USER MOD reduce.3.24.130724 H: found=0, std=0, add=875, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 867 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 32 ASN : amide:sc= -2.92 K(o=-3.4,f=-5.4!) USER MOD Set 1.2: A 41 GLN : amide:sc= -0.928 K(o=-3.4,f=-6!) USER MOD Set 1.3: A 64 THR OG1 : rot 180:sc= 0.408 USER MOD Set 2.1: A 2 SER OG : rot -160:sc= 0.564 USER MOD Set 2.2: A 5 THR OG1 : rot 142:sc= 1.17 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 172:sc= -1.2 (180deg=-1.31) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 GLN : amide:sc= -1.48 K(o=-1.5,f=-5.6!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 THR OG1 : rot 180:sc= 0.0664 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 50 LYS NZ :NH3+ 149:sc= -0.142 (180deg=-0.715) USER MOD Single : A 53 GLN : amide:sc= -2.46 K(o=-2.5,f=-4.2!) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 110:sc= 0.0285 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 GLN : amide:sc= -0.058 K(o=-0.058,f=-2.4) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 HIS : no HD1:sc= -2.2 K(o=-2.2,f=-0.55) USER MOD Single : A 107 HIS : no HD1:sc= -0.0852 X(o=-0.085,f=0) USER MOD Single : A 108 HIS : no HD1:sc=-0.00399 X(o=-0.004,f=-0.046) USER MOD Single : A 109 HIS : no HD1:sc= -0.0501 X(o=-0.05,f=-0.26) USER MOD Single : A 110 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 111 HIS : no HE2:sc= 0.122 K(o=0.12,f=-3.1!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.329 0.000 0.000 1.00 0.00 N ATOM 2 CA MET A 1 2.093 -0.001 -1.242 1.00 0.00 C ATOM 3 C MET A 1 3.008 1.217 -1.318 1.00 0.00 C ATOM 4 O MET A 1 4.073 1.167 -1.935 1.00 0.00 O ATOM 5 CB MET A 1 1.149 -0.020 -2.446 1.00 0.00 C ATOM 6 CG MET A 1 1.259 -1.282 -3.285 1.00 0.00 C ATOM 7 SD MET A 1 -0.211 -1.583 -4.284 1.00 0.00 S ATOM 8 CE MET A 1 -0.282 -3.373 -4.251 1.00 0.00 C ATOM 0 H1 MET A 1 0.618 -0.759 -0.029 1.00 0.00 H new ATOM 0 H2 MET A 1 1.971 -0.157 0.803 1.00 0.00 H new ATOM 0 H3 MET A 1 0.852 0.917 0.113 1.00 0.00 H new ATOM 0 HA MET A 1 2.711 -0.899 -1.259 1.00 0.00 H new ATOM 0 HB2 MET A 1 0.123 0.084 -2.094 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.359 0.844 -3.076 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.128 -1.204 -3.939 1.00 0.00 H new ATOM 0 HG3 MET A 1 1.429 -2.136 -2.629 1.00 0.00 H new ATOM 0 HE1 MET A 1 -1.142 -3.714 -4.828 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.631 -3.781 -4.685 1.00 0.00 H new ATOM 0 HE3 MET A 1 -0.378 -3.714 -3.220 1.00 0.00 H new ATOM 18 N SER A 2 2.587 2.309 -0.688 1.00 0.00 N ATOM 19 CA SER A 2 3.368 3.541 -0.688 1.00 0.00 C ATOM 20 C SER A 2 2.665 4.629 0.118 1.00 0.00 C ATOM 21 O SER A 2 1.608 5.123 -0.274 1.00 0.00 O ATOM 22 CB SER A 2 3.601 4.021 -2.122 1.00 0.00 C ATOM 23 OG SER A 2 2.686 3.415 -3.018 1.00 0.00 O ATOM 0 H SER A 2 1.710 2.366 -0.171 1.00 0.00 H new ATOM 0 HA SER A 2 4.331 3.333 -0.221 1.00 0.00 H new ATOM 0 HB2 SER A 2 3.496 5.105 -2.168 1.00 0.00 H new ATOM 0 HB3 SER A 2 4.621 3.787 -2.426 1.00 0.00 H new ATOM 0 HG SER A 2 3.035 3.474 -3.932 1.00 0.00 H new ATOM 29 N VAL A 3 3.261 4.998 1.247 1.00 0.00 N ATOM 30 CA VAL A 3 2.694 6.029 2.109 1.00 0.00 C ATOM 31 C VAL A 3 2.369 7.290 1.317 1.00 0.00 C ATOM 32 O VAL A 3 1.370 7.959 1.580 1.00 0.00 O ATOM 33 CB VAL A 3 3.655 6.390 3.257 1.00 0.00 C ATOM 34 CG1 VAL A 3 3.085 7.527 4.093 1.00 0.00 C ATOM 35 CG2 VAL A 3 3.934 5.171 4.122 1.00 0.00 C ATOM 0 H VAL A 3 4.136 4.599 1.586 1.00 0.00 H new ATOM 0 HA VAL A 3 1.775 5.621 2.529 1.00 0.00 H new ATOM 0 HB VAL A 3 4.598 6.725 2.826 1.00 0.00 H new ATOM 0 HG11 VAL A 3 3.778 7.768 4.899 1.00 0.00 H new ATOM 0 HG12 VAL A 3 2.941 8.405 3.463 1.00 0.00 H new ATOM 0 HG13 VAL A 3 2.128 7.223 4.516 1.00 0.00 H new ATOM 0 HG21 VAL A 3 4.615 5.445 4.928 1.00 0.00 H new ATOM 0 HG22 VAL A 3 2.999 4.804 4.546 1.00 0.00 H new ATOM 0 HG23 VAL A 3 4.388 4.389 3.513 1.00 0.00 H new ATOM 45 N GLU A 4 3.218 7.607 0.345 1.00 0.00 N ATOM 46 CA GLU A 4 3.021 8.789 -0.486 1.00 0.00 C ATOM 47 C GLU A 4 1.705 8.700 -1.254 1.00 0.00 C ATOM 48 O GLU A 4 0.975 9.685 -1.376 1.00 0.00 O ATOM 49 CB GLU A 4 4.185 8.952 -1.465 1.00 0.00 C ATOM 50 CG GLU A 4 5.443 9.515 -0.826 1.00 0.00 C ATOM 51 CD GLU A 4 6.520 8.464 -0.634 1.00 0.00 C ATOM 52 OE1 GLU A 4 7.711 8.838 -0.589 1.00 0.00 O ATOM 53 OE2 GLU A 4 6.172 7.270 -0.529 1.00 0.00 O ATOM 0 H GLU A 4 4.049 7.062 0.114 1.00 0.00 H new ATOM 0 HA GLU A 4 2.982 9.660 0.169 1.00 0.00 H new ATOM 0 HB2 GLU A 4 4.415 7.983 -1.908 1.00 0.00 H new ATOM 0 HB3 GLU A 4 3.876 9.609 -2.278 1.00 0.00 H new ATOM 0 HG2 GLU A 4 5.833 10.320 -1.448 1.00 0.00 H new ATOM 0 HG3 GLU A 4 5.191 9.952 0.140 1.00 0.00 H new ATOM 60 N THR A 5 1.407 7.512 -1.771 1.00 0.00 N ATOM 61 CA THR A 5 0.182 7.294 -2.529 1.00 0.00 C ATOM 62 C THR A 5 -1.048 7.448 -1.641 1.00 0.00 C ATOM 63 O THR A 5 -2.172 7.552 -2.134 1.00 0.00 O ATOM 64 CB THR A 5 0.162 5.895 -3.175 1.00 0.00 C ATOM 65 OG1 THR A 5 1.423 5.626 -3.798 1.00 0.00 O ATOM 66 CG2 THR A 5 -0.952 5.791 -4.205 1.00 0.00 C ATOM 0 H THR A 5 1.998 6.686 -1.678 1.00 0.00 H new ATOM 0 HA THR A 5 0.158 8.049 -3.314 1.00 0.00 H new ATOM 0 HB THR A 5 -0.020 5.159 -2.392 1.00 0.00 H new ATOM 0 HG1 THR A 5 1.659 4.684 -3.665 1.00 0.00 H new ATOM 0 HG21 THR A 5 -0.947 4.795 -4.648 1.00 0.00 H new ATOM 0 HG22 THR A 5 -1.913 5.968 -3.721 1.00 0.00 H new ATOM 0 HG23 THR A 5 -0.796 6.536 -4.986 1.00 0.00 H new ATOM 74 N ILE A 6 -0.828 7.464 -0.331 1.00 0.00 N ATOM 75 CA ILE A 6 -1.919 7.608 0.624 1.00 0.00 C ATOM 76 C ILE A 6 -2.270 9.076 0.842 1.00 0.00 C ATOM 