13.250 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -4.550 6.757 -15.015 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -5.301 3.318 -15.214 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -5.025 4.808 -16.122 1.00 0.00 H new ATOM 735 N MET A 50 -4.655 1.534 -7.914 1.00 0.00 N ATOM 736 CA MET A 50 -4.231 0.150 -7.737 1.00 0.00 C ATOM 737 C MET A 50 -4.554 -0.680 -8.976 1.00 0.00 C ATOM 738 O MET A 50 -5.683 -0.668 -9.465 1.00 0.00 O ATOM 739 CB MET A 50 -4.908 -0.460 -6.509 1.00 0.00 C ATOM 740 CG MET A 50 -4.359 0.060 -5.191 1.00 0.00 C ATOM 741 SD MET A 50 -4.838 -0.964 -3.786 1.00 0.00 S ATOM 742 CE MET A 50 -6.451 -0.285 -3.407 1.00 0.00 C ATOM 0 H MET A 50 -5.638 1.646 -8.164 1.00 0.00 H new ATOM 0 HA MET A 50 -3.151 0.143 -7.588 1.00 0.00 H new ATOM 0 HB2 MET A 50 -5.977 -0.254 -6.554 1.00 0.00 H new ATOM 0 HB3 MET A 50 -4.790 -1.543 -6.540 1.00 0.00 H new ATOM 0 HG2 MET A 50 -3.271 0.106 -5.248 1.00 0.00 H new ATOM 0 HG3 MET A 50 -4.713 1.078 -5.031 1.00 0.00 H new ATOM 0 HE1 MET A 50 -6.457 0.087 -2.383 1.00 0.00 H new ATOM 0 HE2 MET A 50 -6.671 0.534 -4.092 1.00 0.00 H new ATOM 0 HE3 MET A 50 -7.208 -1.062 -3.515 1.00 0.00 H new ATOM 752 N TYR A 51 -3.555 -1.399 -9.477 1.00 0.00 N ATOM 753 CA TYR A 51 -3.733 -2.232 -10.660 1.00 0.00 C ATOM 754 C TYR A 51 -2.988 -3.555 -10.511 1.00 0.00 C ATOM 755 O TYR A 51 -1.860 -3.594 -10.017 1.00 0.00 O ATOM 756 CB TYR A 51 -3.243 -1.496 -11.907 1.00 0.00 C ATOM 757 CG TYR A 51 -4.307 -0.650 -12.569 1.00 0.00 C ATOM 758 CD1 TYR A 51 -4.875 0.431 -11.906 1.00 0.00 C ATOM 759 CD2 TYR A 51 -4.746 -0.932 -13.857 1.00 0.00 C ATOM 760 CE1 TYR A 51 -5.848 1.206 -12.506 1.00 0.00 C ATOM 761 CE2 TYR A 51 -5.718 -0.162 -14.465 1.00 0.00 C ATOM 762 CZ TYR A 51 -6.266 0.906 -13.786 1.00 0.00 C ATOM 763 OH TYR A 51 -7.235 1.675 -14.388 1.00 0.00 O ATOM 0 H TYR A 51 -2.615 -1.421 -9.082 1.00 0.00 H new ATOM 0 HA TYR A 51 -4.797 -2.444 -10.767 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -2.401 -0.859 -11.635 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -2.871 -2.226 -12.626 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -4.550 0.669 -10.904 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -4.320 -1.768 -14.392 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -6.279 2.042 -11.976 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -6.047 -0.395 -15.467 1.00 0.00 H new ATOM 0 HH TYR A 51 -7.414 1.330 -15.288 1.00 0.00 H new ATOM 773 N LEU A 52 -3.626 -4.638 -10.942 1.00 0.00 N ATOM 774 CA LEU A 52 -3.025 -5.964 -10.859 1.00 0.00 C ATOM 775 C LEU A 52 -2.296 -6.315 -12.152 1.00 0.00 C ATOM 776 O LEU A 52 -2.871 -6.920 -13.057 1.00 0.00 O ATOM 777 CB LEU A 52 -4.097 -7.014 -10.564 1.00 0.00 C ATOM 778 CG LEU A 52 -3.609 -8.309 -9.913 1.00 0.00 C ATOM 779 CD1 LEU A 52 -2.573 -8.009 -8.840 1.00 0.00 C ATOM 780 CD2 LEU A 52 -4.778 -9.085 -9.326 1.00 0.00 C ATOM 0 H LEU A 52 -4.560 -4.623 -11.353 1.00 0.00 H new ATOM 0 HA LEU A 52 -2.299 -5.956 -10.046 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -4.848 -6.565 -9.914 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -4.596 -7.267 -11.499 1.00 0.00 H new ATOM 0 HG LEU A 52 -3.140 -8.925 -10.681 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -2.237 -8.942 -8.388 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -1.722 -7.496 -9.289 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -3.016 -7.373 -8.074 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -4.411 -10.003 -8.867 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -5.277 -8.476 -8.572 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -5.485 -9.332 -10.118 1.00 0.00 H new ATOM 792 N LEU A 53 -1.027 -5.932 -12.232 1.00 0.00 N ATOM 793 CA LEU A 53 -0.217 -6.207 -13.414 1.00 0.00 C ATOM 794 C LEU A 53 0.028 -7.705 -13.570 1.00 0.00 C ATOM 795 O LEU A 53 0.001 -8.467 -12.603 1.00 0.00 O ATOM 796 CB LEU A 53 1.119 -5.467 -13.326 1.00 0.00 C ATOM 797 CG LEU A 53 1.064 -3.955 -13.550 1.00 0.00 C ATOM 798 CD1 LEU A 53 0.790 -3.642 -15.012 1.00 0.00 C ATOM 799 CD2 LEU A 53 0.006 -3.322 -12.659 1.00 0.00 C ATOM 0 H LEU A 53 -0.536 -5.430 -11.492 1.00 0.00 H new ATOM 0 HA LEU A 53 -0.764 -5.854 -14.288 1.00 0.00 H new ATOM 0 HB2 LEU A 53 1.551 -5.653 -12.343 1.00 0.00 H new ATOM 0 HB3 LEU A 53 1.800 -5.898 -14.060 1.00 0.00 H new ATOM 0 HG LEU A 53 2.033 -3.532 -13.285 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.754 -2.562 -15.152 1.00 0.00 H new ATOM 0 HD12 LEU A 53 1.584 -4.062 -15.629 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -0.165 -4.078 -15.304 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -0.019 -2.246 -12.832 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -0.969 -3.750 -12.892 1.00 0.00 H new ATOM 0 HD23 LEU A 53 0.247 -3.516 -11.614 1.00 0.00 H new ATOM 811 N PRO A 54 0.274 -8.138 -14.815 1.00 0.00 N ATOM 812 CA PRO A 54 0.307 -7.240 -15.973 1.00 0.00 C ATOM 813 C PRO A 54 -1.074 -6.701 -16.329 1.00 0.00 C ATOM 814 O PRO A 54 -1.220 -5.535 -16.694 1.00 0.00 O ATOM 815 CB PRO A 54 0.839 -8.132 -17.098 1.00 0.00 C ATOM 816 CG PRO A 54 0.470 -9.517 -16.690 1.00 0.00 C ATOM 817 CD PRO A 54 0.538 -9.538 -15.188 1.00 0.00 C ATOM 0 HA PRO A 54 0.917 -6.356 -15.786 1.00 0.00 H new ATOM 0 HB2 PRO A 54 0.392 -7.869 -18.057 1.00 0.00 H new ATOM 0 HB3 PRO A 54 1.918 -8.027 -17.210 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -0.530 -9.773 -17.039 1.00 0.00 H new ATOM 0 HG3 PRO A 54 1.155 -10.247 -17.122 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -0.203 -10.214 -14.762 1.00 0.00 H new ATOM 0 HD3 PRO A 54 1.514 -9.871 -14.835 1.00 0.00 H new ATOM 825 N ASP A 55 -2.084 -7.557 -16.220 1.00 0.00 N ATOM 826 CA ASP A 55 -3.454 -7.166 -16.529 1.00 0.00 C ATOM 827 C ASP A 55 -3.739 -5.750 -16.039 1.00 0.00 C ATOM 828 O ASP A 55 -3.406 -5.394 -14.909 1.00 0.00 O ATOM 829 CB ASP A 55 -4.443 -8.147 -15.895 1.00 0.00 C ATOM 830 CG ASP A 55 -5.821 -7.543 -15.712 1.00 0.00 C ATOM 831 OD1 ASP A 55 -6.368 -7.004 -16.697 1.00 0.00 O ATOM 832 OD2 ASP A 55 -6.352 -7.609 -14.585 1.00 0.00 O ATOM 0 H ASP A 55 -1.980 -8.526 -15.920 1.00 0.00 H new ATOM 0 HA ASP A 55 -3.576 -7.188 -17.612 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -4.520 -9.036 -16.521 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -4.060 -8.470 -14.927 1.00 0.00 H new ATOM 837 N LYS A 56 -4.356 -4.945 -16.898 1.00 0.00 N ATOM 838 CA LYS A 56 -4.686 -3.567 -16.553 1.00 0.00 C ATOM 839 C LYS A 56 -6.137 -3.252 -16.902 1.00 0.00 C ATOM 840 O LYS A 56 -6.474 -2.113 -17.224 1.00 0.00 O ATOM 841 CB LYS A 56 -3.753 -2.600 -17.285 1.00 0.00 C ATOM 842 CG LYS A 56 -2.485 -2.277 -16.513 1.00 0.00 C ATOM 843 CD LYS A 56 -1.968 -0.888 -16.847 1.00 0.00 C ATOM 844 CE LYS A 56 -0.460 -0.796 -16.666 1.00 0.00 C ATOM 845 NZ LYS A 56 -0.092 -0.390 -15.281 1.00 0.00 N ATOM 0 H LYS A 56 -4.638 -5.223 -17.838 1.00 0.00 H new ATOM 0 HA LYS A 56 -4.555 -3.446 -15.478 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -3.482 -3.030 -18.249 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -4.290 -1.674 -17.489 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -2.682 -2.345 -15.443 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -1.719 -3.017 -16.744 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -2.228 -0.640 -17.876 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -2.458 -0.153 -16.208 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -0.007 -1.761 -16.894 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -0.052 -0.077 -17.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 0.941 -0.437 -15.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -0.415 0.583 -15.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -0.544 -1.032 -14.599 1.00 0.00 H new ATOM 859 N ARG A 57 -6.991 -4.268 -16.834 1.00 0.00 N ATOM 860 CA ARG A 57 -8.406 -4.098 -17.143 1.00 0.00 C ATOM 861 C ARG A 57 -8.905 -2.735 -16.673 1.00 0.00 C ATOM 862 O ARG A 57 -8.871 -2.427 -15.481 1.00 0.00 O ATOM 863 CB ARG A 57 -9.230 -5.208 -16.487 1.00 0.00 C ATOM 864 CG ARG A 57 -9.386 -6.445 -17.357 1.00 0.00 C ATOM 865 CD ARG A 57 -9.529 -7.704 -16.516 1.00 0.00 C ATOM 866 NE ARG A 57 -10.027 -8.832 -17.299 1.00 0.00 N ATOM 867 CZ ARG A 57 -10.069 -10.079 -16.845 1.00 0.00 C ATOM 868 NH1 ARG A 57 -9.646 -10.357 -15.619 1.00 0.00 N ATOM 869 NH2 ARG A 57 -10.536 -11.052 -17.617 1.00 0.00 N ATOM 0 H ARG A 57 -6.728 -5.217 -16.568 1.00 0.00 H new ATOM 0 HA ARG A 57 -8.525 -4.157 -18.225 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -8.758 -5.492 -15.547 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -10.218 -4.819 -16.242 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -10.261 -6.333 -17.997 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -8.521 -6.541 -18.013 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -8.563 -7.962 -16.083 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -10.209 -7.510 -15.686 1.00 0.00 H new ATOM 0 HE ARG A 57 -10.361 -8.652 -18.246 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -9.287 -9.612 -15.022 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -9.680 -11.316 -15.273 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -10.863 -10.842 -18.560 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -10.568 -12.010 -17.267 1.00 0.00 H new ATOM 883 N ARG A 58 -9.368 -1.923 -17.617 1.00 0.00 N ATOM 884 CA ARG A 58 -9.873 -0.592 -17.300 1.00 0.00 C ATOM 885 C ARG A 58 -11.164 -0.678 -16.491 1.00 0.00 C ATOM 886 O ARG A 58 -11.566 0.286 -15.840 1.00 0.00 O ATOM 887 CB ARG A 58 -10.116 0.204 -18.584 1.00 0.00 C ATOM 888 CG ARG A 58 -11.471 -0.062 -19.218 1.00 0.00 C ATOM 889 CD ARG A 58 -11.425 0.116 -20.727 1.00 0.00 C ATOM 890 NE ARG A 58 -11.764 1.479 -21.128 1.00 0.00 N ATOM 891 CZ ARG A 58 -10.879 2.468 -21.194 1.00 0.00 C ATOM 892 NH1 ARG A 58 -9.608 2.246 -20.889 1.00 0.00 N ATOM 893 NH2 ARG A 58 -11.265 3.681 -21.567 1.00 0.00 N ATOM 0 H ARG A 58 -9.404 -2.163 -18.608 1.00 0.00 H new ATOM 0 HA ARG A 58 -9.121 -0.080 -16.699 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -10.030 1.268 -18.364 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -9.334 -0.037 -19.304 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -11.792 -1.076 -18.980 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -12.212 0.615 -18.793 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -10.428 -0.132 -21.091 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -12.118 -0.583 -21.196 1.00 0.00 H new ATOM 0 HE ARG A 58 -12.733 1.683 -21.371 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -9.307 1.314 -20.603 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -8.931 3.007 -20.941 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -12.242 3.855 -21.803 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -10.585 4.440 -21.617 1.00 0.00 H new ATOM 907 N SER A 59 -11.808 -1.840 -16.536 1.00 0.00 N ATOM 908 