77 O ILE A 6 -3.421 9.481 0.676 1.00 0.00 O ATOM 78 CB ILE A 6 -1.568 6.970 1.981 1.00 0.00 C ATOM 79 CG1 ILE A 6 -0.711 5.719 1.774 1.00 0.00 C ATOM 80 CG2 ILE A 6 -2.835 6.630 2.751 1.00 0.00 C ATOM 81 CD1 ILE A 6 -1.348 4.695 0.860 1.00 0.00 C ATOM 0 H ILE A 6 0.096 7.379 0.093 1.00 0.00 H new ATOM 0 HA ILE A 6 -2.779 7.090 0.199 1.00 0.00 H new ATOM 0 HB ILE A 6 -0.994 7.688 2.566 1.00 0.00 H new ATOM 0 HG12 ILE A 6 0.253 6.013 1.360 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -0.515 5.258 2.742 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -2.570 6.180 3.708 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -3.410 7.539 2.925 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -3.434 5.927 2.173 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -0.685 3.835 0.759 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -2.299 4.372 1.283 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -1.519 5.139 -0.121 1.00 0.00 H new ATOM 93 N ILE A 7 -1.270 9.869 1.211 1.00 0.00 N ATOM 94 CA ILE A 7 -1.472 11.293 1.447 1.00 0.00 C ATOM 95 C ILE A 7 -1.893 12.008 0.168 1.00 0.00 C ATOM 96 O ILE A 7 -2.722 12.917 0.198 1.00 0.00 O ATOM 97 CB ILE A 7 -0.197 11.959 1.998 1.00 0.00 C ATOM 98 CG1 ILE A 7 0.124 11.419 3.393 1.00 0.00 C ATOM 99 CG2 ILE A 7 -0.362 13.471 2.035 1.00 0.00 C ATOM 100 CD1 ILE A 7 -0.895 11.807 4.441 1.00 0.00 C ATOM 0 H ILE A 7 -0.312 9.550 1.353 1.00 0.00 H new ATOM 0 HA ILE A 7 -2.267 11.380 2.188 1.00 0.00 H new ATOM 0 HB ILE A 7 0.635 11.720 1.335 1.00 0.00 H new ATOM 0 HG12 ILE A 7 0.189 10.332 3.347 1.00 0.00 H new ATOM 0 HG13 ILE A 7 1.104 11.785 3.698 1.00 0.00 H new ATOM 0 HG21 ILE A 7 0.547 13.927 2.427 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -0.548 13.841 1.027 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -1.203 13.730 2.678 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -0.603 11.390 5.405 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -0.944 12.893 4.516 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -1.873 11.418 4.159 1.00 0.00 H new ATOM 112 N GLU A 8 -1.316 11.590 -0.955 1.00 0.00 N ATOM 113 CA GLU A 8 -1.633 12.191 -2.245 1.00 0.00 C ATOM 114 C GLU A 8 -3.142 12.314 -2.432 1.00 0.00 C ATOM 115 O GLU A 8 -3.644 13.357 -2.851 1.00 0.00 O ATOM 116 CB GLU A 8 -1.033 11.360 -3.381 1.00 0.00 C ATOM 117 CG GLU A 8 -0.532 12.195 -4.547 1.00 0.00 C ATOM 118 CD GLU A 8 -1.646 12.957 -5.240 1.00 0.00 C ATOM 119 OE1 GLU A 8 -2.631 12.314 -5.660 1.00 0.00 O ATOM 120 OE2 GLU A 8 -1.532 14.194 -5.362 1.00 0.00 O ATOM 0 H GLU A 8 -0.628 10.839 -0.997 1.00 0.00 H new ATOM 0 HA GLU A 8 -1.199 13.191 -2.268 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -0.207 10.767 -2.989 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -1.785 10.659 -3.744 1.00 0.00 H new ATOM 0 HG2 GLU A 8 0.217 12.901 -4.188 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -0.038 11.545 -5.269 1.00 0.00 H new ATOM 127 N ARG A 9 -3.860 11.240 -2.119 1.00 0.00 N ATOM 128 CA ARG A 9 -5.312 11.226 -2.254 1.00 0.00 C ATOM 129 C ARG A 9 -5.955 12.250 -1.324 1.00 0.00 C ATOM 130 O ARG A 9 -6.991 12.832 -1.646 1.00 0.00 O ATOM 131 CB ARG A 9 -5.860 9.830 -1.949 1.00 0.00 C ATOM 132 CG ARG A 9 -5.110 8.714 -2.657 1.00 0.00 C ATOM 133 CD ARG A 9 -6.060 7.646 -3.177 1.00 0.00 C ATOM 134 NE ARG A 9 -6.182 7.684 -4.632 1.00 0.00 N ATOM 135 CZ ARG A 9 -7.145 7.063 -5.304 1.00 0.00 C ATOM 136 NH1 ARG A 9 -8.064 6.361 -4.657 1.00 0.00 N ATOM 137 NH2 ARG A 9 -7.189 7.144 -6.628 1.00 0.00 N ATOM 0 H ARG A 9 -3.460 10.369 -1.770 1.00 0.00 H new ATOM 0 HA ARG A 9 -5.558 11.490 -3.282 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -5.818 9.659 -0.873 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -6.910 9.790 -2.237 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -4.538 9.128 -3.487 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -4.394 8.262 -1.970 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -5.704 6.663 -2.869 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -7.043 7.785 -2.727 1.00 0.00 H new ATOM 0 HE ARG A 9 -5.491 8.216 -5.161 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -8.033 6.296 -3.640 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -8.802 5.886 -5.176 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -6.483 7.683 -7.130 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -7.929 6.667 -7.144 1.00 0.00 H new ATOM 151 N ILE A 10 -5.333 12.465 -0.169 1.00 0.00 N ATOM 152 CA ILE A 10 -5.844 13.419 0.807 1.00 0.00 C ATOM 153 C ILE A 10 -5.712 14.851 0.298 1.00 0.00 C ATOM 154 O ILE A 10 -6.653 15.640 0.379 1.00 0.00 O ATOM 155 CB ILE A 10 -5.109 13.295 2.154 1.00 0.00 C ATOM 156 CG1 ILE A 10 -5.372 11.924 2.780 1.00 0.00 C ATOM 157 CG2 ILE A 10 -5.542 14.407 3.099 1.00 0.00 C ATOM 158 CD1 ILE A 10 -4.578 11.673 4.043 1.00 0.00 C ATOM 0 H ILE A 10 -4.475 11.991 0.113 1.00 0.00 H new ATOM 0 HA ILE A 10 -6.898 13.184 0.955 1.00 0.00 H new ATOM 0 HB ILE A 10 -4.038 13.393 1.976 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -6.435 11.834 3.005 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -5.134 11.149 2.051 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -5.013 14.305 4.047 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -5.307 15.374 2.655 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -6.616 14.339 3.273 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -4.815 10.682 4.431 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -3.513 11.730 3.820 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -4.833 12.426 