CA SER A 59 -13.055 -2.051 -15.810 1.00 0.00 C ATOM 909 C SER A 59 -12.781 -2.405 -14.351 1.00 0.00 C ATOM 910 O SER A 59 -13.491 -1.961 -13.450 1.00 0.00 O ATOM 911 CB SER A 59 -13.872 -3.163 -16.472 1.00 0.00 C ATOM 912 OG SER A 59 -14.068 -2.900 -17.850 1.00 0.00 O ATOM 0 H SER A 59 -11.487 -2.649 -17.067 1.00 0.00 H new ATOM 0 HA SER A 59 -13.626 -1.123 -15.839 1.00 0.00 H new ATOM 0 HB2 SER A 59 -13.359 -4.117 -16.350 1.00 0.00 H new ATOM 0 HB3 SER A 59 -14.838 -3.254 -15.975 1.00 0.00 H new ATOM 0 HG SER A 59 -14.591 -3.626 -18.250 1.00 0.00 H new ATOM 918 N GLY A 60 -11.746 -3.209 -14.128 1.00 0.00 N ATOM 919 CA GLY A 60 -11.396 -3.610 -12.778 1.00 0.00 C ATOM 920 C GLY A 60 -10.579 -2.558 -12.054 1.00 0.00 C ATOM 921 O GLY A 60 -9.999 -2.828 -11.002 1.00 0.00 O ATOM 0 H GLY A 60 -11.144 -3.590 -14.858 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -12.307 -3.810 -12.214 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -10.832 -4.542 -12.814 1.00 0.00 H new ATOM 925 N ARG A 61 -10.532 -1.356 -12.619 1.00 0.00 N ATOM 926 CA ARG A 61 -9.777 -0.260 -12.022 1.00 0.00 C ATOM 927 C ARG A 61 -10.310 0.073 -10.632 1.00 0.00 C ATOM 928 O ARG A 61 -11.404 0.620 -10.490 1.00 0.00 O ATOM 929 CB ARG A 61 -9.843 0.979 -12.916 1.00 0.00 C ATOM 930 CG ARG A 61 -9.277 2.231 -12.265 1.00 0.00 C ATOM 931 CD ARG A 61 -9.918 3.490 -12.826 1.00 0.00 C ATOM 932 NE ARG A 61 -11.215 3.764 -12.213 1.00 0.00 N ATOM 933 CZ ARG A 61 -12.027 4.736 -12.614 1.00 0.00 C ATOM 934 NH1 ARG A 61 -11.678 5.521 -13.623 1.00 0.00 N ATOM 935 NH2 ARG A 61 -13.191 4.923 -12.005 1.00 0.00 N ATOM 0 H ARG A 61 -11.007 -1.116 -13.489 1.00 0.00 H new ATOM 0 HA ARG A 61 -8.738 -0.576 -11.928 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -9.297 0.781 -13.838 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -10.881 1.162 -13.193 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -9.440 2.188 -11.188 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -8.199 2.269 -12.423 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -9.254 4.339 -12.663 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -10.042 3.384 -13.904 1.00 0.00 H new ATOM 0 HE ARG A 61 -11.514 3.177 -11.434 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -10.784 5.380 -14.094 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -12.303 6.267 -13.929 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -13.463 4.320 -11.228 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -13.814 5.670 -12.313 1.00 0.00 H new ATOM 949 N ARG A 62 -9.530 -0.260 -9.609 1.00 0.00 N ATOM 950 CA ARG A 62 -9.924 0.002 -8.230 1.00 0.00 C ATOM 951 C ARG A 62 -9.049 1.088 -7.611 1.00 0.00 C ATOM 952 O ARG A 62 -7.823 0.979 -7.596 1.00 0.00 O ATOM 953 CB ARG A 62 -9.831 -1.278 -7.398 1.00 0.00 C ATOM 954 CG ARG A 62 -10.829 -1.335 -6.253 1.00 0.00 C ATOM 955 CD ARG A 62 -12.167 -1.896 -6.708 1.00 0.00 C ATOM 956 NE ARG A 62 -13.263 -1.469 -5.843 1.00 0.00 N ATOM 957 CZ ARG A 62 -13.514 -2.007 -4.654 1.00 0.00 C ATOM 958 NH1 ARG A 62 -12.751 -2.988 -4.193 1.00 0.00 N ATOM 959 NH2 ARG A 62 -14.530 -1.563 -3.925 1.00 0.00 N ATOM 0 H ARG A 62 -8.621 -0.712 -9.709 1.00 0.00 H new ATOM 0 HA ARG A 62 -10.957 0.350 -8.234 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -9.990 -2.137 -8.050 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -8.822 -1.366 -6.994 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -10.428 -1.953 -5.450 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -10.973 -0.335 -5.844 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -12.366 -1.574 -7.730 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -12.118 -2.985 -6.720 1.00 0.00 H new ATOM 0 HE ARG A 62 -13.869 -0.716 -6.169 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -11.969 -3.331 -4.751 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -12.946 -3.399 -3.280 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -15.119 -0.808 -4.277 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -14.722 -1.976 -3.013 1.00 0.00 H new ATOM 973 N LYS A 63 -9.688 2.137 -7.103 1.00 0.00 N ATOM 974 CA LYS A 63 -8.969 3.243 -6.482 1.00 0.00 C ATOM 975 C LYS A 63 -9.772 3.834 -5.327 1.00 0.00 C ATOM 976 O LYS A 63 -10.936 3.487 -5.125 1.00 0.00 O ATOM 977 CB LYS A 63 -8.671 4.330 -7.518 1.00 0.00 C ATOM 978 CG LYS A 63 -9.824 4.595 -8.470 1.00 0.00 C ATOM 979 CD LYS A 63 -9.524 5.759 -9.399 1.00 0.00 C ATOM 980 CE LYS A 63 -9.600 7.090 -8.668 1.00 0.00 C ATOM 981 NZ LYS A 63 -9.623 8.242 -9.612 1.00 0.00 N ATOM 0 H LYS A 63 -10.702 2.244 -7.109 1.00 0.00 H new ATOM 0 HA LYS A 63 -8.029 2.857 -6.088 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -8.419 5.255 -6.999 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -7.794 4.039 -8.095 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -10.023 3.700 -9.059 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -10.727 4.808 -7.898 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -8.530 5.635 -9.829 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -10.233 5.757 -10.227 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -10.495 7.112 -8.046 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -8.745 7.186 -7.999 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -10.342 8.928 -9.305 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -8.690 8.701 -9.623 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -9.853 7.903 -10.568 1.00 0.00 H new ATOM 995 N THR A 64 -9.143 4.729 -4.572 1.00 0.00 N ATOM 996 CA THR A 64 -9.798 5.368 -3.438 1.00 0.00 C ATOM 997 C THR A 64 -10.374 6.724 -3.828 1.00 0.00 C ATOM 998 O THR A 64 -10.052 7.266 -4.886 1.00 0.00 O ATOM 999 CB THR A 64 -8.825 5.556 -2.259 1.00 0.00 C ATOM 1000 OG1 THR A 64 -7.722 6.377 -2.661 1.00 0.00 O ATOM 1001 CG2 THR A 64 -8.310 4.213 -1.763 1.00 0.00 C ATOM 0 H THR A 64 -8.180 5.028 -4.726 1.00 0.00 H new ATOM 0 HA THR A 64 -10.608 4.708 -3.129 1.00 0.00 H new ATOM 0 HB THR A 64 -9.363 6.043 -1.446 1.00 0.00 H new ATOM 0 HG1 THR A 64 -7.674 7.166 -2.082 1.00 0.00 H new ATOM 0 HG21 THR A 64 -7.625 4.371 -0.930 1.00 0.00 H new ATOM 0 HG22 THR A 64 -9.149 3.602 -1.431 1.00 0.00 H new ATOM 0 HG23 THR A 64 -7.787 3.703 -2.572 1.00 0.00 H new ATOM 1009 N HIS A 65 -11.228 7.269 -2.967 1.00 0.00 N ATOM 1010 CA HIS A 65 -11.848 8.565 -3.222 1.00 0.00 C ATOM 1011 C HIS A 65 -10.795 9.612 -3.571 1.00 0.00 C ATOM 1012 O HIS A 65 -9.612 9.440 -3.275 1.00 0.00 O ATOM 1013 CB HIS A 65 -12.651 9.018 -2.003 1.00 0.00 C ATOM 1014 CG HIS A 65 -13.764 9.964 -2.336 1.00 0.00 C ATOM 1015 ND1 HIS A 65 -13.690 11.322 -2.111 1.00 0.00 N ATOM 1016 CD2 HIS A 65 -14.982 9.740 -2.882 1.00 0.00 C ATOM 1017 CE1 HIS A 65 -14.815 11.893 -2.503 1.00 0.00 C ATOM 1018 NE2 HIS A 65 -15.616 10.955 -2.975 1.00 0.00 N ATOM 0 H HIS A 65 -11.506 6.834 -2.087 1.00 0.00 H new ATOM 0 HA HIS A 65 -12.522 8.457 -4.072 1.00 0.00 H new ATOM 0 HB2 HIS A 65 -13.067 8.142 -1.506 1.00 0.00 H new ATOM 0 HB3 HIS A 65 -11.978 9.498 -1.293 1.00 0.00 H new ATOM 0 HD2 HIS A 65 -15.381 8.784 -3.188 1.00 0.00 H new ATOM 0 HE1 HIS A 65 -15.041 12.948 -2.447 1.00 0.00 H new ATOM 0 HE2 HIS A 65 -16.553 11.108 -3.348 1.00 0.00 H new ATOM 1026 N VAL A 66 -11.233 10.698 -4.201 1.00 0.00 N ATOM 1027 CA VAL A 66 -10.328 11.773 -4.589 1.00 0.00 C ATOM 1028 C VAL A 66 -10.559 13.019 -3.741 1.00 0.00 C ATOM 1029 O VAL A 66 -11.535 13.742 -3.935 1.00 0.00 O ATOM 1030 CB VAL A 66 -10.497 12.139 -6.076 1.00 0.00 C ATOM 1031 CG1 VAL A 66 -9.438 13.145 -6.502 1.00 0.00 C ATOM 1032 CG2 VAL A 66 -10.437 10.890 -6.942 1.00 0.00 C ATOM 0 H VAL A 66 -12.209 10.856 -4.453 1.00 0.00 H new ATOM 0 HA VAL A 66 -9.314 11.408 -4.425 1.00 0.00 H new ATOM 0 HB VAL A 66 -11.476 12.599 -6.210 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -9.573 13.392 -7.555 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -9.534 14.050 -5.902 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -8.447 12.715 -6.354 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -10.558 11.167 -7.989 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -9.474 10.399 -6.806 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -11.236 10.208 -6.652 1.00 0.00 H new ATOM 1042 N SER A 67 -9.653 13.263 -2.800 1.00 0.00 N ATOM 1043 CA SER A 67 -9.759 14.420 -1.918 1.00 0.00 C ATOM 1044 C SER A 67 -9.278 15.685 -2.623 1.00 0.00 C ATOM 1045 O SER A 67 -8.292 15.663 -3.360 1.00 0.00 O ATOM 1046 CB SER A 67 -8.945 14.192 -0.643 1.00 0.00 C ATOM 1047 OG SER A 67 -9.437 14.985 0.424 1.00 0.00 O ATOM 0 H SER A 67 -8.837 12.675 -2.628 1.00 0.00 H new ATOM 0 HA SER A 67 -10.808 14.549 -1.652 1.00 0.00 H new ATOM 0 HB2 SER A 67 -8.985 13.139 -0.366 1.00 0.00 H new ATOM 0 HB3 SER A 67 -7.898 14.434 -0.828 1.00 0.00 H new ATOM 0 HG SER A 67 -9.137 14.608 1.277 1.00 0.00 H new ATOM 1053 N LYS A 68 -9.982 16.787 -2.390 1.00 0.00 N ATOM 1054 CA LYS A 68 -9.628 18.064 -3.000 1.00 0.00 C ATOM 1055 C LYS A 68 -9.261 19.092 -1.935 1.00 0.00 C ATOM 1056 O LYS A 68 -9.680 18.984 -0.782 1.00 0.00 O ATOM 1057 CB LYS A 68 -10.790 18.586 -3.849 1.00 0.00 C ATOM 1058 CG LYS A 68 -11.303 17.578 -4.862 1.00 0.00 C ATOM 1059 CD LYS A 68 -11.992 18.263 -6.030 1.00 0.00 C ATOM 1060 CE LYS A 68 -12.641 17.253 -6.965 1.00 0.00 C ATOM 1061 NZ LYS A 68 -13.924 16.735 -6.416 1.00 0.00 N ATOM 0 H LYS A 68 -10.801 16.822 -1.783 1.00 0.00 H new ATOM 0 HA LYS A 68 -8.761 17.905 -3.640 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -11.609 18.876 -3.190 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -10.470 19.486 -4.374 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -10.472 16.976 -5.231 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -12.000 16.895 -4.376 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -12.749 18.951 -5.654 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -11.266 18.859 -6.583 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -12.822 17.719 -7.934 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -11.956 16.422 -7.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -14.335 16.050 -7.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -13.748 16.268 -5.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -14.587 17.525 -6.279 1.00 0.00 H new ATOM 1075 N LYS A 69 -8.478 20.091 -2.328 1.00 0.00 N ATOM 1076 CA LYS A 69 -8.056 21.141 -1.408 1.00 0.00 C ATOM 1077 C LYS A 69 -7.350 20.548 -0.193 1.00 0.00 C ATOM 1078 O LYS A 69 -7.624 20.931 0.945 1.00 0.00 O ATOM 1079 CB LYS A 69 -9.262 21.968 -0.958 1.00 0.00 C ATOM 1080 CG LYS A 69 -9.757 22.944 -2.011 1.00 0.00 C ATOM 1081 CD LYS A 69 -9.063 24.291 -1.893 1.00 0.00 C ATOM 1082 CE LYS A 69 -9.633 25.112 -0.746 1.00 0.00 C ATOM 1083 NZ LYS A 69 -8.638 26.083 -0.212 1.00 0.00 N ATOM 0 H LYS A 69 -8.122 20.196 -3.278 1.00 0.00 H new ATOM 0 HA LYS A 69 -7.354 21.789 -1.933 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -10.075 21.293 -0.689 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -8.997 22.522 -0.057 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -9.582 22.529 -3.004 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -10.834 23.078 -1.907 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -7.995 24.139 -1.738 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -9.174 24.842 -2.827 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -10.517 25.649 -1.088 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -9.955 24.445 0.054 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -9.064 26.623 0.568 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -7.804 25.569 0.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -8.350 26.736 -0.968 1.00 0.00 H new ATOM 1097 N THR A 70 -6.439 19.613 -0.441 1.00 0.00 N ATOM 1098 CA THR A 70 -5.694 18.968 0.633 1.00 0.00 C ATOM 1099 C THR A 70 -4.435 18.293 0.101 1.00 0.00 C ATOM 1100 O THR A 70 -4.415 17.790 -1.023 1.00 0.00 O ATOM 1101 CB THR A 70 -6.554 17.920 1.364 1.00 0.00 C ATOM 1102 OG1 THR A 70 -5.842 17.402 2.492 1.00 0.00 O ATOM 1103 CG2 THR A 70 -6.930 16.781 0.428 1.00 0.00 C ATOM 0 H THR A 70 -6.199 19.285 -1.377 1.00 0.00 H new ATOM 0 HA THR A 70 -5.414 19.752 1.337 1.00 0.00 H new ATOM 0 HB THR A 70 -7.468 18.406 1.705 1.00 0.00 H new ATOM 0 HG1 THR A 70 -6.397 16.738 2.952 1.00 0.00 H new ATOM 0 HG21 THR A 70 -7.537 16.053 0.966 1.00 0.00 H new ATOM 0 HG22 THR A 70 -7.498 17.175 -0.415 1.00 0.00 H new ATOM 0 HG23 THR A 70 -6.025 16.298 0.061 1.00 0.00 H new ATOM 1111 N LEU A 71 -3.385 18.285 0.915 1.00 0.00 N ATOM 1112 CA LEU A 71 -2.120 17.670 0.525 1.00 0.00 C ATOM 1113 C LEU A 71 -1.984 16.276 1.128 1.00 0.00 C ATOM 1114 O LEU A 71 -1.416 15.375 0.512 1.00 0.00 O ATOM 1115 CB LEU A 71 -0.947 18.547 0.968 1.00 0.00 C ATOM 1116 CG LEU A 71 -0.818 19.900 0.267 1.00 0.00 C ATOM 1117 CD1 LEU A 71 0.409 20.645 0.769 1.00 0.00 C ATOM 1118 CD2 LEU A 71 -0.752 19.714 -1.242 1.00 0.00 C ATOM 0 H LEU A 71 -3.384 18.697 1.848 1.00 0.00 H new ATOM 0 HA LEU A 71 -2.108 17.578 -0.561 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -1.035 18.723 2.040 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -0.023 17.990 0.812 1.00 0.00 H new ATOM 0 HG LEU A 71 -1.700 20.496 0.501 1.00 0.00 H new ATOM 0 HD11 LEU A 71 0.485 21.606 0.259 1.00 0.00 H new ATOM 0 HD12 LEU A 71 0.321 20.810 1.843 1.00 0.00 H new ATOM 0 HD13 LEU A 71 1.302 20.054 0.565 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -0.660 20.687 -1.725 1.00 0.00 H new ATOM 0 HD22 LEU A 71 0.112 19.100 -1.495 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -1.661 19.221 -1.588 1.00 0.00 H new ATOM 1130 N ASN A 72 -2.511 16.105 2.336 1.00 0.00 N ATOM 1131 CA ASN A 72 -2.450 14.820 3.022 1.00 0.00 C ATOM 1132 C ASN A 72 -3.831 14.176 3.095 1.00 0.00 C ATOM 1133 O ASN A 72 -4.526 14.252 4.109 1.00 0.00 O ATOM 1134 CB ASN A 72 -1.882 14.997 4.432 1.00 0.00 C ATOM 1135 CG ASN A 72 -2.804 15.799 5.330 1.00 0.00 C ATOM 1136 OD1 ASN A 72 -3.277 16.871 4.953 1.00 0.00 O ATOM 1137 ND2 ASN A 72 -3.063 15.281 6.525 1.00 0.00 N ATOM 0 H ASN A 72 -2.985 16.841 2.860 1.00 0.00 H new ATOM 0 HA ASN A 72 -1.792 14.163 2.452 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -1.708 14.017 4.876 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -0.915 15.495 4.371 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -3.677 15.775 7.173 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -2.648 14.389 6.795 1.00 0.00 H new ATOM 1144 N PRO A 73 -4.240 13.526 1.996 1.00 0.00 N ATOM 1145 CA PRO A 73 -5.540 12.855 1.910 1.00 0.00 C ATOM 1146 C PRO A 73 -5.610 11.611 2.790 1.00 0.00 C ATOM 1147 O PRO A 73 -4.631 10.877 2.923 1.00 0.00 O ATOM 1148 CB PRO A 73 -5.644 12.470 0.432 1.00 0.00 C ATOM 1149 CG PRO A 73 -4.233 12.369 -0.033 1.00 0.00 C ATOM 1150 CD PRO A 73 -3.463 13.395 0.751 1.00 0.00 C ATOM 0 HA PRO A 73 -6.352 13.495 2.256 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -6.171 11.524 0.305 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -6.195 13.221 -0.135 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -3.836 11.368 0.139 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -4.160 12.561 -1.103 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -2.442 13.068 0.947 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -3.397 14.343 0.217 1.00 0.00 H new ATOM 1158 N VAL A 74 -6.774 11.381 3.390 1.00 0.00 N ATOM 1159 CA VAL A 74 -6.972 10.225 4.256 1.00 0.00 C ATOM 1160 C VAL A 74 -8.191 9.418 3.825 1.00 0.00 C ATOM 1161 O VAL A 74 -9.305 9.939 3.768 1.00 0.00 O ATOM 1162 CB VAL A 74 -7.144 10.649 5.727 1.00 0.00 C ATOM 1163 CG1 VAL A 74 -7.347 9.430 6.614 1.00 0.00 C ATOM 1164 CG2 VAL A 74 -5.944 11.462 6.190 1.00 0.00 C ATOM 0 H VAL A 74 -7.594 11.980 3.292 1.00 0.00 H new ATOM 0 HA VAL A 74 -6.080 9.605 4.166 1.00 0.00 H new ATOM 0 HB VAL A 74 -8.032 11.277 5.805 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -7.467 9.749 7.649 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -8.240 8.892 6.295 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -6.480 8.774 6.535 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -6.082 11.753 7.231 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -5.040 10.860 6.098 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -5.850 12.355 5.573 1.00 0.00 H new ATOM 1174 N PHE A 75 -7.973 8.142 3.524 1.00 0.00 N ATOM 1175 CA PHE A 75 -9.054 7.261 3.098 1.00 0.00 C ATOM 1176 C PHE A 75 -9.352 6.211 4.164 1.00 0.00 C ATOM 1177 O PHE A 75 -10.451 6.166 4.717 1.00 0.00 O ATOM 1178 CB PHE A 75 -8.693 6.577 1.778 1.00 0.00 C ATOM 1179 CG PHE A 75 -7.844 7.426 0.876 1.00 0.00 C ATOM 1180 CD1 PHE A 75 -8.423 8.368 0.041 1.00 0.00 C ATOM 1181 CD2 PHE A 75 -6.466 7.282 0.862 1.00 0.00 C ATOM 1182 CE1 PHE A 75 -7.645 9.151 -0.790 1.00 0.00 C ATOM 1183 CE2 PHE A 75 -5.682 8.062 0.033 1.00 0.00 C ATOM 1184 CZ PHE A 75 -6.272 8.997 -0.795 1.00 0.00 C ATOM 0 H PHE A 75 -7.057 7.695 3.567 1.00 0.00 H new ATOM 0 HA PHE A 75 -9.948 7.868 2.952 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -8.165 5.648 1.992 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -9.610 6.309 1.254 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -9.496 8.492 0.040 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -5.999 6.552 1.506 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -8.109 9.882 -1.435 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -4.609 7.941 0.033 1.00 0.00 H new ATOM 0 HZ PHE A 75 -5.661 9.606 -1.445 1.00 0.00 H new ATOM 1194 N ASP A 76 -8.366 5.367 4.446 1.00 0.00 N ATOM 1195 CA ASP A 76 -8.520 4.316 5.445 1.00 0.00 C ATOM 1196 C ASP A 76 -9.395 3.185 4.913 1.00 0.00 C ATOM 1197 O ASP A 76 -10.069 2.497 5.679 1.00 0.00 O ATOM 1198 CB ASP A 76 -9.128 4.888 6.727 1.00 0.00 C ATOM 1199 CG ASP A 76 -8.777 4.065 7.951 1.00 0.00 C ATOM 1200 OD1 ASP A 76 -8.497 2.859 7.794 1.00 0.00 O ATOM 1201 OD2 ASP A 76 -8.782 4.628 9.066 1.00 0.00 O ATOM 0 H ASP A 76 -7.451 5.390 3.996 1.00 0.00 H new ATOM 0 HA ASP A 76 -7.532 3.913 5.668 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -8.777 5.910 6.867 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -10.212 4.934 6.622 1.00 0.00 H new ATOM 1206 N GLN A 77 -9.378 2.999 3.597 1.00 0.00 N ATOM 1207 CA GLN A 77 -10.171 1.953 2.964 1.00 0.00 C ATOM 1208 C GLN A 77 -9.332 0.700 2.732 1.00 0.00 C ATOM 1209 O GLN A 77 -8.106 0.769 2.644 1.00 0.00 O ATOM 1210 CB GLN A 77 -10.743 2.451 1.635 1.00 0.00 C ATOM 1211 CG GLN A 77 -12.017 3.266 1.789 1.00 0.00 C ATOM 1212 CD GLN A 77 -12.341 4.080 0.552 1.00 0.00 C ATOM 1213 OE1 GLN A 77 -12.161 5.298 0.531 1.00 0.00 O ATOM 1214 NE2 GLN A 77 -12.824 3.410 -0.488 1.00 0.00 N ATOM 0 H GLN A 77 -8.824 3.559 2.949 1.00 0.00 H new ATOM 0 HA GLN A 77 -10.993 1.700 3.633 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -9.992 3.058 1.130 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -10.945 1.594 0.992 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -12.849 2.596 2.007 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -11.915 3.935 2.643 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -12.957 2.401 -0.427 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -13.062 3.905 -1.348 1.00 0.00 H new ATOM 1223 N SER A 78 -10.002 -0.444 2.634 1.00 0.00 N ATOM 1224 CA SER A 78 -9.318 -1.714 2.417 1.00 0.00 C ATOM 1225 C SER A 78 -9.954 -2.483 1.263 1.00 0.00 C ATOM 1226 O SER A 78 -11.158 -2.739 1.261 1.00 0.00 O ATOM 1227 CB SER A 78 -9.353 -2.561 3.691 1.00 0.00 C ATOM 1228 OG SER A 78 -8.723 -3.814 3.487 1.00 0.00 O ATOM 0 H SER A 78 -11.017 -0.518 2.701 1.00 0.00 H new ATOM 0 HA SER A 78 -8.280 -1.501 2.160 1.00 0.00 H new ATOM 0 HB2 SER A 78 -8.855 -2.027 4.500 1.00 0.00 H new ATOM 0 HB3 SER A 78 -10.387 -2.716 4.000 1.00 0.00 H new ATOM 0 HG SER A 78 -8.757 -4.336 4.316 1.00 0.00 H new ATOM 1234 N PHE A 79 -9.136 -2.849 0.282 1.00 0.00 N ATOM 1235 CA PHE A 79 -9.617 -3.589 -0.879 1.00 0.00 C ATOM 1236 C PHE A 79 -9.056 -5.008 -0.891 1.00 0.00 C ATOM 1237 O PHE A 79 -8.084 -5.308 -0.198 1.00 0.00 O ATOM 1238 CB PHE A 79 -9.228 -2.863 -2.169 1.00 0.00 C ATOM 1239 CG PHE A 79 -9.532 -1.393 -2.144 1.00 0.00 C ATOM 1240 CD1 PHE A 79 -8.837 -0.542 -1.299 1.00 0.00 C ATOM 1241 CD2 PHE A 79 -10.512 -0.860 -2.966 1.00 0.00 C ATOM 1242 CE1 PHE A 79 -9.115 0.811 -1.274 1.00 0.00 C ATOM 1243 CE2 PHE A 79 -10.794 0.493 -2.946 1.00 0.00 C ATOM 1244 CZ PHE A 79 -10.094 1.330 -2.100 1.00 0.00 C ATOM 0 H PHE A 79 -8.137 -2.645 0.268 1.00 0.00 H new ATOM 0 HA PHE A 79 -10.704 -3.648 -0.817 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -8.162 -3.002 -2.348 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -9.754 -3.321 -3.007 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -8.069 -0.941 -0.653 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -11.062 -1.510 -3.630 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -8.568 1.463 -0.609 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -11.561 0.895 -3.591 1.00 0.00 H new ATOM 0 HZ PHE A 79 -10.311 2.388 -2.084 1.00 0.00 H new ATOM 1254 N ASP A 80 -9.675 -5.875 -1.683 1.00 0.00 N ATOM 1255 CA ASP A 80 -9.239 -7.263 -1.787 1.00 0.00 C ATOM 1256 C ASP A 80 -9.461 -7.798 -3.198 1.00 0.00 C ATOM 1257 O ASP A 80 -10.385 -7.377 -3.895 1.00 0.00 O ATOM 1258 CB ASP A 80 -9.986 -8.132 -0.775 1.00 0.00 C ATOM 1259 CG ASP A 80 -10.372 -7.364 0.474 1.00 0.00 C ATOM 1260 OD1 ASP A 80 -9.463 -6.843 1.154 1.00 0.00 O ATOM 1261 OD2 ASP A 80 -11.582 -7.285 0.772 1.00 0.00 O ATOM 0 H ASP A 80 -10.481 -5.642 -2.263 1.00 0.00 H new ATOM 0 HA ASP A 80 -8.172 -7.300 -1.568 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -10.884 -8.537 -1.241 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -9.361 -8.981 -0.498 1.00 0.00 H new ATOM 1266 N PHE A 81 -8.608 -8.729 -3.614 1.00 0.00 N ATOM 1267 CA PHE A 81 -8.710 -9.320 -4.943 1.00 0.00 C ATOM 1268 C PHE A 81 -8.469 -10.826 -4.888 1.00 0.00 C ATOM 1269 O PHE A 81 -7.482 -11.287 -4.314 1.00 0.00 O ATOM 1270 CB PHE A 81 -7.707 -8.666 -5.895 1.00 0.00 C ATOM 1271 CG PHE A 81 -7.664 -7.169 -5.784 1.00 0.00 C ATOM 1272 CD1 PHE A 81 -8.688 -6.393 -6.303 1.00 0.00 C ATOM 1273 CD2 PHE A 81 -6.600 -6.537 -5.161 1.00 0.00 C ATOM 1274 CE1 PHE A 81 -8.652 -5.015 -6.203 1.00 0.00 C ATOM 1275 CE2 PHE A 81 -6.558 -5.160 -5.057 1.00 0.00 C ATOM 1276 CZ PHE A 81 -7.585 -4.398 -5.579 1.00 0.00 C ATOM 0 H PHE A 81 -7.839 -9.090 -3.050 1.00 0.00 H new ATOM 0 HA PHE A 81 -9.720 -9.144 -5.315 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -6.713 -9.066 -5.694 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -7.959 -8.939 -6.920 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -9.524 -6.871 -6.792 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -5.794 -7.128 -4.752 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -9.456 -4.422 -6.612 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -5.723 -4.680 -4.568 1.00 0.00 H new ATOM 0 HZ PHE A 81 -7.554 -3.321 -5.499 1.00 0.00 H new ATOM 1286 N SER A 82 -9.378 -11.588 -5.487 1.00 0.00 N ATOM 1287 CA SER A 82 -9.268 -13.042 -5.503 1.00 0.00 C ATOM 1288 C SER A 82 -8.169 -13.492 -6.461 1.00 0.00 C ATOM 1289 O SER A 82 -8.407 -13.676 -7.655 1.00 0.00 O ATOM 1290 CB SER A 82 -10.602 -13.671 -5.907 1.00 0.00 C ATOM 1291 OG SER A 82 -11.008 -13.228 -7.191 1.00 0.00 O ATOM 0 H SER A 82 -10.200 -11.222 -5.968 1.00 0.00 H new ATOM 0 HA SER A 82 -9.008 -13.374 -4.498 1.00 0.00 H new ATOM 0 HB2 SER A 82 -10.510 -14.757 -5.906 1.00 0.00 H new ATOM 0 HB3 SER A 82 -11.365 -13.415 -5.172 1.00 0.00 H new ATOM 0 HG SER A 82 -10.237 -13.230 -7.797 1.00 0.00 H new ATOM 1297 N VAL A 83 -6.964 -13.669 -5.929 1.00 0.00 N ATOM 1298 CA VAL A 83 -5.828 -14.099 -6.735 1.00 0.00 C ATOM 1299 C VAL A 83 -4.919 -15.037 -5.948 1.00 0.00 C ATOM 1300 O VAL A 83 -4.581 -14.767 -4.795 1.00 0.00 O ATOM 1301 CB VAL A 83 -5.002 -12.896 -7.228 1.00 0.00 C ATOM 1302 CG1 VAL A 83 -4.673 -11.964 -6.072 1.00 0.00 C ATOM 1303 CG2 VAL A 83 -3.732 -13.369 -7.919 1.00 0.00 C ATOM 0 H VAL A 83 -6.749 -13.521 -4.943 1.00 0.00 H new ATOM 0 HA VAL A 83 -6.234 -14.629 -7.596 1.00 0.00 H new ATOM 0 HB VAL A 83 -5.598 -12.341 -7.953 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -4.089 -11.120 -6.440 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -5.597 -11.598 -5.625 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -4.096 -12.505 -5.322 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -3.161 -12.506 -8.261 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -3.130 -13.948 -7.218 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -3.994 -13.993 -8.774 1.00 0.00 H new ATOM 1313 N SER A 84 -4.526 -16.139 -6.578 1.00 0.00 N ATOM 1314 CA SER A 84 -3.659 -17.119 -5.936 1.00 0.00 C ATOM 1315 C SER A 84 -2.222 -16.611 -5.866 1.00 0.00 C ATOM 1316 O SER A 84 -1.767 -15.878 -6.746 1.00 0.00 O ATOM 1317 CB SER A 84 -3.706 -18.447 -6.694 1.00 0.00 C ATOM 1318 OG SER A 84 -5.000 -18.690 -7.217 1.00 0.00 O ATOM 0 H SER A 84 -4.795 -16.376 -7.533 1.00 0.00 H new ATOM 0 HA SER A 84 -4.020 -17.276 -4.920 1.00 0.00 H new ATOM 0 HB2 SER A 84 -2.979 -18.432 -7.506 1.00 0.00 H new ATOM 0 HB3 SER A 84 -3.421 -19.261 -6.027 1.00 0.00 H new ATOM 0 HG SER A 84 -5.003 -19.544 -7.698 1.00 0.00 H new ATOM 1324 N LEU A 85 -1.513 -17.004 -4.815 1.00 0.00 N ATOM 1325 CA LEU A 85 -0.126 -16.589 -4.628 1.00 0.00 C ATOM 1326 C LEU A 85 0.706 -16.897 -5.869 1.00 0.00 C ATOM 1327 O LEU A 85 1.499 -16.078 -6.334 1.00 0.00 O ATOM 1328 CB LEU A 85 0.477 -17.289 -3.409 1.00 0.00 C ATOM 1329 CG LEU A 85 2.000 -17.417 -3.394 1.00 0.00 C ATOM 1330 CD1 LEU A 85 2.641 -16.117 -2.932 1.00 0.00 C ATOM 1331 CD2 LEU A 85 2.430 -18.572 -2.502 1.00 0.00 C ATOM 0 H LEU A 85 -1.875 -17.610 -4.078 1.00 0.00 H new ATOM 0 HA LEU A 85 -0.114 -15.512 -4.463 1.00 0.00 H new ATOM 0 HB2 LEU A 85 0.169 -16.747 -2.515 1.00 0.00 H new ATOM 0 HB3 LEU A 85 0.048 -18.289 -3.340 1.00 0.00 H new ATOM 0 HG LEU A 85 2.337 -17.624 -4.410 1.00 0.00 H new ATOM 0 HD11 LEU A 85 3.725 -16.227 -2.928 1.00 0.00 H new ATOM 0 HD12 LEU A 85 2.361 -15.312 -3.611 1.00 0.00 H new ATOM 0 HD13 LEU A 85 2.297 -15.879 -1.926 1.00 0.00 H new ATOM 0 HD21 LEU A 85 3.517 -18.648 -2.504 1.00 0.00 H new ATOM 0 HD22 LEU A 85 2.080 -18.396 -1.485 1.00 0.00 H new ATOM 0 HD23 LEU A 85 2.001 -19.501 -2.878 1.00 0.00 H new ATOM 1343 N PRO A 86 0.520 -18.106 -6.421 1.00 0.00 N ATOM 1344 CA PRO A 86 1.243 -18.549 -7.617 1.00 0.00 C ATOM 1345 C PRO A 86 1.222 -17.504 -8.728 1.00 0.00 C ATOM 1346 O PRO A 86 2.187 -17.363 -9.477 1.00 0.00 O ATOM 1347 CB PRO A 86 0.479 -19.803 -8.049 1.00 0.00 C ATOM 1348 CG PRO A 86 -0.143 -20.317 -6.797 1.00 0.00 C ATOM 1349 CD PRO A 86 -0.409 -19.132 -5.920 1.00 0.00 C ATOM 0 HA PRO A 86 2.299 -18.725 -7.413 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -0.276 -19.568 -8.799 1.00 0.00 H new ATOM 0 HB3 PRO A 86 1.148 -20.542 -8.491 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -1.068 -20.849 -7.017 1.00 0.00 H new ATOM 0 HG3 PRO A 86 0.521 -21.024 -6.299 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -1.446 -18.804 -5.996 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -0.223 -19.362 -4.871 1.00 0.00 H new ATOM 1357 N GLU A 87 0.115 -16.773 -8.826 1.00 0.00 N ATOM 1358 CA GLU A 87 -0.030 -15.741 -9.846 1.00 0.00 C ATOM 1359 C GLU A 87 0.461 -14.392 -9.328 1.00 0.00 C ATOM 1360 O GLU A 87 1.305 -13.746 -9.949 1.00 0.00 O ATOM 1361 CB GLU A 87 -1.491 -15.630 -10.286 1.00 0.00 C ATOM 1362 CG GLU A 87 -1.892 -16.660 -11.329 1.00 0.00 C ATOM 1363 CD GLU A 87 -1.584 -16.209 -12.743 1.00 0.00 C ATOM 1364 OE1 GLU A 87 -1.573 -14.984 -12.986 1.00 0.00 O ATOM 1365 OE2 GLU A 87 -1.353 -17.080 -13.608 1.00 0.00 O ATOM 0 H GLU A 87 -0.693 -16.877 -8.212 1.00 0.00 H new ATOM 0 HA GLU A 87 0.580 -16.025 -10.704 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -2.134 -15.740 -9.413 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -1.666 -14.632 -10.687 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -1.371 -17.596 -11.129 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -2.959 -16.864 -11.241 1.00 0.00 H new ATOM 1372 N VAL A 88 -0.076 -13.972 -8.187 1.00 0.00 N ATOM 1373 CA VAL A 88 0.307 -12.701 -7.585 1.00 0.00 C ATOM 1374 C VAL A 88 1.823 -12.564 -7.505 1.00 0.00 C ATOM 1375 O VAL A 88 2.362 -11.462 -7.599 1.00 0.00 O ATOM 1376 CB VAL A 88 -0.286 -12.548 -6.171 1.00 0.00 C ATOM 1377 CG1 VAL A 88 0.644 -13.158 -5.133 1.00 0.00 C ATOM 1378 CG2 VAL A 88 -0.556 -11.084 -5.862 1.00 0.00 C ATOM 0 H VAL A 88 -0.777 -14.493 -7.661 1.00 0.00 H new ATOM 0 HA VAL A 88 -0.092 -11.915 -8.226 1.00 0.00 H new ATOM 0 HB VAL A 88 -1.234 -13.084 -6.134 1.00 0.00 H new ATOM 0 HG11 VAL A 88 0.209 -13.040 -4.141 1.00 0.00 H new ATOM 0 HG12 VAL A 88 0.781 -14.218 -5.346 1.00 0.00 H new ATOM 0 HG13 VAL A 88 1.609 -12.653 -5.168 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -0.975 -10.995 -4.860 1.00 0.00 H new ATOM 0 HG22 VAL A 88 0.377 -10.523 -5.917 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -1.264 -10.684 -6.588 1.00 0.00 H new ATOM 1388 N GLN A 89 2.505 -13.692 -7.333 1.00 0.00 N ATOM 1389 CA GLN A 89 3.960 -13.698 -7.242 1.00 0.00 C ATOM 1390 C GLN A 89 4.586 -13.032 -8.463 1.00 0.00 C ATOM 1391 O GLN A 89 5.375 -12.096 -8.336 1.00 0.00 O ATOM 1392 CB GLN A 89 4.478 -15.131 -7.106 1.00 0.00 C ATOM 1393 CG GLN A 89 4.318 -15.706 -5.708 1.00 0.00 C ATOM 1394 CD GLN A 89 4.442 -17.217 -5.681 1.00 0.00 C ATOM 1395 OE1 GLN A 89 4.129 -17.895 -6.660 1.00 0.00 O ATOM 1396 NE2 GLN A 89 4.902 -17.753 -4.557 1.00 0.00 N ATOM 0 H GLN A 89 2.073 -14.613 -7.254 1.00 0.00 H new ATOM 0 HA GLN A 89 4.245 -13.130 -6.356 1.00 0.00 H new ATOM 0 HB2 GLN A 89 3.949 -15.768 -7.815 1.00 0.00 H new ATOM 0 HB3 GLN A 89 5.532 -15.155 -7.381 1.00 0.00 H new ATOM 0 HG2 GLN A 89 5.072 -15.272 -5.052 1.00 0.00 H new ATOM 0 HG3 GLN A 89 3.345 -15.418 -5.310 1.00 0.00 H new ATOM 0 HE21 GLN A 89 5.149 -17.153 -3.770 1.00 0.00 H new ATOM 0 HE22 GLN A 89 5.008 -18.765 -4.480 1.00 0.00 H new ATOM 1405 N ARG A 90 4.228 -13.521 -9.646 1.00 0.00 N ATOM 1406 CA ARG A 90 4.755 -12.974 -10.890 1.00 0.00 C ATOM 1407 C ARG A 90 4.158 -11.599 -11.175 1.00 0.00 C ATOM 1408 O ARG A 90 4.768 -10.777 -11.859 1.00 0.00 O ATOM 1409 CB ARG A 90 4.459 -13.922 -12.054 1.00 0.00 C ATOM 1410 CG ARG A 90 4.892 -15.356 -11.797 1.00 0.00 C ATOM 1411 CD ARG A 90 4.451 -16.281 -12.920 1.00 0.00 C ATOM 1412 NE ARG A 90 3.039 -16.107 -13.250 1.00 0.00 N ATOM 1413 CZ ARG A 90 2.591 -15.191 -14.101 1.00 0.00 C ATOM 1414 NH1 ARG A 90 3.439 -14.370 -14.705 1.00 0.00 N ATOM 1415 NH2 ARG A 90 1.291 -15.094 -14.350 1.00 0.00 N ATOM 0 H ARG A 90 3.575 -14.295 -9.769 1.00 0.00 H new ATOM 0 HA ARG A 90 5.834 -12.867 -10.783 1.00 0.00 H new ATOM 0 HB2 ARG A 90 3.389 -13.906 -12.261 1.00 0.00 H new ATOM 0 HB3 ARG A 90 4.962 -13.554 -12.948 1.00 0.00 H new ATOM 0 HG2 ARG A 90 5.976 -15.397 -11.695 1.00 0.00 H new ATOM 0 HG3 ARG A 90 4.470 -15.701 -10.853 1.00 0.00 H new ATOM 0 HD2 ARG A 90 5.057 -16.090 -13.806 1.00 0.00 H new ATOM 0 HD3 ARG A 90 4.630 -17.316 -12.629 1.00 0.00 H new ATOM 0 HE ARG A 90 2.360 -16.723 -12.803 1.00 0.00 H new ATOM 0 HH11 ARG A 90 4.439 -14.441 -14.517 1.00 0.00 H new ATOM 0 HH12 ARG A 90 3.091 -13.668 -15.358 1.00 0.00 H new ATOM 0 HH21 ARG A 90 0.635 -15.723 -13.888 1.00 0.00 H new ATOM 0 HH22 ARG A 90 0.948 -14.390 -15.004 1.00 0.00 H new ATOM 1429 N ARG A 91 2.963 -11.357 -10.647 1.00 0.00 N ATOM 1430 CA ARG A 91 2.283 -10.083 -10.847 1.00 0.00 C ATOM 1431 C ARG A 91 2.864 -9.008 -9.932 1.00 0.00 C ATOM 1432 O ARG A 91 3.630 -9.305 -9.015 1.00 0.00 O ATOM 1433 CB ARG A 91 0.783 -10.234 -10.586 1.00 0.00 C ATOM 1434 CG ARG A 91 0.062 -11.059 -11.640 1.00 0.00 C ATOM 1435 CD ARG A 91 -1.447 -10.935 -11.508 1.00 0.00 C ATOM 1436 NE ARG A 91 -2.152 -11.797 -12.452 1.00 0.00 N ATOM 1437 CZ ARG A 91 -3.438 -12.112 -12.342 1.00 0.00 C ATOM 1438 NH1 ARG A 91 -4.156 -11.638 -11.332 1.00 0.00 N ATOM 1439 NH2 ARG A 91 -4.009 -12.902 -13.242 1.00 0.00 N ATOM 0 H ARG A 91 2.446 -12.026 -10.077 1.00 0.00 H new ATOM 0 HA ARG A 91 2.435 -9.777 -11.882 1.00 0.00 H new ATOM 0 HB2 ARG A 91 0.637 -10.698 -9.611 1.00 0.00 H new ATOM 0 HB3 ARG A 91 0.329 -9.244 -10.539 1.00 0.00 H new ATOM 0 HG2 ARG A 91 0.370 -10.731 -12.633 1.00 0.00 H new ATOM 0 HG3 ARG A 91 0.352 -12.106 -11.546 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -1.744 -11.192 -10.491 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -1.741 -9.899 -11.674 1.00 0.00 H new ATOM 0 HE ARG A 91 -1.628 -12.179 -13.240 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -3.721 -11.030 -10.638 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -5.143 -11.881 -11.250 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -3.461 -13.269 -14.020 