4.789 1.00 0.00 H new ATOM 170 N LYS A 11 -4.537 15.179 -0.229 1.00 0.00 N ATOM 171 CA LYS A 11 -4.280 16.514 -0.755 1.00 0.00 C ATOM 172 C LYS A 11 -5.145 16.792 -1.981 1.00 0.00 C ATOM 173 O LYS A 11 -5.681 17.888 -2.139 1.00 0.00 O ATOM 174 CB LYS A 11 -2.801 16.667 -1.116 1.00 0.00 C ATOM 175 CG LYS A 11 -1.862 15.984 -0.136 1.00 0.00 C ATOM 176 CD LYS A 11 -0.428 16.452 -0.320 1.00 0.00 C ATOM 177 CE LYS A 11 0.453 15.343 -0.874 1.00 0.00 C ATOM 178 NZ LYS A 11 0.876 15.619 -2.275 1.00 0.00 N ATOM 0 H LYS A 11 -3.747 14.538 -0.303 1.00 0.00 H new ATOM 0 HA LYS A 11 -4.535 17.237 0.020 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -2.634 16.257 -2.112 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -2.555 17.728 -1.163 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -2.185 16.191 0.884 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -1.914 14.904 -0.273 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -0.407 17.307 -0.996 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -0.029 16.792 0.636 1.00 0.00 H new ATOM 0 HE2 LYS A 11 1.335 15.231 -0.244 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -0.087 14.397 -0.837 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 1.475 14.840 -2.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 0.035 15.701 -2.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 1.414 16.509 -2.306 1.00 0.00 H new ATOM 192 N ALA A 12 -5.277 15.790 -2.845 1.00 0.00 N ATOM 193 CA ALA A 12 -6.079 15.926 -4.054 1.00 0.00 C ATOM 194 C ALA A 12 -7.561 16.058 -3.718 1.00 0.00 C ATOM 195 O ALA A 12 -8.317 16.702 -4.446 1.00 0.00 O ATOM 196 CB ALA A 12 -5.849 14.737 -4.976 1.00 0.00 C ATOM 0 H ALA A 12 -4.839 14.876 -2.730 1.00 0.00 H new ATOM 0 HA ALA A 12 -5.767 16.836 -4.567 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -6.454 14.851 -5.875 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -4.795 14.689 -5.251 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -6.132 13.818 -4.463 1.00 0.00 H new ATOM 202 N ARG A 13 -7.969 15.445 -2.612 1.00 0.00 N ATOM 203 CA ARG A 13 -9.361 15.493 -2.181 1.00 0.00 C ATOM 204 C ARG A 13 -9.656 16.795 -1.441 1.00 0.00 C ATOM 205 O ARG A 13 -10.623 17.492 -1.751 1.00 0.00 O ATOM 206 CB ARG A 13 -9.680 14.299 -1.280 1.00 0.00 C ATOM 207 CG ARG A 13 -9.859 12.994 -2.040 1.00 0.00 C ATOM 208 CD ARG A 13 -11.330 12.663 -2.240 1.00 0.00 C ATOM 209 NE ARG A 13 -11.609 11.249 -2.006 1.00 0.00 N ATOM 210 CZ ARG A 13 -11.275 10.284 -2.855 1.00 0.00 C ATOM 211 NH1 ARG A 13 -10.653 10.579 -3.988 1.00 0.00 N ATOM 212 NH2 ARG A 13 -11.564 9.020 -2.571 1.00 0.00 N ATOM 0 H ARG A 13 -7.356 14.909 -1.998 1.00 0.00 H new ATOM 0 HA ARG A 13 -9.992 15.448 -3.069 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -8.877 14.179 -0.552 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -10.590 14.511 -0.719 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -9.366 13.066 -3.009 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -9.374 12.185 -1.495 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -11.933 13.268 -1.563 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -11.627 12.928 -3.255 1.00 0.00 H new ATOM 0 HE ARG A 13 -12.087 10.988 -1.143 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -10.430 11.549 -4.210 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -10.398 9.836 -4.638 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -12.043 8.790 -1.700 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -11.307 8.279 -3.223 1.00 0.00 H new ATOM 226 N VAL A 14 -8.817 17.116 -0.461 1.00 0.00 N ATOM 227 CA VAL A 14 -8.988 18.334 0.323 1.00 0.00 C ATOM 228 C VAL A 14 -9.129 19.554 -0.581 1.00 0.00 C ATOM 229 O VAL A 14 -9.976 20.415 -0.350 1.00 0.00 O ATOM 230 CB VAL A 14 -7.803 18.553 1.283 1.00 0.00 C ATOM 231 CG1 VAL A 14 -7.840 17.541 2.417 1.00 0.00 C ATOM 232 CG2 VAL A 14 -6.485 18.474 0.528 1.00 0.00 C ATOM 0 H VAL A 14 -8.013 16.550 -0.191 1.00 0.00 H new ATOM 0 HA VAL A 14 -9.901 18.211 0.906 1.00 0.00 H new ATOM 0 HB VAL A 14 -7.888 19.550 1.716 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -6.995 17.712 3.085 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -8.771 17.652 2.974 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -7.781 16.533 2.007 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -5.659 18.631 1.221 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -6.389 17.492 0.065 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -6.462 19.243 -0.244 1.00 0.00 H new ATOM 242 N GLY A 15 -8.292 19.620 -1.612 1.00 0.00 N ATOM 243 CA GLY A 15 -8.339 20.738 -2.536 1.00 0.00 C ATOM 244 C GLY A 15 -9.603 20.746 -3.372 1.00 0.00 C ATOM 245 O GLY A 15 -9.860 21.695 -4.112 1.00 0.00 O ATOM 0 H GLY A 15 -7.582 18.919 -1.824 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -8.271 21.671 -1.976 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -7.472 20.698 -3.195 1.00 0.00 H new ATOM 249 N ALA A 16 -10.394 19.684 -3.257 1.00 0.00 N ATOM 250 CA ALA A 16 -11.638 19.572 -4.008 1.00 0.00 C ATOM 251 C ALA A 16 -12.836 19.452 -3.073 1.00 0.00 C ATOM 252 O ALA A 16 -13.972 19.715 -3.466 1.00 0.00 O ATOM 253 CB ALA A 16 -11.580 18.378 -4.950 1.00 0.00 C ATOM 0 H ALA A 16 -10.195 18.889 -2.650 1.00 0.00 H new ATOM 0 HA ALA A 16 -11.760 20.481 -4.597 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -12.516 18.306 -5.505 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -10.753 18.505 -5.648 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -11.430 17.466 -4.372 1.00 0.00 H new ATOM 259 N VAL A 17 -12.575 19.052 -1.832 1.00 0.00 N ATOM 260 CA VAL A 17 -13.632 18.898 -0.840 1.00 0.00 C ATOM 261 C VAL A 17 -14.102 20.253 -0.323 1.00 0.00 C ATOM 262 O VAL A 17 -13.423 21.265 -0.497 1.00 0.00 O ATOM 263 CB VAL A 17 -13.163 18.040 0.351 1.00 0.00 C ATOM 264 CG1 VAL A 17 -12.349 18.878 1.324 1.00 0.00 C ATOM 265 CG2 VAL A 17 -14.355 17.403 1.049 1.00 0.00 C ATOM 0 H VAL A 17 -11.640 18.829 -1.490 1.00 0.00 H new ATOM 0 HA VAL A 17 -14.462 18.395 -1.336 1.00 0.00 H new ATOM 0 HB VAL A 17 -12.523 17.242 -0.026 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -12.026 18.256 2.159 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -11.475 19.282 0.813 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -12.962 19.698 1.699 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -14.006 16.800 1.888 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -15.022 18.183 1.415 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -14.892 16.768 0.345 1.00 0.00 H new ATOM 275 N ASP A 18 -15.267 20.264 0.314 1.00 0.00 N ATOM 276 CA ASP A 18 -15.829 21.495 0.859 1.00 0.00 C ATOM 277 C ASP A 18 -15.647 21.552 2.373 1.00 0.00 C ATOM 278 O ASP A 18 -15.444 20.535 3.037 1.00 0.00 O ATOM 279 CB ASP A 18 -17.313 21.603 0.507 1.00 0.00 C ATOM 280 CG ASP A 18 -17.594 22.721 -0.478 1.00 0.00 C ATOM 281 OD1 ASP A 18 -16.783 22.910 -1.409 1.00 0.00 O ATOM 282 OD2 ASP A 18 -18.626 23.406 -0.318 1.00 0.00 O ATOM 0 H ASP A 18 -15.841 19.435 0.466 1.00 0.00 H new ATOM 0 HA ASP A 18 -15.296 22.336 0.415 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -17.653 20.657 0.085 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -17.888 21.772 1.417 1.00 0.00 H new ATOM 287 N PRO A 19 -15.719 22.768 2.933 1.00 0.00 N ATOM 288 CA PRO A 19 -15.564 22.987 4.374 1.00 0.00 C ATOM 289 C PRO A 19 -16.743 22.442 5.173 1.00 0.00 C ATOM 290 O PRO A 19 -16.566 21.879 6.252 1.00 0.00 O ATOM 291 CB PRO A 19 -15.494 24.511 4.496 1.00 0.00 C ATOM 292 CG PRO A 19 -16.218 25.021 3.298 1.00 0.00 C ATOM 293 CD PRO A 19 -15.957 24.024 2.202 1.00 0.00 C ATOM 0 HA PRO A 19 -14.689 22.473 4.772 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -15.962 24.856 5.418 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -14.461 24.860 4.513 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -17.286 25.112 3.497 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -15.860 26.012 3.018 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -16.807 23.940 1.525 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -15.095 24.307 1.598 1.00 0.00 H new ATOM 301 N ASN A 20 -17.946 22.613 4.635 1.00 0.00 N ATOM 302 CA ASN A 20 -19.155 22.138 5.298 1.00 0.00 C ATOM 303 C ASN A 20 -19.259 20.618 5.216 1.00 0.00 C ATOM 304 O ASN A 20 -20.055 20.000 5.922 1.00 0.00 O ATOM 305 CB ASN A 20 -20.393 22.780 4.669 1.00 0.00 C ATOM 306 CG ASN A 20 -20.891 23.973 5.461 1.00 0.00 C ATOM 307 OD1 ASN A 20 -21.936 23.909 6.110 1.00 0.00 O ATOM 308 ND2 ASN A 20 -20.144 25.070 5.412 1.00 0.00 N ATOM 0 H ASN A 20 -18.110 23.077 3.742 1.00 0.00 H new ATOM 0 HA ASN A 20 -19.100 22.425 6.348 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -20.159 23.095 3.652 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -21.188 22.037 4.598 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -20.429 25.904 5.925 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -19.285 25.078 4.861 1.00 0.00 H new ATOM 315 N GLY A 21 -18.448 20.021 4.348 1.00 0.00 N ATOM 316 CA GLY A 21 -18.464 18.578 4.189 1.00 0.00 C ATOM 317 C GLY A 21 -18.377 17.848 5.515 1.00 0.00 C ATOM 318 O GLY A 21 -19.321 17.187 5.947 1.00 0.00 O ATOM 0 H GLY A 21 -17.780 20.510 3.752 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -19.378 18.282 3.674 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -17.630 18.276 3.556 1.00 0.00 H new ATOM 322 N PRO A 22 -17.219 17.963 6.183 1.00 0.00 N ATOM 323 CA PRO A 22 -16.985 17.314 7.476 1.00 0.00 C ATOM 324 C PRO A 22 -17.807 17.940 8.597 1.00 0.00 C ATOM 325 O PRO A 22 -18.558 18.889 8.372 1.00 0.00 O ATOM 326 CB PRO A 22 -15.490 17.538 7.720 1.00 0.00 C ATOM 327 CG PRO A 22 -15.159 18.762 6.938 1.00 0.00 C ATOM 328 CD PRO A 22 -16.051 18.735 5.728 1.00 0.00 C ATOM 0 HA PRO A 22 -17.276 16.264 7.463 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -15.278 17.676 8.780 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -14.902 16.683 7.386 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -15.331 19.661 7.530 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -14.108 18.767 6.648 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -16.331 19.740 5.413 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -15.561 18.260 4.878 1.00 0.00 H new ATOM 336 N ARG A 23 -17.659 17.404 9.804 1.00 0.00 N ATOM 337 CA ARG A 23 -18.389 17.911 10.960 1.00 0.00 C ATOM 338 C ARG A 23 -17.899 19.303 11.345 1.00 0.00 C ATOM 339 O ARG A 23 -16.831 19.739 10.913 1.00 0.00 O ATOM 340 CB ARG A 23 -18.234 16.957 12.146 1.00 0.00 C ATOM 341 CG ARG A 23 -19.151 15.747 12.079 1.00 0.00 C ATOM 342 CD ARG A 23 -20.321 15.881 13.040 1.00 0.00 C ATOM 343 NE ARG A 23 -20.973 14.598 13.291 1.00 0.00 N ATOM 344 CZ ARG A 23 -22.179 14.480 13.835 1.00 0.00 C ATOM 345 NH1 ARG A 23 -22.862 15.562 14.182 1.00 0.00 N ATOM 346 NH2 ARG A 23 -22.705 13.278 14.031 1.00 0.00 N ATOM 0 H ARG A 23 -17.040 16.619 10.007 1.00 0.00 H new ATOM 0 HA ARG A 23 -19.443 17.978 10.692 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -17.200 16.616 12.194 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -18.433 17.502 13.068 