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -4.996 -13.143 -13.156 1.00 0.00 H new ATOM 1453 N THR A 92 2.493 -7.757 -10.188 1.00 0.00 N ATOM 1454 CA THR A 92 2.977 -6.638 -9.390 1.00 0.00 C ATOM 1455 C THR A 92 1.845 -5.678 -9.046 1.00 0.00 C ATOM 1456 O THR A 92 0.873 -5.554 -9.793 1.00 0.00 O ATOM 1457 CB THR A 92 4.088 -5.863 -10.124 1.00 0.00 C ATOM 1458 OG1 THR A 92 5.024 -6.779 -10.702 1.00 0.00 O ATOM 1459 CG2 THR A 92 4.812 -4.924 -9.172 1.00 0.00 C ATOM 0 H THR A 92 1.859 -7.494 -10.942 1.00 0.00 H new ATOM 0 HA THR A 92 3.385 -7.059 -8.471 1.00 0.00 H new ATOM 0 HB THR A 92 3.626 -5.270 -10.913 1.00 0.00 H new ATOM 0 HG1 THR A 92 5.726 -6.279 -11.168 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.592 -4.388 -9.713 1.00 0.00 H new ATOM 0 HG22 THR A 92 4.102 -4.209 -8.756 1.00 0.00 H new ATOM 0 HG23 THR A 92 5.262 -5.501 -8.364 1.00 0.00 H new ATOM 1467 N LEU A 93 1.976 -4.999 -7.911 1.00 0.00 N ATOM 1468 CA LEU A 93 0.963 -4.047 -7.468 1.00 0.00 C ATOM 1469 C LEU A 93 1.317 -2.630 -7.909 1.00 0.00 C ATOM 1470 O LEU A 93 2.153 -1.969 -7.293 1.00 0.00 O ATOM 1471 CB LEU A 93 0.817 -4.098 -5.947 1.00 0.00 C ATOM 1472 CG LEU A 93 -0.567 -3.758 -5.393 1.00 0.00 C ATOM 1473 CD1 LEU A 93 -1.514 -4.937 -5.560 1.00 0.00 C ATOM 1474 CD2 LEU A 93 -0.471 -3.352 -3.929 1.00 0.00 C ATOM 0 H LEU A 93 2.773 -5.090 -7.281 1.00 0.00 H new ATOM 0 HA LEU A 93 0.014 -4.324 -7.927 1.00 0.00 H new ATOM 0 HB2 LEU A 93 1.085 -5.099 -5.610 1.00 0.00 H new ATOM 0 HB3 LEU A 93 1.540 -3.410 -5.509 1.00 0.00 H new ATOM 0 HG LEU A 93 -0.966 -2.915 -5.958 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -2.494 -4.676 -5.160 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -1.607 -5.182 -6.618 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -1.120 -5.799 -5.022 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -1.465 -3.114 -3.552 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -0.051 -4.174 -3.350 1.00 0.00 H new ATOM 0 HD23 LEU A 93 0.172 -2.477 -3.836 1.00 0.00 H new ATOM 1486 N ASP A 94 0.674 -2.170 -8.977 1.00 0.00 N ATOM 1487 CA ASP A 94 0.919 -0.830 -9.498 1.00 0.00 C ATOM 1488 C ASP A 94 0.270 0.226 -8.608 1.00 0.00 C ATOM 1489 O ASP A 94 -0.933 0.471 -8.694 1.00 0.00 O ATOM 1490 CB ASP A 94 0.385 -0.710 -10.926 1.00 0.00 C ATOM 1491 CG ASP A 94 0.018 0.716 -11.289 1.00 0.00 C ATOM 1492 OD1 ASP A 94 0.806 1.631 -10.970 1.00 0.00 O ATOM 1493 OD2 ASP A 94 -1.057 0.916 -11.892 1.00 0.00 O ATOM 0 H ASP A 94 -0.020 -2.705 -9.499 1.00 0.00 H new ATOM 0 HA ASP A 94 1.996 -0.661 -9.506 1.00 0.00 H new ATOM 0 HB2 ASP A 94 1.137 -1.077 -11.624 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -0.492 -1.347 -11.038 1.00 0.00 H new ATOM 1498 N VAL A 95 1.075 0.847 -7.753 1.00 0.00 N ATOM 1499 CA VAL A 95 0.580 1.877 -6.847 1.00 0.00 C ATOM 1500 C VAL A 95 1.150 3.245 -7.205 1.00 0.00 C ATOM 1501 O VAL A 95 2.296 3.555 -6.880 1.00 0.00 O ATOM 1502 CB VAL A 95 0.932 1.553 -5.383 1.00 0.00 C ATOM 1503 CG1 VAL A 95 0.283 2.558 -4.443 1.00 0.00 C ATOM 1504 CG2 VAL A 95 0.510 0.134 -5.035 1.00 0.00 C ATOM 0 H VAL A 95 2.073 0.655 -7.668 1.00 0.00 H new ATOM 0 HA VAL A 95 -0.504 1.899 -6.956 1.00 0.00 H new ATOM 0 HB VAL A 95 2.013 1.625 -5.263 1.00 0.00 H new ATOM 0 HG11 VAL A 95 0.543 2.313 -3.413 1.00 0.00 H new ATOM 0 HG12 VAL A 95 0.640 3.560 -4.679 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -0.800 2.521 -4.563 1.00 0.00 H new ATOM 0 HG21 VAL A 95 0.766 -0.078 -3.997 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -0.567 0.031 -5.171 1.00 0.00 H new ATOM 0 HG23 VAL A 95 1.027 -0.570 -5.687 1.00 0.00 H new ATOM 1514 N ALA A 96 0.343 4.059 -7.876 1.00 0.00 N ATOM 1515 CA ALA A 96 0.766 5.395 -8.277 1.00 0.00 C ATOM 1516 C ALA A 96 -0.214 6.453 -7.781 1.00 0.00 C ATOM 1517 O ALA A 96 -1.418 6.360 -8.022 1.00 0.00 O ATOM 1518 CB ALA A 96 0.908 5.473 -9.790 1.00 0.00 C ATOM 0 H ALA A 96 -0.608 3.817 -8.154 1.00 0.00 H new ATOM 0 HA ALA A 96 1.736 5.593 -7.822 1.00 0.00 H new ATOM 0 HB1 ALA A 96 1.224 6.477 -10.074 1.00 0.00 H new ATOM 0 HB2 ALA A 96 1.652 4.750 -10.123 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -0.051 5.249 -10.257 1.00 0.00 H new ATOM 1524 N VAL A 97 0.309 7.459 -7.087 1.00 0.00 N ATOM 1525 CA VAL A 97 -0.521 8.535 -6.557 1.00 0.00 C ATOM 1526 C VAL A 97 -0.509 9.745 -7.484 1.00 0.00 C ATOM 1527 O VAL A 97 0.420 10.553 -7.457 1.00 0.00 O ATOM 1528 CB VAL A 97 -0.049 8.970 -5.157 1.00 0.00 C ATOM 1529 CG1 VAL A 97 -0.844 10.174 -4.676 1.00 0.00 C ATOM 1530 CG2 VAL A 97 -0.166 7.816 -4.173 1.00 0.00 C ATOM 0 H VAL A 97 1.303 7.551 -6.879 1.00 0.00 H new ATOM 0 HA VAL A 97 -1.537 8.146 -6.485 1.00 0.00 H new ATOM 0 HB VAL A 97 1.000 9.259 -5.220 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -0.497 10.467 -3.685 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -0.704 11.003 -5.370 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -1.902 9.916 -4.628 1.00 0.00 H new ATOM 0 HG21 VAL A 97 0.172 8.141 -3.189 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -1.206 7.494 -4.112 1.00 0.00 H new ATOM 0 HG23 VAL A 97 0.452 6.985 -4.512 1.00 0.00 H new ATOM 1540 N LYS A 98 -1.547 9.865 -8.305 1.00 0.00 N ATOM 1541 CA LYS A 98 -1.658 10.978 -9.241 1.00 0.00 C ATOM 1542 C LYS A 98 -2.823 11.888 -8.867 1.00 0.00 C ATOM 1543 O LYS A 98 -3.608 11.573 -7.974 1.00 0.00 O ATOM 1544 CB LYS A 98 -1.843 10.455 -10.667 1.00 0.00 C ATOM 1545 CG LYS A 98 -0.902 9.317 -11.024 1.00 0.00 C ATOM 1546 CD LYS A 98 -1.518 8.388 -12.057 1.00 0.00 C ATOM 1547 CE LYS A 98 -0.454 7.748 -12.936 1.00 0.00 C ATOM 1548 NZ LYS A 98 -1.020 7.255 -14.222 1.00 0.00 N ATOM 0 H LYS A 98 -2.324 9.205 -8.341 1.00 0.00 H new ATOM 0 HA LYS A 98 -0.736 11.557 -9.190 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -2.872 10.117 -10.791 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -1.691 11.275 -11.369 1.00 0.00 H new ATOM 0 HG2 LYS A 98 0.032 9.724 -11.410 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -0.656 8.751 -10.125 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -2.091 7.610 -11.552 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -2.218 8.946 -12.679 1.00 0.00 H new ATOM 0 HE2 LYS A 98 0.333 8.474 -13.140 1.00 0.00 H new ATOM 0 HE3 LYS A 98 0.008 6.918 -12.401 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -0.264 6.826 -14.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -1.754 6.544 -14.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -1.439 8.051 -14.745 1.00 0.00 H new ATOM 1562 N ASN A 99 -2.930 13.019 -9.558 1.00 0.00 N ATOM 1563 CA ASN A 99 -4.001 13.975 -9.298 1.00 0.00 C ATOM 1564 C ASN A 99 -5.001 13.997 -10.450 1.00 0.00 C ATOM 1565 O ASN A 99 -4.619 14.103 -11.616 1.00 0.00 O ATOM 1566 CB ASN A 99 -3.422 15.375 -9.083 1.00 0.00 C ATOM 1567 CG ASN A 99 -3.180 16.107 -10.389 1.00 0.00 C ATOM 1568 OD1 ASN A 99 -3.933 17.009 -10.756 1.00 0.00 O ATOM 1569 ND2 ASN A 99 -2.124 15.721 -11.097 1.00 0.00 N ATOM 0 H ASN A 99 -2.289 13.296 -10.301 1.00 0.00 H new ATOM 0 HA ASN A 99 -4.522 13.662 -8.393 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -4.105 15.957 -8.465 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -2.484 15.297 -8.534 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -1.910 16.177 -11.984 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -1.527 14.968 -10.754 1.00 0.00 H new ATOM 1576 N SER A 100 -6.283 13.898 -10.116 1.00 0.00 N ATOM 1577 CA SER A 100 -7.339 13.904 -11.122 1.00 0.00 C ATOM 1578 C SER A 100 -7.617 15.323 -11.609 1.00 0.00 C ATOM 1579 O SER A 100 -7.656 15.583 -12.811 1.00 0.00 O ATOM 1580 CB SER A 100 -8.618 13.288 -10.553 1.00 0.00 C ATOM 1581 OG SER A 100 -9.554 13.015 -11.582 1.00 0.00 O ATOM 0 H SER A 100 -6.616 13.813 -9.156 1.00 0.00 H new ATOM 0 HA SER A 100 -7.003 13.307 -11.970 1.00 0.00 H new ATOM 0 HB2 SER A 100 -8.377 12.367 -10.023 1.00 0.00 H new ATOM 0 HB3 SER A 100 -9.061 13.968 -9.825 1.00 0.00 H new ATOM 0 HG SER A 100 -10.362 12.620 -11.193 1.00 0.00 H new ATOM 1587 N GLY A 101 -7.811 16.239 -10.664 1.00 0.00 N ATOM 1588 CA GLY A 101 -8.084 17.620 -11.016 1.00 0.00 C ATOM 1589 C GLY A 101 -9.534 17.846 -11.396 1.00 0.00 C ATOM 1590 O GLY A 101 -10.246 18.601 -10.735 1.00 0.00 O ATOM 0 H GLY A 101 -7.784 16.049 -9.662 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -7.828 18.264 -10.174 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -7.444 17.913 -11.848 1.00 0.00 H new ATOM 1594 N GLY A 102 -9.972 17.192 -12.467 1.00 0.00 N ATOM 1595 CA GLY A 102 -11.344 17.340 -12.917 1.00 0.00 C ATOM 1596 C GLY A 102 -11.670 18.764 -13.323 1.00 0.00 C ATOM 1597 O GLY A 102 -11.035 19.323 -14.216 1.00 0.00 O ATOM 0 H GLY A 102 -9.402 16.562 -13.031 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -11.520 16.675 -13.763 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -12.020 17.029 -12.121 1.00 0.00 H new ATOM 1601 N PHE A 103 -12.665 19.351 -12.666 1.00 0.00 N ATOM 1602 CA PHE A 103 -13.077 20.717 -12.965 1.00 0.00 C ATOM 1603 C PHE A 103 -13.183 20.936 -14.472 1.00 0.00 C ATOM 1604 O PHE A 103 -12.591 21.867 -15.019 1.00 0.00 O ATOM 1605 CB PHE A 103 -12.086 21.715 -12.363 1.00 0.00 C ATOM 1606 CG PHE A 103 -12.709 23.030 -11.992 1.00 0.00 C ATOM 1607 CD1 PHE A 103 -13.631 23.636 -12.830 1.00 0.00 C ATOM 1608 CD2 PHE A 103 -12.373 23.661 -10.805 1.00 0.00 C ATOM 1609 CE1 PHE A 103 -14.207 24.846 -12.491 1.00 0.00 C ATOM 1610 CE2 PHE A 103 -12.946 24.871 -10.461 1.00 0.00 C ATOM 1611 CZ PHE A 103 -13.863 25.464 -11.306 1.00 0.00 C ATOM 0 H PHE A 103 -13.201 18.902 -11.923 1.00 0.00 H new ATOM 0 HA PHE A 103 -14.060 20.878 -12.521 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -11.633 21.274 -11.475 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -11.282 21.892 -13.077 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -13.903 23.157 -13.759 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -11.655 23.202 -10.141 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -14.925 25.307 -13.153 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -12.677 25.352 -9.532 1.00 0.00 H new ATOM 0 HZ PHE A 103 -14.310 26.410 -11.040 1.00 0.00 H new ATOM 1621 N LEU A 104 -13.942 20.071 -15.137 1.00 0.00 N ATOM 1622 CA LEU A 104 -14.126 20.168 -16.581 1.00 0.00 C ATOM 1623 C LEU A 104 -12.789 20.071 -17.308 1.00 0.00 C ATOM 1624 O LEU A 104 -12.478 20.895 -18.169 1.00 0.00 O ATOM 1625 CB LEU A 104 -14.821 21.483 -16.939 1.00 0.00 C ATOM 1626 CG LEU A 104 -15.984 21.896 -16.036 1.00 0.00 C ATOM 1627 CD1 LEU A 104 -16.236 23.392 -16.140 1.00 0.00 C ATOM 1628 CD2 LEU A 104 -17.240 21.115 -16.394 1.00 0.00 C ATOM 0 H LEU A 104 -14.439 19.295 -14.700 1.00 0.00 H new ATOM 0 HA LEU A 104 -14.752 19.335 -16.900 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -14.077 22.279 -16.926 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -15.190 21.409 -17.962 1.00 0.00 H new ATOM 0 HG LEU A 104 -15.718 21.665 -15.005 