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -19.526 15.629 11.062 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -18.585 14.846 12.317 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -19.969 16.300 13.983 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -21.048 16.583 12.631 1.00 0.00 H new ATOM 0 HE ARG A 23 -20.475 13.746 13.034 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -22.462 16.488 14.031 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -23.788 15.469 14.600 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -22.183 12.443 13.764 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -23.631 13.189 14.449 1.00 0.00 H new ATOM 360 N LYS A 24 -18.686 19.998 12.160 1.00 0.00 N ATOM 361 CA LYS A 24 -18.333 21.341 12.605 1.00 0.00 C ATOM 362 C LYS A 24 -17.096 21.310 13.497 1.00 0.00 C ATOM 363 O LYS A 24 -17.203 21.215 14.720 1.00 0.00 O ATOM 364 CB LYS A 24 -19.504 21.975 13.359 1.00 0.00 C ATOM 365 CG LYS A 24 -20.047 21.106 14.480 1.00 0.00 C ATOM 366 CD LYS A 24 -20.350 21.925 15.723 1.00 0.00 C ATOM 367 CE LYS A 24 -21.808 22.357 15.764 1.00 0.00 C ATOM 368 NZ LYS A 24 -21.970 23.707 16.372 1.00 0.00 N ATOM 0 H LYS A 24 -19.573 19.653 12.526 1.00 0.00 H new ATOM 0 HA LYS A 24 -18.109 21.942 11.724 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -19.183 22.931 13.774 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -20.307 22.187 12.653 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -20.954 20.603 14.145 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -19.322 20.329 14.723 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -20.118 21.338 16.612 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -19.708 22.805 15.745 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -22.213 22.363 14.752 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -22.386 21.630 16.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -22.977 23.965 16.381 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -21.607 23.695 17.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -21.439 24.405 15.813 1.00 0.00 H new ATOM 382 N VAL A 25 -15.923 21.394 12.878 1.00 0.00 N ATOM 383 CA VAL A 25 -14.666 21.379 13.617 1.00 0.00 C ATOM 384 C VAL A 25 -13.583 22.155 12.875 1.00 0.00 C ATOM 385 O VAL A 25 -13.782 22.589 11.740 1.00 0.00 O ATOM 386 CB VAL A 25 -14.175 19.939 13.860 1.00 0.00 C ATOM 387 CG1 VAL A 25 -15.205 19.150 14.653 1.00 0.00 C ATOM 388 CG2 VAL A 25 -13.866 19.252 12.539 1.00 0.00 C ATOM 0 H VAL A 25 -15.817 21.473 11.867 1.00 0.00 H new ATOM 0 HA VAL A 25 -14.858 21.857 14.578 1.00 0.00 H new ATOM 0 HB VAL A 25 -13.256 19.981 14.445 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -14.841 18.136 14.815 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -15.371 19.634 15.616 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -16.142 19.115 14.098 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -13.520 18.236 12.729 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -14.767 19.220 11.926 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -13.089 19.807 12.013 1.00 0.00 H new ATOM 398 N LEU A 26 -12.436 22.326 13.524 1.00 0.00 N ATOM 399 CA LEU A 26 -11.320 23.049 12.926 1.00 0.00 C ATOM 400 C LEU A 26 -10.079 22.962 13.809 1.00 0.00 C ATOM 401 O LEU A 26 -10.099 23.375 14.967 1.00 0.00 O ATOM 402 CB LEU A 26 -11.698 24.514 12.701 1.00 0.00 C ATOM 403 CG LEU A 26 -11.694 25.407 13.943 1.00 0.00 C ATOM 404 CD1 LEU A 26 -12.063 26.835 13.574 1.00 0.00 C ATOM 405 CD2 LEU A 26 -12.649 24.861 14.994 1.00 0.00 C ATOM 0 H LEU A 26 -12.255 21.974 14.464 1.00 0.00 H new ATOM 0 HA LEU A 26 -11.093 22.587 11.965 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -11.009 24.938 11.971 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -12.693 24.548 12.257 1.00 0.00 H new ATOM 0 HG LEU A 26 -10.688 25.411 14.362 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -12.055 27.456 14.470 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -11.340 27.224 12.857 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -13.059 26.851 13.131 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -12.634 25.508 15.871 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -13.659 24.827 14.585 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -12.339 23.856 15.280 1.00 0.00 H new ATOM 417 N GLY A 27 -8.999 22.423 13.251 1.00 0.00 N ATOM 418 CA GLY A 27 -7.763 22.294 14.001 1.00 0.00 C ATOM 419 C GLY A 27 -6.685 21.567 13.222 1.00 0.00 C ATOM 420 O GLY A 27 -6.525 21.783 12.020 1.00 0.00 O ATOM 0 H GLY A 27 -8.958 22.074 12.294 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -7.403 23.286 14.275 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -7.959 21.758 14.930 1.00 0.00 H new ATOM 424 N VAL A 28 -5.942 20.703 13.907 1.00 0.00 N ATOM 425 CA VAL A 28 -4.873 19.942 13.271 1.00 0.00 C ATOM 426 C VAL A 28 -4.725 18.565 13.909 1.00 0.00 C ATOM 427 O VAL A 28 -4.910 18.405 15.115 1.00 0.00 O ATOM 428 CB VAL A 28 -3.526 20.685 13.360 1.00 0.00 C ATOM 429 CG1 VAL A 28 -2.541 20.127 12.345 1.00 0.00 C ATOM 430 CG2 VAL A 28 -3.728 22.178 13.156 1.00 0.00 C ATOM 0 H VAL A 28 -6.061 20.513 14.902 1.00 0.00 H new ATOM 0 HA VAL A 28 -5.147 19.826 12.222 1.00 0.00 H new ATOM 0 HB VAL A 28 -3.110 20.531 14.356 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -1.596 20.664 12.422 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -2.375 19.068 12.544 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -2.946 20.248 11.340 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -2.767 22.688 13.222 