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -17.067 23.667 -15.490 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -15.341 23.934 -15.834 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -16.481 23.649 -17.171 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -18.057 21.422 -15.741 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -17.509 21.314 -17.431 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -17.054 20.049 -16.266 1.00 0.00 H new ATOM 1640 N SER A 105 -12.003 19.059 -16.958 1.00 0.00 N ATOM 1641 CA SER A 105 -10.698 18.855 -17.577 1.00 0.00 C ATOM 1642 C SER A 105 -10.147 17.473 -17.239 1.00 0.00 C ATOM 1643 O SER A 105 -10.755 16.717 -16.481 1.00 0.00 O ATOM 1644 CB SER A 105 -9.717 19.935 -17.116 1.00 0.00 C ATOM 1645 OG SER A 105 -10.059 21.199 -17.658 1.00 0.00 O ATOM 0 H SER A 105 -12.246 18.367 -16.249 1.00 0.00 H new ATOM 0 HA SER A 105 -10.821 18.924 -18.658 1.00 0.00 H new ATOM 0 HB2 SER A 105 -9.717 19.990 -16.027 1.00 0.00 H new ATOM 0 HB3 SER A 105 -8.706 19.666 -17.421 1.00 0.00 H new ATOM 0 HG SER A 105 -10.814 21.097 -18.275 1.00 0.00 H new ATOM 1651 N LYS A 106 -8.989 17.150 -17.805 1.00 0.00 N ATOM 1652 CA LYS A 106 -8.352 15.861 -17.565 1.00 0.00 C ATOM 1653 C LYS A 106 -6.833 15.997 -17.561 1.00 0.00 C ATOM 1654 O LYS A 106 -6.274 16.837 -18.265 1.00 0.00 O ATOM 1655 CB LYS A 106 -8.782 14.850 -18.631 1.00 0.00 C ATOM 1656 CG LYS A 106 -10.280 14.829 -18.881 1.00 0.00 C ATOM 1657 CD LYS A 106 -10.676 15.806 -19.975 1.00 0.00 C ATOM 1658 CE LYS A 106 -10.336 15.264 -21.355 1.00 0.00 C ATOM 1659 NZ LYS A 106 -11.185 14.096 -21.718 1.00 0.00 N ATOM 0 H LYS A 106 -8.472 17.764 -18.434 1.00 0.00 H new ATOM 0 HA LYS A 106 -8.669 15.504 -16.585 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -8.270 15.080 -19.565 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -8.459 13.854 -18.327 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -10.589 13.822 -19.162 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -10.807 15.079 -17.960 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -11.746 16.007 -19.915 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -10.164 16.756 -19.819 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -10.467 16.052 -22.097 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -9.286 14.972 -21.382 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -11.162 13.957 -22.748 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -10.823 13.243 -21.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -12.164 14.271 -21.414 1.00 0.00 H new ATOM 1673 N ASP A 107 -6.171 15.164 -16.765 1.00 0.00 N ATOM 1674 CA ASP A 107 -4.716 15.190 -16.671 1.00 0.00 C ATOM 1675 C ASP A 107 -4.197 13.954 -15.944 1.00 0.00 C ATOM 1676 O ASP A 107 -4.866 13.409 -15.066 1.00 0.00 O ATOM 1677 CB ASP A 107 -4.253 16.455 -15.948 1.00 0.00 C ATOM 1678 CG ASP A 107 -2.757 16.674 -16.065 1.00 0.00 C ATOM 1679 OD1 ASP A 107 -2.224 16.535 -17.185 1.00 0.00 O ATOM 1680 OD2 ASP A 107 -2.120 16.983 -15.036 1.00 0.00 O ATOM 0 H ASP A 107 -6.619 14.462 -16.176 1.00 0.00 H new ATOM 0 HA ASP A 107 -4.311 15.191 -17.683 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -4.777 17.318 -16.360 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -4.526 16.389 -14.895 1.00 0.00 H new ATOM 1685 N LYS A 108 -2.999 13.515 -16.315 1.00 0.00 N ATOM 1686 CA LYS A 108 -2.387 12.344 -15.699 1.00 0.00 C ATOM 1687 C LYS A 108 -1.138 12.731 -14.915 1.00 0.00 C ATOM 1688 O LYS A 108 -0.327 11.877 -14.558 1.00 0.00 O ATOM 1689 CB LYS A 108 -2.031 11.307 -16.767 1.00 0.00 C ATOM 1690 CG LYS A 108 -3.209 10.900 -17.635 1.00 0.00 C ATOM 1691 CD LYS A 108 -3.331 11.788 -18.862 1.00 0.00 C ATOM 1692 CE LYS A 108 -4.301 11.205 -19.878 1.00 0.00 C ATOM 1693 NZ LYS A 108 -4.205 11.894 -21.195 1.00 0.00 N ATOM 0 H LYS A 108 -2.432 13.954 -17.041 1.00 0.00 H new ATOM 0 HA LYS A 108 -3.109 11.910 -15.007 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -1.243 11.709 -17.404 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -1.626 10.420 -16.280 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -3.091 9.862 -17.946 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -4.128 10.956 -17.052 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -3.669 12.780 -18.562 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -2.351 11.911 -19.322 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -4.096 10.142 -20.008 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -5.319 11.289 -19.498 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -4.882 11.468 -21.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -4.426 12.903 -21.076 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -3.240 11.793 -21.570 1.00 0.00 H new ATOM 1707 N GLY A 109 -0.989 14.025 -14.648 1.00 0.00 N ATOM 1708 CA GLY A 109 0.164 14.502 -13.906 1.00 0.00 C ATOM 1709 C GLY A 109 0.618 13.519 -12.845 1.00 0.00 C ATOM 1710 O GLY A 109 0.024 13.437 -11.770 1.00 0.00 O ATOM 0 H GLY A 109 -1.646 14.752 -14.932 1.00 0.00 H new ATOM 0 HA2 GLY A 109 0.985 14.690 -14.598 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -0.080 15.454 -13.434 1.00 0.00 H new ATOM 1714 N LEU A 110 1.672 12.770 -13.148 1.00 0.00 N ATOM 1715 CA LEU A 110 2.205 11.786 -12.212 1.00 0.00 C ATOM 1716 C LEU A 110 3.051 12.459 -11.136 1.00 0.00 C ATOM 1717 O LEU A 110 4.171 12.901 -11.398 1.00 0.00 O ATOM 1718 CB LEU A 110 3.042 10.745 -12.958 1.00 0.00 C ATOM 1719 CG LEU A 110 3.916 9.839 -12.090 1.00 0.00 C ATOM 1720 CD1 LEU A 110 3.055 9.011 -11.148 1.00 0.00 C ATOM 1721 CD2 LEU A 110 4.778 8.936 -12.960 1.00 0.00 C ATOM 0 H LEU A 110 2.174 12.825 -14.034 1.00 0.00 H new ATOM 0 HA LEU A 110 1.364 11.289 -11.728 1.00 0.00 H new ATOM 0 HB2 LEU A 110 2.369 10.117 -13.541 1.00 0.00 H new ATOM 0 HB3 LEU A 110 3.685 11.266 -13.667 1.00 0.00 H new ATOM 0 HG LEU A 110 4.574 10.468 -11.490 1.00 0.00 H new ATOM 0 HD11 LEU A 110 3.694 8.372 -10.538 1.00 0.00 H new ATOM 0 HD12 LEU A 110 2.482 9.675 -10.501 1.00 0.00 H new ATOM 0 HD13 LEU A 110 2.372 8.392 -11.729 1.00 0.00 H new ATOM 0 HD21 LEU A 110 5.393 8.298 -12.325 1.00 0.00 H new ATOM 0 HD22 LEU A 110 4.138 8.315 -13.586 1.00 0.00 H new ATOM 0 HD23 LEU A 110 5.422 9.547 -13.593 1.00 0.00 H new ATOM 1733 N LEU A 111 2.510 12.533 -9.926 1.00 0.00 N ATOM 1734 CA LEU A 111 3.215 13.151 -8.808 1.00 0.00 C ATOM 1735 C LEU A 111 4.240 12.190 -8.213 1.00 0.00 C ATOM 1736 O LEU A 111 5.295 12.607 -7.738 1.00 0.00 O ATOM 1737 CB LEU A 111 2.221 13.587 -7.730 1.00 0.00 C ATOM 1738 CG LEU A 111 0.998 14.362 -8.219 1.00 0.00 C ATOM 1739 CD1 LEU A 111 0.063 14.672 -7.060 1.00 0.00 C ATOM 1740 CD2 LEU A 111 1.424 15.644 -8.920 1.00 0.00 C ATOM 0 H LEU A 111 1.585 12.173 -9.693 1.00 0.00 H new ATOM 0 HA LEU A 111 3.742 14.029 -9.183 1.00 0.00 H new ATOM 0 HB2 LEU A 111 1.876 12.698 -7.202 1.00 0.00 H new ATOM 0 HB3 LEU A 111 2.751 14.204 -7.004 1.00 0.00 H new ATOM 0 HG LEU A 111 0.461 13.740 -8.936 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -0.802 15.224 -7.428 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -0.269 13.741 -6.601 1.00 0.00 H new ATOM 0 HD13 LEU A 111 0.589 15.274 -6.319 1.00 0.00 H new ATOM 0 HD21 LEU A 111 0.540 16.183 -9.262 1.00 0.00 H new ATOM 0 HD22 LEU A 111 1.985 16.270 -8.225 1.00 0.00 H new ATOM 0 HD23 LEU A 111 2.053 15.399 -9.776 1.00 0.00 H new ATOM 1752 N GLY A 112 3.921 10.899 -8.244 1.00 0.00 N ATOM 1753 CA GLY A 112 4.825 9.899 -7.707 1.00 0.00 C ATOM 1754 C GLY A 112 4.234 8.504 -7.745 1.00 0.00 C ATOM 1755 O GLY A 112 3.042 8.318 -7.498 1.00 0.00 O ATOM 0 H GLY A 112 3.053 10.529 -8.631 1.00 0.00 H new ATOM 0 HA2 GLY A 112 5.755 9.912 -8.275 1.00 0.00 H new ATOM 0 HA3 GLY A 112 5.076 10.156 -6.678 1.00 0.00 H new ATOM 1759 N LYS A 113 5.068 7.518 -8.058 1.00 0.00 N ATOM 1760 CA LYS A 113 4.623 6.132 -8.130 1.00 0.00 C ATOM 1761 C LYS A 113 5.646 5.198 -7.489 1.00 0.00 C ATOM 1762 O LYS A 113 6.838 5.501 -7.449 1.00 0.00 O ATOM 1763 CB LYS A 113 4.387 5.724 -9.586 1.00 0.00 C ATOM 1764 CG LYS A 113 5.610 5.892 -10.470 1.00 0.00 C ATOM 1765 CD LYS A 113 5.306 5.537 -11.916 1.00 0.00 C ATOM 1766 CE LYS A 113 5.548 4.061 -12.191 1.00 0.00 C ATOM 1767 NZ LYS A 113 6.954 3.799 -12.608 1.00 0.00 N ATOM 0 H LYS A 113 6.057 7.654 -8.266 1.00 0.00 H new ATOM 0 HA LYS A 113 3.686 6.049 -7.580 1.00 0.00 H new ATOM 0 HB2 LYS A 113 4.068 4.682 -9.616 1.00 0.00 H new ATOM 0 HB3 LYS A 113 3.570 6.319 -9.994 1.00 0.00 H new ATOM 0 HG2 LYS A 113 5.962 6.922 -10.414 1.00 0.00 H new ATOM 0 HG3 LYS A 113 6.417 5.259 -10.101 1.00 0.00 H new ATOM 0 HD2 LYS A 113 4.269 5.785 -12.142 1.00 0.00 H new ATOM 0 HD3 LYS A 113 5.929 6.138 -12.578 1.00 0.00 H new ATOM 0 HE2 LYS A 113 5.321 3.482 -11.296 1.00 0.00 H new ATOM 0 HE3 LYS A 113 4.868 3.720 -12.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 7.093 2.776 -12.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 7.148 4.291 -13.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 7.604 4.147 -11.875 1.00 0.00 H new ATOM 1781 N VAL A 114 5.172 4.061 -6.990 1.00 0.00 N ATOM 1782 CA VAL A 114 6.045 3.082 -6.354 1.00 0.00 C ATOM 1783 C VAL A 114 5.530 1.664 -6.569 1.00 0.00 C ATOM 1784 O VAL A 114 4.374 1.359 -6.270 1.00 0.00 O ATOM 1785 CB VAL A 114 6.175 3.345 -4.842 1.00 0.00 C ATOM 1786 CG1 VAL A 114 4.809 3.312 -4.174 1.00 0.00 C ATOM 1787 CG2 VAL A 114 7.114 2.332 -4.204 1.00 0.00 C ATOM 0 H VAL A 114 4.188 3.795 -7.014 1.00 0.00 H new ATOM 0 HA VAL A 114 7.026 3.183 -6.819 1.00 0.00 H new ATOM 0 HB VAL A 114 6.598 4.339 -4.699 1.00 0.00 H new ATOM 0 HG11 VAL A 114 4.922 3.500 -3.106 1.00 0.00 H new ATOM 0 HG12 VAL A 114 4.171 4.079 -4.612 1.00 0.00 H new ATOM 0 HG13 VAL A 114 4.354 2.333 -4.324 1.00 0.00 H new ATOM 0 HG21 VAL A 114 7.194 2.533 -3.136 1.00 0.00 H new ATOM 0 HG22 VAL A 114 6.722 1.326 -4.356 1.00 0.00 H new ATOM 0 HG23 VAL A 114 8.100 2.410 -4.663 1.00 0.00 H new ATOM 1797 N LEU A 115 6.394 0.799 -7.089 1.00 0.00 N ATOM 1798 CA LEU A 115 6.027 -0.589 -7.345 1.00 0.00 C ATOM 1799 C LEU A 115 6.457 -1.488 -6.189 1.00 0.00 C ATOM 1800 O LEU A 115 7.482 -1.248 -5.551 1.00 0.00 O ATOM 1801 CB LEU A 115 6.664 -1.074 -8.648 1.00 0.00 C ATOM 1802 CG LEU A 115 5.966 -0.643 -9.938 1.00 0.00 C ATOM 1803 CD1 LEU A 115 4.620 -1.337 -10.074 1.00 0.00 C ATOM 1804 CD2 LEU A 115 5.794 0.869 -9.971 1.00 0.00 C ATOM 0 H LEU A 115 7.354 1.035 -7.342 1.00 0.00 H new ATOM 0 HA LEU A 115 4.942 -0.641 -7.437 1.00 0.00 H new ATOM 0 HB2 LEU A 115 7.694 -0.718 -8.680 1.00 0.00 H new ATOM 0 HB3 LEU A 115 6.703 -2.163 -8.626 1.00 0.00 H new ATOM 0 HG LEU A 115 6.590 -0.937 -10.782 1.00 0.00 H new ATOM 0 HD11 LEU A 115 4.138 -1.018 -10.998 1.00 0.00 H new ATOM 0 HD12 LEU A 115 4.768 -2.417 -10.096 1.00 0.00 H new ATOM 0 HD13 LEU A 115 3.988 -1.075 -9.226 1.00 0.00 H new ATOM 0 HD21 LEU A 115 5.295 1.158 -10.896 1.00 0.00 H new ATOM 0 HD22 LEU A 115 5.191 1.185 -9.120 1.00 0.00 H new ATOM 0 HD23 LEU A 115 6.772 1.348 -9.921 1.00 0.00 H new ATOM 1816 N VAL A 116 5.668 -2.525 -5.927 1.00 0.00 N ATOM 1817 CA VAL A 116 5.968 -3.462 -4.851 1.00 0.00 C ATOM 1818 C VAL A 116 5.914 -4.902 -5.346 1.00 0.00 C ATOM 1819 O VAL A 116 4.839 -5.432 -5.627 1.00 0.00 O ATOM 1820 CB VAL A 116 4.989 -3.297 -3.674 1.00 0.00 C ATOM 1821 CG1 VAL A 116 5.230 -4.372 -2.625 1.00 0.00 C ATOM 1822 CG2 VAL A 116 5.117 -1.909 -3.066 1.00 0.00 C ATOM 0 H VAL A 116 4.816 -2.738 -6.446 1.00 0.00 H new ATOM 0 HA VAL A 116 6.978 -3.237 -4.507 1.00 0.00 H new ATOM 0 HB VAL A 116 3.972 -3.411 -4.050 1.00 0.00 H new ATOM 0 HG11 VAL A 116 4.529 -4.240 -1.801 1.00 0.00 H new ATOM 0 HG12 VAL A 116 5.083 -5.355 -3.072 1.00 0.00 H new ATOM 0 HG13 VAL A 116 6.250 -4.292 -2.250 1.00 0.00 H new ATOM 0 HG21 VAL A 116 4.418 -1.810 -2.236 1.00 0.00 H new ATOM 0 HG22 VAL A 116 6.134 -1.763 -2.703 1.00 0.00 H new ATOM 0 HG23 VAL A 116 4.890 -1.158 -3.823 1.00 0.00 H new ATOM 1832 N ALA A 117 7.080 -5.532 -5.449 1.00 0.00 N ATOM 1833 CA ALA A 117 7.165 -6.913 -5.907 1.00 0.00 C ATOM 1834 C ALA A 117 6.490 -7.861 -4.922 1.00 0.00 C ATOM 1835 O ALA A 117 7.008 -8.115 -3.834 1.00 0.00 O ATOM 1836 CB ALA A 117 8.618 -7.311 -6.115 1.00 0.00 C ATOM 0 H ALA A 117 7.979 -5.107 -5.221 1.00 0.00 H new ATOM 0 HA ALA A 117 6.640 -6.987 -6.859 1.00 0.00 H new ATOM 0 HB1 ALA A 117 8.667 -8.345 -6.457 1.00 0.00 H new ATOM 0 HB2 ALA A 117 9.070 -6.660 -6.863 1.00 0.00 H new ATOM 0 HB3 ALA A 117 9.160 -7.214 -5.174 1.00 0.00 H new ATOM 1842 N LEU A 118 5.330 -8.381 -5.309 1.00 0.00 N ATOM 1843 CA LEU A 118 4.582 -9.301 -4.459 1.00 0.00 C ATOM 1844 C LEU A 118 5.121 -10.722 -4.589 1.00 0.00 C ATOM 1845 O LEU A 118 4.453 -11.686 -4.217 1.00 0.00 O ATOM 1846 CB LEU A 118 3.097 -9.271 -4.823 1.00 0.00 C ATOM 1847 CG LEU A 118 2.512 -7.894 -5.142 1.00 0.00 C ATOM 1848 CD1 LEU A 118 1.142 -8.033 -5.786 1.00 0.00 C ATOM 1849 CD2 LEU A 118 2.428 -7.046 -3.882 1.00 0.00 C ATOM 0 H LEU A 118 4.887 -8.181 -6.206 1.00 0.00 H new ATOM 0 HA LEU A 118 4.702 -8.980 -3.424 1.00 0.00 H new ATOM 0 HB2 LEU A 118 2.942 -9.918 -5.686 1.00 0.00 H new ATOM 0 HB3 LEU A 118 2.532 -9.701 -3.996 1.00 0.00 H new ATOM 0 HG LEU A 118 3.174 -7.394 -5.849 1.00 0.00 H new ATOM 0 HD11 LEU A 118 0.741 -7.043 -6.006 1.00 0.00 H new ATOM 0 HD12 LEU A 118 1.231 -8.602 -6.711 1.00 0.00 H new ATOM 0 HD13 LEU A 118 0.470 -8.553 -5.103 1.00 0.00 H new ATOM 0 HD21 LEU A 118 2.010 -6.070 -4.128 1.00 0.00 H new ATOM 0 HD22 LEU A 118 1.788 -7.542 -3.152 1.00 0.00 H new ATOM 0 HD23 LEU A 118 3.426 -6.918 -3.462 1.00 0.00 H new ATOM 1861 N ALA A 119 6.334 -10.843 -5.119 1.00 0.00 N ATOM 1862 CA ALA A 119 6.964 -12.146 -5.294 1.00 0.00 C ATOM 1863 C ALA A 119 7.687 -12.581 -4.024 1.00 0.00 C ATOM 1864 O ALA A 119 8.509 -13.498 -4.050 1.00 0.00 O ATOM 1865 CB ALA A 119 7.930 -12.111 -6.469 1.00 0.00 C ATOM 0 H ALA A 119 6.900 -10.055 -5.434 1.00 0.00 H new ATOM 0 HA ALA A 119 6.182 -12.876 -5.503 1.00 0.00 H new ATOM 0 HB1 ALA A 119 8.393 -13.090 -6.588 1.00 0.00 H new ATOM 0 HB2 ALA A 119 7.387 -11.853 -7.378 1.00 0.00 H new ATOM 0 HB3 ALA A 119 8.702 -11.364 -6.283 1.00 0.00 H new ATOM 1871 N SER A 120 7.377 -11.918 -2.915 1.00 0.00 N ATOM 1872 CA SER A 120 8.002 -12.234 -1.636 1.00 0.00 C ATOM 1873 C SER A 120 7.174 -13.257 -0.865 1.00 0.00 C ATOM 1874 O SER A 120 5.956 -13.333 -1.026 1.00 0.00 O ATOM 1875 CB SER A 120 8.171 -10.964 -0.799 1.00 0.00 C ATOM 1876 OG SER A 120 9.220 -11.109 0.143 1.00 0.00 O ATOM 0 H SER A 120 6.697 -11.159 -2.876 1.00 0.00 H new ATOM 0 HA SER A 120 8.984 -12.663 -1.836 1.00 0.00 H new ATOM 0 HB2 SER A 120 8.381 -10.118 -1.454 1.00 0.00 H new ATOM 0 HB3 SER A 120 7.239 -10.741 -0.279 1.00 0.00 H new ATOM 0 HG SER A 120 9.309 -10.284 0.664 1.00 0.00 H new ATOM 1882 N GLU A 121 7.844 -14.042 -0.027 1.00 0.00 N ATOM 1883 CA GLU A 121 7.170 -15.062 0.768 1.00 0.00 C ATOM 1884 C GLU A 121 6.556 -14.453 2.026 1.00 0.00 C ATOM 1885 O GLU A 121 5.613 -15.001 2.595 1.00 0.00 O ATOM 1886 CB GLU A 121 8.151 -16.171 1.152 1.00 0.00 C ATOM 1887 CG GLU A 121 7.495 -17.348 1.855 1.00 0.00 C ATOM 1888 CD GLU A 121 7.168 -17.053 3.306 1.00 0.00 C ATOM 1889 OE1 GLU A 121 7.871 -16.220 3.915 1.00 0.00 O ATOM 1890 OE2 GLU A 121 6.209 -17.655 3.832 1.00 0.00 O ATOM 0 H GLU A 121 8.852 -13.991 0.119 1.00 0.00 H new ATOM 0 HA GLU A 121 6.370 -15.488 0.163 1.00 0.00 H new ATOM 0 HB2 GLU A 121 8.652 -16.529 0.252 1.00 0.00 H new ATOM 0 HB3 GLU A 121 8.921 -15.754 1.801 1.00 0.00 H new ATOM 0 HG2 GLU A 121 6.580 -17.617 1.328 1.00 0.00 H new ATOM 0 HG3 GLU A 121 8.158 -18.212 1.804 1.00 0.00 H new ATOM 1897 N GLU A 122 7.099 -13.317 2.452 1.00 0.00 N ATOM 1898 CA GLU A 122 6.605 -12.635 3.642 1.00 0.00 C ATOM 1899 C GLU A 122 5.115 -12.332 3.517 1.00 0.00 C ATOM 1900 O GLU A 122 4.452 -12.002 4.502 1.00 0.00 O ATOM 1901 CB GLU A 122 7.383 -11.338 3.874 1.00 0.00 C ATOM 1902 CG GLU A 122 8.621 -11.516 4.736 1.00 0.00 C ATOM 1903 CD GLU A 122 9.177 -10.197 5.238 1.00 0.00 C ATOM 1904 OE1 GLU A 122 9.012 -9.178 4.537 1.00 0.00 O ATOM 1905 OE2 GLU A 122 9.777 -10.186 6.334 1.00 0.00 O ATOM 0 H GLU A 122 7.880 -12.850 1.991 1.00 0.00 H new ATOM 0 HA GLU A 122 6.753 -13.296 4.496 1.00 0.00 H new ATOM 0 HB2 GLU A 122 7.679 -10.924 2.910 1.00 0.00 H new ATOM 0 HB3 GLU A 122 6.724 -10.609 4.345 1.00 0.00 H new ATOM 0 HG2 GLU A 122 8.378 -12.151 5.588 1.00 0.00 H new ATOM 0 HG3 GLU A 122 9.388 -12.034 4.161 1.00 0.00 H new ATOM 1912 N LEU A 123 4.595 -12.445 2.300 1.00 0.00 N ATOM 1913 CA LEU A 123 3.183 -12.182 2.044 1.00 0.00 C ATOM 1914 C LEU A 123 2.298 -13.096 2.887 1.00 0.00 C ATOM 1915 O LEU A 123 1.146 -12.770 3.172 1.00 0.00 O ATOM 1916 CB LEU A 123 2.868 -12.376 0.560 1.00 0.00 C ATOM 1917 CG LEU A 123 3.257 -11.222 -0.365 1.00 0.00 C ATOM 1918 CD1 LEU A 123 3.221 -11.667 -1.818 1.00 0.00 C ATOM 1919 CD2 LEU A 123 2.335 -10.031 -0.147 1.00 0.00 C ATOM 0 H LEU A 123 5.130 -12.717 1.475 1.00 0.00 H new ATOM 0 HA LEU A 123 2.975 -11.148 2.321 1.00 0.00 H new ATOM 0 HB2 LEU A 123 3.375 -13.278 0.216 1.00 0.00 H new ATOM 0 HB3 LEU A 123 1.798 -12.553 0.456 1.00 0.00 H new ATOM 0 HG LEU A 123 4.276 -10.917 -0.126 1.00 0.00 H new ATOM 0 HD11 LEU A 123 3.501 -10.833 -2.461 1.00 0.00 H new ATOM 0 HD12 LEU A 123 3.922 -12.489 -1.964 1.00 0.00 H new ATOM 0 HD13 LEU A 123 2.214 -11.999 -2.072 1.00 0.00 H new ATOM 0 HD21 LEU A 123 2.626 -9.219 -0.813 1.00 0.00 H new ATOM 0 HD22 LEU A 123 1.307 -10.323 -0.359 1.00 0.00 H new ATOM 0 HD23 LEU A 123 2.411 -9.696 0.888 1.00 0.00 H new ATOM 1931 N ALA A 124 2.845 -14.240 3.283 1.00 0.00 N ATOM 1932 CA ALA A 124 2.108 -15.199 4.097 1.00 0.00 C ATOM 1933 C ALA A 124 1.726 -14.596 5.444 1.00 0.00 C ATOM 1934 O ALA A 124 0.755 -15.019 6.073 1.00 0.00 O ATOM 1935 CB ALA A 124 2.928 -16.464 4.296 1.00 0.00 C ATOM 0 H ALA A 124 3.797 -14.526 3.053 1.00 0.00 H new ATOM 0 HA ALA A 124 1.189 -15.455 3.569 1.00 0.00 H new ATOM 0 HB1 ALA A 124 2.365 -17.171 4.906 1.00 0.00 H new ATOM 0 HB2 ALA A 124 3.145 -16.913 3.327 1.00 0.00 H new ATOM 0 HB3 ALA A 124 3.863 -16.216 4.798 1.00 0.00 H new ATOM 1941 N LYS A 125 2.495 -13.606 5.884 1.00 0.00 N ATOM 1942 CA LYS A 125 2.238 -12.944 7.157 1.00 0.00 C ATOM 1943 C LYS A 125 1.690 -11.537 6.938 1.00 0.00 C ATOM 1944 O LYS A 125 0.646 -11.176 7.478 1.00 0.00 O ATOM 1945 CB LYS A 125 3.520 -12.879 7.990 1.00 0.00 C ATOM 1946 CG LYS A 125 3.918 -14.213 8.598 1.00 0.00 C ATOM 1947 CD LYS A 125 5.359 -14.199 9.079 1.00 0.00 C ATOM 1948 CE LYS A 125 5.844 -15.597 9.430 1.00 0.00 C ATOM 1949 NZ LYS A 125 5.140 -16.145 10.622 1.00 0.00 N ATOM 0 H LYS A 125 3.303 -13.244 5.377 1.00 0.00 H new ATOM 0 HA LYS A 125 1.491 -13.526 7.696 1.00 0.00 H new ATOM 0 HB2 LYS A 125 4.334 -12.518 7.361 1.00 0.00 H new ATOM 0 HB3 LYS A 125 3.388 -12.150 8.789 1.00 0.00 H new ATOM 0 HG2 LYS A 125 3.257 -14.445 9.433 1.00 0.00 H new ATOM 0 HG3 LYS A 125 3.788 -15.004 7.859 1.00 0.00 H new ATOM 0 HD2 LYS A 125 5.998 -13.775 8.304 1.00 0.00 H new ATOM 0 HD3 LYS A 125 5.446 -13.553 9.953 1.00 0.00 H new ATOM 0 HE2 LYS A 125 5.687 -16.260 8.579 1.00 0.00 H new ATOM 0 HE3 LYS A 125 6.917 -15.572 9.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 5.499 -17.099 10.829 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 5.310 -15.526 11.440 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 4.119 -16.193 10.430 1.00 0.00 H new ATOM 1963 N GLY A 126 2.402 -10.747 6.140 1.00 0.00 N ATOM 1964 CA GLY A 126 1.971 -9.390 5.863 1.00 0.00 C ATOM 1965 C GLY A 126 2.887 -8.352 6.480 1.00 0.00 C ATOM 1966 O GLY A 126 3.363 -8.524 7.603 1.00 0.00 O ATOM 0 H GLY A 126 3.270 -11.023 5.681 1.00 0.00 H new ATOM 0 HA2 GLY A 126 1.930 -9.238 4.784 1.00 0.00 H new ATOM 0 HA3 GLY A 126 0.959 -9.249 6.243 1.00 0.00 H new ATOM 1970 N TRP A 127 3.136 -7.274 5.746 1.00 0.00 N ATOM 1971 CA TRP A 127 4.004 -6.205 6.229 1.00 0.00 C ATOM 1972 C TRP A 127 3.415 -4.837 5.903 1.00 0.00 C ATOM 1973 O TRP A 127 2.594 -4.703 4.995 1.00 0.00 O ATOM 1974 CB TRP A 127 5.398 -6.334 5.611 1.00 0.00 C ATOM 1975 CG TRP A 127 5.450 -5.924 4.171 1.00 0.00 C ATOM 1976 CD1 TRP A 127 5.712 -4.675 3.683 1.00 0.00 C ATOM 1977 CD2 TRP A 127 5.232 -6.763 3.032 1.00 0.00 C ATOM 1978 NE1 TRP A 127 5.670 -4.688 2.310 1.00 0.00 N ATOM 1979 CE2 TRP A 127 5.379 -5.958 1.886 1.00 0.00 C ATOM 1980 CE3 TRP A 127 4.929 -8.118 2.869 1.00 0.00 C ATOM 1981 CZ2 TRP A 127 5.231 -6.463 0.597 1.00 0.00 C ATOM 1982 CZ3 TRP A 127 4.783 -8.618 1.589 1.00 0.00 C ATOM 1983 CH2 TRP A 127 4.935 -7.793 0.467 1.00 0.00 C ATOM 0 H TRP A 127 2.750 -7.116 4.815 1.00 0.00 H new ATOM 0 HA TRP A 127 4.084 -6.297 7.312 1.00 0.00 H new ATOM 0 HB2 TRP A 127 6.098 -5.723 6.181 1.00 0.00 H new ATOM 0 HB3 TRP A 127 5.732 -7.368 5.699 1.00 0.00 H new ATOM 0 HD1 TRP A 127 5.921 -3.805 4.288 1.00 0.00 H new ATOM 0 HE1 TRP A 127 5.830 -3.883 1.704 1.00 0.00 H new ATOM 0 HE3 TRP A 127 4.811 -8.762 3.728 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 5.346 -5.828 -0.269 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 4.548 -9.663 1.451 1.00 0.00 H new ATOM 0 HH2 TRP A 127 4.816 -8.215 -0.520 1.00 0.00 H new ATOM 1994 N THR A 128 3.839 -3.822 6.650 1.00 0.00 N ATOM 1995 CA THR A 128 3.352 -2.464 6.441 1.00 0.00 C ATOM 1996 C THR A 128 4.485 -1.451 6.555 1.00 0.00 C ATOM 1997 O THR A 128 5.241 -1.458 7.527 1.00 0.00 O ATOM 1998 CB THR A 128 2.250 -2.101 7.453 1.00 0.00 C ATOM 1999 OG1 THR A 128 1.164 -3.029 7.350 1.00 0.00 O ATOM 2000 CG2 THR A 128 1.740 -0.688 7.214 1.00 0.00 C ATOM 0 H THR A 128 4.519 -3.915 7.405 1.00 0.00 H new ATOM 0 HA THR A 128 2.936 -2.428 5.434 1.00 0.00 H new ATOM 0 HB THR A 128 2.677 -2.152 8.455 1.00 0.00 H new ATOM 0 HG1 THR A 128 0.377 -2.572 6.986 1.00 0.00 H new ATOM 0 HG21 THR A 128 0.962 -0.454 7.941 1.00 0.00 H new ATOM 0 HG22 THR A 128 2.563 0.019 7.323 1.00 0.00 H new ATOM 0 HG23 THR A 128 1.329 -0.615 