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -4.166 22.355 12.174 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -4.396 22.563 13.926 1.00 0.00 H new ATOM 440 N PHE A 29 -4.390 17.573 13.090 1.00 0.00 N ATOM 441 CA PHE A 29 -4.217 16.209 13.574 1.00 0.00 C ATOM 442 C PHE A 29 -2.839 15.670 13.201 1.00 0.00 C ATOM 443 O PHE A 29 -2.238 16.102 12.217 1.00 0.00 O ATOM 444 CB PHE A 29 -5.305 15.300 12.998 1.00 0.00 C ATOM 445 CG PHE A 29 -6.479 15.115 13.917 1.00 0.00 C ATOM 446 CD1 PHE A 29 -7.111 16.210 14.483 1.00 0.00 C ATOM 447 CD2 PHE A 29 -6.951 13.846 14.214 1.00 0.00 C ATOM 448 CE1 PHE A 29 -8.192 16.044 15.329 1.00 0.00 C ATOM 449 CE2 PHE A 29 -8.032 13.674 15.058 1.00 0.00 C ATOM 450 CZ PHE A 29 -8.652 14.774 15.617 1.00 0.00 C ATOM 0 H PHE A 29 -4.233 17.689 12.089 1.00 0.00 H new ATOM 0 HA PHE A 29 -4.301 16.222 14.661 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -5.655 15.718 12.054 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -4.872 14.325 12.774 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -6.755 17.205 14.261 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -6.469 12.982 13.781 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -8.676 16.906 15.764 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -8.391 12.680 15.280 1.00 0.00 H new ATOM 0 HZ PHE A 29 -9.495 14.641 16.278 1.00 0.00 H new ATOM 460 N GLN A 30 -2.345 14.725 13.994 1.00 0.00 N ATOM 461 CA GLN A 30 -1.038 14.128 13.748 1.00 0.00 C ATOM 462 C GLN A 30 -1.174 12.659 13.360 1.00 0.00 C ATOM 463 O GLN A 30 -1.423 11.802 14.209 1.00 0.00 O ATOM 464 CB GLN A 30 -0.152 14.260 14.988 1.00 0.00 C ATOM 465 CG GLN A 30 1.312 13.945 14.726 1.00 0.00 C ATOM 466 CD GLN A 30 1.830 14.593 13.457 1.00 0.00 C ATOM 467 OE1 GLN A 30 1.449 15.714 13.118 1.00 0.00 O ATOM 468 NE2 GLN A 30 2.704 13.889 12.747 1.00 0.00 N ATOM 0 H GLN A 30 -2.830 14.356 14.812 1.00 0.00 H new ATOM 0 HA GLN A 30 -0.573 14.662 12.919 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -0.233 15.276 15.376 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -0.526 13.592 15.764 1.00 0.00 H new ATOM 0 HG2 GLN A 30 1.910 14.283 15.572 1.00 0.00 H new ATOM 0 HG3 GLN A 30 1.441 12.865 14.657 1.00 0.00 H new ATOM 0 HE21 GLN A 30 2.992 12.964 13.065 1.00 0.00 H new ATOM 0 HE22 GLN A 30 3.087 14.274 11.883 1.00 0.00 H new ATOM 477 N LEU A 31 -1.010 12.375 12.073 1.00 0.00 N ATOM 478 CA LEU A 31 -1.115 11.009 11.571 1.00 0.00 C ATOM 479 C LEU A 31 0.245 10.319 11.582 1.00 0.00 C ATOM 480 O LEU A 31 1.278 10.958 11.389 1.00 0.00 O ATOM 481 CB LEU A 31 -1.689 11.009 10.153 1.00 0.00 C ATOM 482 CG LEU A 31 -3.169 11.370 10.028 1.00 0.00 C ATOM 483 CD1 LEU A 31 -3.442 12.050 8.696 1.00 0.00 C ATOM 484 CD2 LEU A 31 -4.036 10.128 10.182 1.00 0.00 C ATOM 0 H LEU A 31 -0.804 13.072 11.358 1.00 0.00 H new ATOM 0 HA LEU A 31 -1.787 10.457 12.228 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -1.112 11.710 9.549 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -1.539 10.019 9.722 1.00 0.00 H new ATOM 0 HG LEU A 31 -3.422 12.067 10.827 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -4.501 12.300 8.625 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -2.849 12.962 8.625 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -3.173 11.377 7.882 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -5.086 10.404 10.090 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -3.781 9.408 9.405 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -3.862 9.682 11.161 1.00 0.00 H new ATOM 496 N ASN A 32 0.236 9.009 11.807 1.00 0.00 N ATOM 497 CA ASN A 32 1.469 8.231 11.841 1.00 0.00 C ATOM 498 C ASN A 32 1.267 6.862 11.198 1.00 0.00 C ATOM 499 O ASN A 32 0.366 6.114 11.578 1.00 0.00 O ATOM 500 CB ASN A 32 1.951 8.063 13.283 1.00 0.00 C ATOM 501 CG ASN A 32 1.562 9.236 14.163 1.00 0.00 C ATOM 502 OD1 ASN A 32 1.866 10.387 13.852 1.00 0.00 O ATOM 503 ND2 ASN A 32 0.885 8.946 15.268 1.00 0.00 N ATOM 0 H ASN A 32 -0.611 8.464 11.968 1.00 0.00 H new ATOM 0 HA ASN A 32 2.226 8.772 11.272 1.00 0.00 H new ATOM 0 HB2 ASN A 32 1.533 7.146 13.699 1.00 0.00 H new ATOM 0 HB3 ASN A 32 3.035 7.951 13.290 1.00 0.00 H new ATOM 0 HD21 ASN A 32 0.595 9.693 15.899 1.00 0.00 H new ATOM 0 HD22 ASN A 32 0.655 7.976 15.485 1.00 0.00 H new ATOM 510 N ILE A 33 2.111 6.542 10.223 1.00 0.00 N ATOM 511 CA ILE A 33 2.026 5.263 9.529 1.00 0.00 C ATOM 512 C ILE A 33 2.980 4.242 10.139 1.00 0.00 C ATOM 513 O ILE A 33 4.198 4.349 9.994 1.00 0.00 O ATOM 514 CB ILE A 33 2.345 5.414 8.030 1.00 0.00 C ATOM 515 CG1 ILE A 33 1.854 6.769 7.516 1.00 0.00 C ATOM 516 CG2 ILE A 33 1.712 4.280 7.237 1.00 0.00 C ATOM 517 CD1 ILE A 33 0.364 6.973 7.677 1.00 0.00 C ATOM 0 H ILE A 33 2.861 7.151 9.896 1.00 0.00 H new ATOM 0 HA ILE A 33 1.000 4.911 9.641 1.00 0.00 H new ATOM 0 HB ILE A 33 3.426 5.366 7.897 1.00 0.00 H new ATOM 0 HG12 ILE A 33 2.380 7.562 8.047 1.00 0.00 H new ATOM 0 HG13 ILE A 33 2.114 6.864 6.462 1.00 0.00 H new ATOM 0 HG21 ILE A 33 1.946 4.401 6.179 1.00 0.00 H new ATOM 0 HG22 ILE A 33 2.105 3.326 7.589 1.00 0.00 H new ATOM 0 HG23 ILE A 33 0.631 4.300 7.374 1.00 0.00 H new ATOM 0 HD11 ILE A 33 0.087 7.954 7.291 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -0.171 6.202 7.123 1.00 0.00 H new ATOM 0 HD13 ILE A 33 0.100 6.910 8.733 1.00 0.00 H new ATOM 529 N LYS A 34 2.418 3.250 10.823 1.00 0.00 N ATOM 530 CA LYS A 34 3.217 2.207 11.453 1.00 0.00 C ATOM 531 C LYS A 34 3.850 1.297 10.405 1.00 0.00 C ATOM 532 O LYS A 34 3.150 0.615 9.655 1.00 0.00 O ATOM 533 CB LYS A 34 2.352 1.379 12.406 1.00 0.00 C ATOM 534 CG LYS A 34 2.579 1.704 13.872 1.00 0.00 C ATOM 535 CD LYS A 34 1.504 1.090 14.753 1.00 0.00 C ATOM 536 CE LYS A 34 2.089 0.069 15.717 1.00 0.00 C ATOM 537 NZ LYS A 34 1.108 -0.998 16.057 1.00 0.00 N ATOM 0 H LYS A 34 1.412 3.147 10.955 1.00 0.00 H new ATOM 0 HA LYS A 34 4.014 2.688 12.020 1.00 0.00 H new ATOM 0 HB2 LYS A 34 1.302 1.543 12.165 1.00 0.00 H new ATOM 0 HB3 LYS A 34 2.556 0.321 12.241 1.00 0.00 H new ATOM 0 HG2 LYS A 34 3.557 1.335 14.180 1.00 0.00 H new ATOM 0 HG3 LYS A 34 2.589 2.785 14.008 1.00 0.00 H new ATOM 0 HD2 LYS A 34 1.000 1.876 15.316 1.00 0.00 H new ATOM 0 HD3 LYS A 34 0.750 0.612 14.128 1.00 0.00 H new ATOM 0 HE2 LYS A 34 2.977 -0.382 15.274 1.00 0.00 H new ATOM 0 HE3 LYS A 34 2.409 0.572 16.