6.207 1.00 0.00 H new ATOM 2008 N GLN A 129 4.597 -0.580 5.557 1.00 0.00 N ATOM 2009 CA GLN A 129 5.638 0.440 5.547 1.00 0.00 C ATOM 2010 C GLN A 129 5.299 1.555 4.564 1.00 0.00 C ATOM 2011 O GLN A 129 4.449 1.387 3.689 1.00 0.00 O ATOM 2012 CB GLN A 129 6.988 -0.182 5.184 1.00 0.00 C ATOM 2013 CG GLN A 129 7.288 -0.158 3.694 1.00 0.00 C ATOM 2014 CD GLN A 129 8.110 1.048 3.283 1.00 0.00 C ATOM 2015 OE1 GLN A 129 8.206 2.028 4.022 1.00 0.00 O ATOM 2016 NE2 GLN A 129 8.709 0.981 2.100 1.00 0.00 N ATOM 0 H GLN A 129 3.980 -0.561 4.745 1.00 0.00 H new ATOM 0 HA GLN A 129 5.700 0.869 6.547 1.00 0.00 H new ATOM 0 HB2 GLN A 129 7.778 0.350 5.714 1.00 0.00 H new ATOM 0 HB3 GLN A 129 7.009 -1.214 5.534 1.00 0.00 H new ATOM 0 HG2 GLN A 129 7.823 -1.068 3.420 1.00 0.00 H new ATOM 0 HG3 GLN A 129 6.350 -0.160 3.138 1.00 0.00 H new ATOM 0 HE21 GLN A 129 8.602 0.149 1.520 1.00 0.00 H new ATOM 0 HE22 GLN A 129 9.277 1.762 1.771 1.00 0.00 H new ATOM 2025 N TRP A 130 5.967 2.693 4.714 1.00 0.00 N ATOM 2026 CA TRP A 130 5.735 3.837 3.839 1.00 0.00 C ATOM 2027 C TRP A 130 6.499 3.683 2.528 1.00 0.00 C ATOM 2028 O TRP A 130 7.703 3.930 2.468 1.00 0.00 O ATOM 2029 CB TRP A 130 6.151 5.132 4.537 1.00 0.00 C ATOM 2030 CG TRP A 130 5.169 5.592 5.571 1.00 0.00 C ATOM 2031 CD1 TRP A 130 5.152 5.251 6.894 1.00 0.00 C ATOM 2032 CD2 TRP A 130 4.060 6.474 5.368 1.00 0.00 C ATOM 2033 NE1 TRP A 130 4.099 5.869 7.525 1.00 0.00 N ATOM 2034 CE2 TRP A 130 3.415 6.625 6.611 1.00 0.00 C ATOM 2035 CE3 TRP A 130 3.552 7.154 4.258 1.00 0.00 C ATOM 2036 CZ2 TRP A 130 2.287 7.426 6.771 1.00 0.00 C ATOM 2037 CZ3 TRP A 130 2.432 7.948 4.419 1.00 0.00 C ATOM 2038 CH2 TRP A 130 1.810 8.080 5.667 1.00 0.00 C ATOM 0 H TRP A 130 6.674 2.848 5.433 1.00 0.00 H new ATOM 0 HA TRP A 130 4.669 3.881 3.614 1.00 0.00 H new ATOM 0 HB2 TRP A 130 7.123 4.986 5.009 1.00 0.00 H new ATOM 0 HB3 TRP A 130 6.274 5.916 3.789 1.00 0.00 H new ATOM 0 HD1 TRP A 130 5.862 4.593 7.373 1.00 0.00 H new ATOM 0 HE1 TRP A 130 3.865 5.779 8.514 1.00 0.00 H new ATOM 0 HE3 TRP A 130 4.026 7.061 3.292 1.00 0.00 H new ATOM 0 HZ2 TRP A 130 1.805 7.528 7.732 1.00 0.00 H new ATOM 0 HZ3 TRP A 130 2.029 8.476 3.567 1.00 0.00 H new ATOM 0 HH2 TRP A 130 0.938 8.710 5.760 1.00 0.00 H new ATOM 2049 N TYR A 131 5.791 3.274 1.481 1.00 0.00 N ATOM 2050 CA TYR A 131 6.404 3.086 0.171 1.00 0.00 C ATOM 2051 C TYR A 131 6.726 4.428 -0.478 1.00 0.00 C ATOM 2052 O TYR A 131 5.840 5.111 -0.991 1.00 0.00 O ATOM 2053 CB TYR A 131 5.476 2.277 -0.738 1.00 0.00 C ATOM 2054 CG TYR A 131 5.064 0.946 -0.151 1.00 0.00 C ATOM 2055 CD1 TYR A 131 5.994 0.117 0.465 1.00 0.00 C ATOM 2056 CD2 TYR A 131 3.744 0.517 -0.213 1.00 0.00 C ATOM 2057 CE1 TYR A 131 5.621 -1.100 1.001 1.00 0.00 C ATOM 2058 CE2 TYR A 131 3.362 -0.698 0.322 1.00 0.00 C ATOM 2059 CZ TYR A 131 4.304 -1.503 0.927 1.00 0.00 C ATOM 2060 OH TYR A 131 3.929 -2.715 1.462 1.00 0.00 O ATOM 0 H TYR A 131 4.793 3.066 1.514 1.00 0.00 H new ATOM 0 HA TYR A 131 7.336 2.537 0.310 1.00 0.00 H new ATOM 0 HB2 TYR A 131 4.582 2.865 -0.947 1.00 0.00 H new ATOM 0 HB3 TYR A 131 5.975 2.105 -1.692 1.00 0.00 H new ATOM 0 HD1 TYR A 131 7.026 0.430 0.526 1.00 0.00 H new ATOM 0 HD2 TYR A 131 3.004 1.144 -0.688 1.00 0.00 H new ATOM 0 HE1 TYR A 131 6.357 -1.733 1.475 1.00 0.00 H new ATOM 0 HE2 TYR A 131 2.331 -1.016 0.267 1.00 0.00 H new ATOM 0 HH TYR A 131 4.549 -2.962 2.179 1.00 0.00 H new ATOM 2070 N ASP A 132 8.002 4.799 -0.452 1.00 0.00 N ATOM 2071 CA ASP A 132 8.444 6.059 -1.038 1.00 0.00 C ATOM 2072 C ASP A 132 8.142 6.098 -2.533 1.00 0.00 C ATOM 2073 O ASP A 132 8.441 5.152 -3.263 1.00 0.00 O ATOM 2074 CB ASP A 132 9.942 6.258 -0.803 1.00 0.00 C ATOM 2075 CG ASP A 132 10.787 5.267 -1.580 1.00 0.00 C ATOM 2076 OD1 ASP A 132 10.655 4.051 -1.329 1.00 0.00 O ATOM 2077 OD2 ASP A 132 11.579 5.708 -2.439 1.00 0.00 O ATOM 0 H ASP A 132 8.748 4.245 -0.031 1.00 0.00 H new ATOM 0 HA ASP A 132 7.898 6.868 -0.553 1.00 0.00 H new ATOM 0 HB2 ASP A 132 10.220 7.272 -1.090 1.00 0.00 H new ATOM 0 HB3 ASP A 132 10.156 6.158 0.261 1.00 0.00 H new ATOM 2082 N LEU A 133 7.545 7.197 -2.982 1.00 0.00 N ATOM 2083 CA LEU A 133 7.201 7.359 -4.391 1.00 0.00 C ATOM 2084 C LEU A 133 8.419 7.787 -5.203 1.00 0.00 C ATOM 2085 O LEU A 133 9.379 8.337 -4.662 1.00 0.00 O ATOM 2086 CB LEU A 133 6.081 8.389 -4.547 1.00 0.00 C ATOM 2087 CG LEU A 133 4.749 8.038 -3.885 1.00 0.00 C ATOM 2088 CD1 LEU A 133 3.777 9.203 -3.990 1.00 0.00 C ATOM 2089 CD2 LEU A 133 4.154 6.787 -4.514 1.00 0.00 C ATOM 0 H LEU A 133 7.289 7.988 -2.392 1.00 0.00 H new ATOM 0 HA LEU A 133 6.856 6.397 -4.769 1.00 0.00 H new ATOM 0 HB2 LEU A 133 6.428 9.338 -4.138 1.00 0.00 H new ATOM 0 HB3 LEU A 133 5.905 8.546 -5.611 1.00 0.00 H new ATOM 0 HG LEU A 133 4.932 7.838 -2.829 1.00 0.00 H new ATOM 0 HD11 LEU A 133 2.834 8.934 -3.513 1.00 0.00 H new ATOM 0 HD12 LEU A 133 4.200 10.076 -3.492 1.00 0.00 H new ATOM 0 HD13 LEU A 133 3.599 9.435 -5.040 1.00 0.00 H new ATOM 0 HD21 LEU A 133 3.206 6.552 -4.030 1.00 0.00 H new ATOM 0 HD22 LEU A 133 3.986 6.959 -5.577 1.00 0.00 H new ATOM 0 HD23 LEU A 133 4.843 5.952 -4.386 1.00 0.00 H new ATOM 2101 N THR A 134 8.373 7.534 -6.507 1.00 0.00 N ATOM 2102 CA THR A 134 9.471 7.894 -7.395 1.00 0.00 C ATOM 2103 C THR A 134 8.955 8.299 -8.771 1.00 0.00 C ATOM 2104 O THR A 134 7.775 8.133 -9.075 1.00 0.00 O ATOM 2105 CB THR A 134 10.469 6.732 -7.555 1.00 0.00 C ATOM 2106 OG1 THR A 134 9.976 5.792 -8.516 1.00 0.00 O ATOM 2107 CG2 THR A 134 10.700 6.030 -6.225 1.00 0.00 C ATOM 0 H THR A 134 7.586 7.081 -6.972 1.00 0.00 H new ATOM 0 HA THR A 134 9.982 8.741 -6.938 1.00 0.00 H new ATOM 0 HB THR A 134 11.418 7.142 -7.901 1.00 0.00 H new ATOM 0 HG1 THR A 134 9.030 5.609 -8.339 1.00 0.00 H new ATOM 0 HG21 THR A 134 11.408 5.213 -6.363 1.00 0.00 H new ATOM 0 HG22 THR A 134 11.102 6.741 -5.503 1.00 0.00 H new ATOM 0 HG23 THR A 134 9.755 5.632 -5.855 1.00 0.00 H new ATOM 2115 N GLU A 135 9.849 8.831 -9.600 1.00 0.00 N ATOM 2116 CA GLU A 135 9.482 9.259 -10.945 1.00 0.00 C ATOM 2117 C GLU A 135 9.317 8.059 -11.873 1.00 0.00 C ATOM 2118 O GLU A 135 9.739 6.948 -11.549 1.00 0.00 O ATOM 2119 CB GLU A 135 10.540 10.211 -11.507 1.00 0.00 C ATOM 2120 CG GLU A 135 10.679 11.501 -10.717 1.00 0.00 C ATOM 2121 CD GLU A 135 12.073 12.092 -10.806 1.00 0.00 C ATOM 2122 OE1 GLU A 135 13.011 11.484 -10.250 1.00 0.00 O ATOM 2123 OE2 GLU A 135 12.225 13.162 -11.432 1.00 0.00 O ATOM 0 H GLU A 135 10.831 8.975 -9.364 1.00 0.00 H new ATOM 0 HA GLU A 135 8.528 9.782 -10.884 1.00 0.00 H new ATOM 0 HB2 GLU A 135 11.503 9.701 -11.525 1.00 0.00 H new ATOM 0 HB3 GLU A 135 10.288 10.453 -12.539 1.00 0.00 H new ATOM 0 HG2 GLU A 135 9.956 12.228 -11.086 1.00 0.00 H new ATOM 0 HG3 GLU A 135 10.435 11.311 -9.672 1.00 0.00 H new ATOM 2130 N ASP A 136 8.701 8.291 -13.026 1.00 0.00 N ATOM 2131 CA ASP A 136 8.481 7.229 -14.002 1.00 0.00 C ATOM 2132 C ASP A 136 9.793 6.537 -14.357 1.00 0.00 C ATOM 2133 O ASP A 136 10.730 7.171 -14.840 1.00 0.00 O ATOM 2134 CB ASP A 136 7.830 7.796 -15.265 1.00 0.00 C ATOM 2135 CG ASP A 136 8.785 8.651 -16.075 1.00 0.00 C ATOM 2136 OD1 ASP A 136 9.067 9.790 -15.649 1.00 0.00 O ATOM 2137 OD2 ASP A 136 9.250 8.181 -17.134 1.00 0.00 O ATOM 0 H ASP A 136 8.345 9.204 -13.308 1.00 0.00 H new ATOM 0 HA ASP A 136 7.812 6.492 -13.557 1.00 0.00 H new ATOM 0 HB2 ASP A 136 7.468 6.975 -15.884 1.00 0.00 H new ATOM 0 HB3 ASP A 136 6.961 8.392 -14.986 1.00 0.00 H new ATOM 2142 N SER A 137 9.851 5.231 -14.114 1.00 0.00 N ATOM 2143 CA SER A 137 11.050 4.453 -14.404 1.00 0.00 C ATOM 2144 C SER A 137 10.708 3.213 -15.224 1.00 0.00 C ATOM 2145 O SER A 137 10.121 2.260 -14.714 1.00 0.00 O ATOM 2146 CB SER A 137 11.744 4.042 -13.103 1.00 0.00 C ATOM 2147 OG SER A 137 13.080 3.638 -13.344 1.00 0.00 O ATOM 0 H SER A 137 9.082 4.690 -13.717 1.00 0.00 H new ATOM 0 HA SER A 137 11.726 5.078 -14.987 1.00 0.00 H new ATOM 0 HB2 SER A 137 11.734 4.877 -12.402 1.00 0.00 H new ATOM 0 HB3 SER A 137 11.193 3.226 -12.635 1.00 0.00 H new ATOM 0 HG SER A 137 13.502 3.382 -12.497 1.00 0.00 H new ATOM 2153 N GLY A 138 11.079 3.235 -16.501 1.00 0.00 N ATOM 2154 CA GLY A 138 10.803 2.108 -17.373 1.00 0.00 C ATOM 2155 C GLY A 138 11.682 2.102 -18.608 1.00 0.00 C ATOM 2156 O GLY A 138 11.285 2.556 -19.681 1.00 0.00 O ATOM 0 H GLY A 138 11.565 4.013 -16.947 1.00 0.00 H new ATOM 0 HA2 GLY A 138 10.951 1.180 -16.821 1.00 0.00 H new ATOM 0 HA3 GLY A 138 9.756 2.135 -17.676 1.00 0.00 H new ATOM 2160 N PRO A 139 12.909 1.579 -18.464 1.00 0.00 N ATOM 2161 CA PRO A 139 13.872 1.505 -19.566 1.00 0.00 C ATOM 2162 C PRO A 139 13.459 0.493 -20.630 1.00 0.00 C ATOM 2163 O PRO A 139 13.881 0.583 -21.782 1.00 0.00 O ATOM 2164 CB PRO A 139 15.165 1.059 -18.878 1.00 0.00 C ATOM 2165 CG PRO A 139 14.714 0.336 -17.656 1.00 0.00 C ATOM 2166 CD PRO A 139 13.449 1.020 -17.213 1.00 0.00 C ATOM 0 HA PRO A 139 13.960 2.454 -20.095 1.00 0.00 H new ATOM 0 HB2 PRO A 139 15.755 0.411 -19.526 1.00 0.00 H new ATOM 0 HB3 PRO A 139 15.793 1.913 -18.624 1.00 0.00 H new ATOM 0 HG2 PRO A 139 14.534 -0.717 -17.870 1.00 0.00 H new ATOM 0 HG3 PRO A 139 15.474 0.377 -16.876 1.00 0.00 H new ATOM 0 HD2 PRO A 139 12.753 0.319 -16.752 1.00 0.00 H new ATOM 0 HD3 PRO A 139 13.650 1.799 -16.478 1.00 0.00 H new ATOM 2174 N SER A 140 12.632 -0.469 -20.235 1.00 0.00 N ATOM 2175 CA SER A 140 12.164 -1.500 -21.154 1.00 0.00 C ATOM 2176 C SER A 140 10.646 -1.635 -21.092 1.00 0.00 C ATOM 2177 O SER A 140 10.002 -1.118 -20.179 1.00 0.00 O ATOM 2178 CB SER A 140 12.821 -2.842 -20.825 1.00 0.00 C ATOM 2179 OG SER A 140 14.230 -2.766 -20.954 1.00 0.00 O ATOM 0 H SER A 140 12.272 -0.556 -19.285 1.00 0.00 H new ATOM 0 HA SER A 140 12.444 -1.205 -22.165 1.00 0.00 H new ATOM 0 HB2 SER A 140 12.561 -3.138 -19.809 1.00 0.00 H new ATOM 0 HB3 SER A 140 12.433 -3.613 -21.490 1.00 0.00 H new ATOM 0 HG SER A 140 14.626 -3.636 -20.737 1.00 0.00 H new ATOM 2185 N SER A 141 10.080 -2.334 -22.071 1.00 0.00 N ATOM 2186 CA SER A 141 8.637 -2.534 -22.132 1.00 0.00 C ATOM 2187 C SER A 141 8.281 -3.998 -21.892 1.00 0.00 C ATOM 2188 O SER A 141 7.392 -4.312 -21.102 1.00 0.00 O ATOM 2189 CB SER A 141 8.094 -2.081 -23.489 1.00 0.00 C ATOM 2190 OG SER A 141 6.739 -2.463 -23.649 1.00 0.00 O ATOM 0 H SER A 141 10.599 -2.771 -22.833 1.00 0.00 H new ATOM 0 HA SER A 141 8.179 -1.933 -21.347 1.00 0.00 H new ATOM 0 HB2 SER A 141 8.183 -0.998 -23.577 1.00 0.00 H new ATOM 0 HB3 SER A 141 8.695 -2.516 -24.288 1.00 0.00 H new ATOM 0 HG SER A 141 6.415 -2.161 -24.523 1.00 0.00 H new ATOM 2196 N GLY A 142 8.984 -4.892 -22.581 1.00 0.00 N ATOM 2197 CA GLY A 142 8.729 -6.313 -22.430 1.00 0.00 C ATOM 2198 C GLY A 142 8.929 -7.078 -23.723 1.00 0.00 C ATOM 2199 O GLY A 142 9.999 -7.017 -24.329 1.00 0.00 O ATOM 0 H GLY A 142 9.726 -4.658 -23.241 1.00 0.00 H new ATOM 0 HA2 GLY A 142 9.391 -6.719 -21.665 1.00 0.00 H new ATOM 0 HA3 GLY A 142 7.708 -6.460 -22.078 1.00 0.00 H new TER 2203 GLY A 142