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 1.545 -1.674 16.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 0.271 -0.571 16.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 0.822 -1.496 15.190 1.00 0.00 H new ATOM 551 N THR A 35 5.179 1.291 10.358 1.00 0.00 N ATOM 552 CA THR A 35 5.905 0.465 9.402 1.00 0.00 C ATOM 553 C THR A 35 7.057 -0.272 10.075 1.00 0.00 C ATOM 554 O THR A 35 7.547 0.149 11.123 1.00 0.00 O ATOM 555 CB THR A 35 6.461 1.309 8.239 1.00 0.00 C ATOM 556 OG1 THR A 35 7.459 0.567 7.529 1.00 0.00 O ATOM 557 CG2 THR A 35 7.058 2.611 8.752 1.00 0.00 C ATOM 0 H THR A 35 5.774 1.849 10.971 1.00 0.00 H new ATOM 0 HA THR A 35 5.194 -0.261 9.008 1.00 0.00 H new ATOM 0 HB THR A 35 5.638 1.546 7.565 1.00 0.00 H new ATOM 0 HG1 THR A 35 7.806 1.109 6.790 1.00 0.00 H new ATOM 0 HG21 THR A 35 7.444 3.190 7.913 1.00 0.00 H new ATOM 0 HG22 THR A 35 6.288 3.186 9.266 1.00 0.00 H new ATOM 0 HG23 THR A 35 7.870 2.391 9.445 1.00 0.00 H new ATOM 565 N ALA A 36 7.485 -1.373 9.467 1.00 0.00 N ATOM 566 CA ALA A 36 8.582 -2.167 10.007 1.00 0.00 C ATOM 567 C ALA A 36 9.879 -1.366 10.034 1.00 0.00 C ATOM 568 O ALA A 36 10.788 -1.663 10.809 1.00 0.00 O ATOM 569 CB ALA A 36 8.763 -3.440 9.194 1.00 0.00 C ATOM 0 H ALA A 36 7.089 -1.736 8.600 1.00 0.00 H new ATOM 0 HA ALA A 36 8.331 -2.437 11.033 1.00 0.00 H new ATOM 0 HB1 ALA A 36 9.585 -4.023 9.609 1.00 0.00 H new ATOM 0 HB2 ALA A 36 7.846 -4.029 9.231 1.00 0.00 H new ATOM 0 HB3 ALA A 36 8.987 -3.182 8.159 1.00 0.00 H new ATOM 575 N SER A 37 9.958 -0.348 9.183 1.00 0.00 N ATOM 576 CA SER A 37 11.146 0.494 9.106 1.00 0.00 C ATOM 577 C SER A 37 11.074 1.629 10.124 1.00 0.00 C ATOM 578 O SER A 37 12.073 2.291 10.403 1.00 0.00 O ATOM 579 CB SER A 37 11.300 1.067 7.697 1.00 0.00 C ATOM 580 OG SER A 37 11.351 0.034 6.728 1.00 0.00 O ATOM 0 H SER A 37 9.213 -0.086 8.537 1.00 0.00 H new ATOM 0 HA SER A 37 12.014 -0.123 9.336 1.00 0.00 H new ATOM 0 HB2 SER A 37 10.465 1.733 7.479 1.00 0.00 H new ATOM 0 HB3 SER A 37 12.209 1.666 7.642 1.00 0.00 H new ATOM 0 HG SER A 37 11.448 0.427 5.836 1.00 0.00 H new ATOM 586 N GLY A 38 9.884 1.846 10.676 1.00 0.00 N ATOM 587 CA GLY A 38 9.703 2.901 11.656 1.00 0.00 C ATOM 588 C GLY A 38 8.278 3.415 11.698 1.00 0.00 C ATOM 589 O GLY A 38 7.332 2.636 11.823 1.00 0.00 O ATOM 0 H GLY A 38 9.043 1.310 10.462 1.00 0.00 H new ATOM 0 HA2 GLY A 38 9.981 2.528 12.642 1.00 0.00 H new ATOM 0 HA3 GLY A 38 10.377 3.726 11.426 1.00 0.00 H new ATOM 593 N VAL A 39 8.121 4.731 11.594 1.00 0.00 N ATOM 594 CA VAL A 39 6.801 5.348 11.621 1.00 0.00 C ATOM 595 C VAL A 39 6.793 6.663 10.850 1.00 0.00 C ATOM 596 O VAL A 39 7.483 7.613 11.218 1.00 0.00 O ATOM 597 CB VAL A 39 6.333 5.610 13.065 1.00 0.00 C ATOM 598 CG1 VAL A 39 5.172 6.593 13.081 1.00 0.00 C ATOM 599 CG2 VAL A 39 5.948 4.305 13.745 1.00 0.00 C ATOM 0 H VAL A 39 8.892 5.390 11.490 1.00 0.00 H new ATOM 0 HA VAL A 39 6.115 4.647 11.146 1.00 0.00 H new ATOM 0 HB VAL A 39 7.159 6.053 13.621 1.00 0.00 H new ATOM 0 HG11 VAL A 39 4.855 6.765 14.110 1.00 0.00 H new ATOM 0 HG12 VAL A 39 5.488 7.536 12.636 1.00 0.00 H new ATOM 0 HG13 VAL A 39 4.340 6.182 12.509 1.00 0.00 H new ATOM 0 HG21 VAL A 39 5.620 4.509 14.764 1.00 0.00 H new ATOM 0 HG22 VAL A 39 5.138 3.831 13.191 1.00 0.00 H new ATOM 0 HG23 VAL A 39 6.810 3.638 13.768 1.00 0.00 H new ATOM 609 N GLU A 40 6.008 6.710 9.778 1.00 0.00 N ATOM 610 CA GLU A 40 5.911 7.909 8.954 1.00 0.00 C ATOM 611 C GLU A 40 4.901 8.891 9.541 1.00 0.00 C ATOM 612 O GLU A 40 3.698 8.634 9.540 1.00 0.00 O ATOM 613 CB GLU A 40 5.510 7.541 7.524 1.00 0.00 C ATOM 614 CG GLU A 40 6.692 7.225 6.623 1.00 0.00 C ATOM 615 CD GLU A 40 6.368 7.403 5.152 1.00 0.00 C ATOM 616 OE1 GLU A 40 6.563 6.440 4.382 1.00 0.00 O ATOM 617 OE2 GLU A 40 5.921 8.505 4.772 1.00 0.00 O ATOM 0 H GLU A 40 5.430 5.932 9.460 1.00 0.00 H new ATOM 0 HA GLU A 40 6.890 8.388 8.937 1.00 0.00 H new ATOM 0 HB2 GLU A 40 4.845 6.678 7.553 1.00 0.00 H new ATOM 0 HB3 GLU A 40 4.944 8.365 7.091 1.00 0.00 H new ATOM 0 HG2 GLU A 40 7.529 7.871 6.888 1.00 0.00 H new ATOM 0 HG3 GLU A 40 7.014 6.199 6.799 1.00 0.00 H new ATOM 624 N GLN A 41 5.401 10.017 10.040 1.00 0.00 N ATOM 625 CA GLN A 41 4.543 11.038 10.631 1.00 0.00 C ATOM 626 C GLN A 41 4.022 11.995 9.564 1.00 0.00 C ATOM 627 O GLN A 41 4.708 12.277 8.581 1.00 0.00 O ATOM 628 CB GLN A 41 5.306 11.817 11.703 1.00 0.00 C ATOM 629 CG GLN A 41 5.926 10.932 12.773 1.00 0.00 C ATOM 630 CD GLN A 41 5.327 11.168 14.145 1.00 0.00 C ATOM 631 OE1 GLN A 41 5.550 12.210 14.762 1.00 0.00 O ATOM 632 NE2 GLN A 41 4.560 10.199 14.631 1.00 0.00 N ATOM 0 H GLN A 41 6.395 10.245 10.047 1.00 0.00 H new ATOM 0 HA GLN A 41 3.691 10.539 11.092 1.00 0.00 H new ATOM 0 HB2 GLN A 41 6.093 12.401 11.225 1.00 0.00 H new ATOM 0 HB3 GLN A 41 4.627 12.525 12.178 1.00 0.00 H new ATOM 0 HG2 GLN A 41 5.791 9.886 12.497 1.00 0.00 H new ATOM 0 HG3 GLN A 41 7.000 11.115 12.813 1.00 0.00 H new ATOM 0 HE21 GLN A 41 4.402 9.352 14.086 1.00 0.00 H new ATOM 0 HE22 GLN A 41 4.129 10.302 15.550 1.00 0.00 H new ATOM 641 N TRP A 42 2.806 12.490 9.764 1.00 0.00 N ATOM 642 CA TRP A 42 2.193 13.416 8.818 1.00 0.00 C ATOM 643 C TRP A 42 1.327 14.440 9.542 1.00 0.00 C ATOM 644 O TRP A 42 0.727 14.139 10.575 1.00 0.00 O ATOM 645 CB TRP A 42 1.352 12.650 7.795 1.00 0.00 C ATOM 646 CG TRP A 42 2.168 12.026 6.703 1.00 0.00 C ATOM 647 CD1 TRP A 42 2.596 10.731 6.638 1.00 0.00 C ATOM 648 CD2 TRP A 42 2.654 12.672 5.521 1.00 0.00 C ATOM 649 NE1 TRP A 42 3.320 10.533 5.486 1.00 0.00 N ATOM 650 CE2 TRP A 42 3.369 11.708 4.784 1.00 0.00 C ATOM 651 CE3 TRP A 42 2.553 13.970 5.013 1.00 0.00 C ATOM 652 CZ2 TRP A 42 3.979 12.003 3.568 1.00 0.00 C ATOM 653 CZ3 TRP A 42 3.160 14.262 3.806 1.00 0.00 C ATOM 654 CH2 TRP A 42 3.865 13.282 3.094 1.00 0.00 C ATOM 0 H TRP A 42 2.225 12.266 10.572 1.00 0.00 H new ATOM 0 HA TRP A 42 2.991 13.946 8.298 1.00 0.00 H new ATOM 0 HB2 TRP A 42 0.789 11.871 8.309 1.00 0.00 H new ATOM 0 HB3 TRP A 42 0.624 13.330 7.352 1.00 0.00 H new ATOM 0 HD1 TRP A 42 2.395 9.974 7.382 1.00 0.00 H new ATOM 0 HE1 TRP A 42 3.751 9.654 5.200 1.00 0.00 H new ATOM 0 HE3 TRP A 42 2.010 14.731 5.554 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 4.523 11.249 3.018 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 3.090 15.262 3.405 1.00 0.00 H new ATOM 0 HH2 TRP A 42 4.327 13.541 2.153 1.00 0.00 H new ATOM 665 N ILE A 43 1.265 15.649 8.995 1.00 0.00 N ATOM 666 CA ILE A 43 0.470 16.716 9.590 1.00 0.00 C ATOM 667 C ILE A 43 -0.727 17.065 8.711 1.00 0.00 C ATOM 668 O ILE A 43 -0.589 17.254 7.502 1.00 0.00 O ATOM 669 CB ILE A 43 1.312 17.985 9.819 1.00 0.00 C ATOM 670 CG1 ILE A 43 2.514 17.671 10.713 1.00 0.00 C ATOM 671 CG2 ILE A 43 0.459 19.083 10.436 1.00 0.00 C ATOM 672 CD1 ILE A 43 3.790 18.351 10.269 1.00 0.00 C ATOM 0 H ILE A 43 1.756 15.914 8.141 1.00 0.00 H new ATOM 0 HA ILE A 43 0.116 16.347 10.552 1.00 0.00 H new ATOM 0 HB ILE A 43 1.681 18.337 8.856 1.00 0.00 H new ATOM 0 HG12 ILE A 43 2.286 17.975 11.735 1.00 0.00 H new ATOM 0 HG13 ILE A 43 2.673 16.593 10.729 1.00 0.00 H new ATOM 0 HG21 ILE A 43 1.069 19.973 10.592 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -0.367 19.322 9.766 1.00 0.00 H new ATOM 0 HG23 ILE A 43 0.064 18.742 11.393 1.00 0.00 H new ATOM 0 HD11 ILE A 43 4.600 18.084 10.948 1.00 0.00 H new ATOM 0 HD12 ILE A 43 4.042 18.028 9.259 1.00 0.00 H new ATOM 0 HD13 ILE A 43 3.649 19.432 10.280 1.00 0.00 H new ATOM 684 N VAL A 44 -1.901 17.152 9.327 1.00 0.00 N ATOM 685 CA VAL A 44 -3.122 17.482 8.602 1.00 0.00 C ATOM 686 C VAL A 44 -3.922 18.555 9.331 1.00 0.00 C ATOM 687 O VAL A 44 -4.067 18.513 10.553 1.00 0.00 O ATOM 688 CB VAL A 44 -4.012 16.239 8.405 1.00 0.00 C ATOM 689 CG1 VAL A 44 -4.850 15.980 9.648 1.00 0.00 C ATOM 690 CG2 VAL A 44 -4.897 16.407 7.180 1.00 0.00 C ATOM 0 H VAL A 44 -2.033 16.999 10.327 1.00 0.00 H new ATOM 0 HA VAL A 44 -2.817 17.860 7.626 1.00 0.00 H new ATOM 0 HB VAL A 44 -3.369 15.374 8.244 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -5.472 15.099 9.490 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -4.193 15.813 10.501 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -5.486 16.843 9.844 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -5.519 15.520 7.056 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -5.534 17.282 7.309 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -4.273 16.539 6.296 1.00 0.00 H new ATOM 700 N ASP A 45 -4.439 19.516 8.574 1.00 0.00 N ATOM 701 CA ASP A 45 -5.227 20.601 9.149 1.00 0.00 C ATOM 702 C ASP A 45 -6.696 20.472 8.759 1.00 0.00 C ATOM 703 O ASP A 45 -7.020 20.154 7.614 1.00 0.00 O ATOM 704 CB ASP A 45 -4.681 21.954 8.689 1.00 0.00 C ATOM 705 CG ASP A 45 -4.926 23.053 9.705 1.00 0.00 C ATOM 706 OD1 ASP A 45 -6.106 23.370 9.963 1.00 0.00 O ATOM 707 OD2 ASP A 45 -3.937 23.594 10.242 1.00 0.00 O ATOM 0 H ASP A 45 -4.327 19.566 7.561 1.00 0.00 H new ATOM 0 HA ASP A 45 -5.152 20.537 10.234 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -3.610 21.867 8.504 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -5.147 22.228 7.742 1.00 0.00 H new ATOM 712 N LEU A 46 -7.581 20.720 9.718 1.00 0.00 N ATOM 713 CA LEU A 46 -9.017 20.630 9.476 1.00 0.00 C ATOM 714 C LEU A 46 -9.574 21.969 9.004 1.00 0.00 C ATOM 715 O LEU A 46 -10.349 22.030 8.050 1.00 0.00 O ATOM 716 CB LEU A 46 -9.741 20.183 10.746 1.00 0.00 C ATOM 717 CG LEU A 46 -8.900 19.409 11.762 1.00 0.00 C ATOM 718 CD1 LEU A 46 -9.722 19.083 12.999 1.00 0.00 C ATOM 719 CD2 LEU A 46 -8.346 18.137 11.137 1.00 0.00 C ATOM 0 H LEU A 46 -7.330 20.985 10.670 1.00 0.00 H new ATOM 0 HA LEU A 46 -9.183 19.891 8.692 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -10.147 21.066 11.239 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -10.588 19.561 10.457 1.00 0.00 H new ATOM 0 HG LEU A 46 -8.062 20.037 12.064 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -9.106 18.532 13.710 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -10.069 20.008 13.460 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -10.581 18.475 12.715 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -7.750 17.599 11.874 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -9.170 17.505 10.806 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -7.720 18.394 10.283 1.00 0.00 H new ATOM 731 N LYS A 47 -9.172 23.042 9.677 1.00 0.00 N ATOM 732 CA LYS A 47 -9.627 24.382 9.326 1.00 0.00 C ATOM 733 C LYS A 47 -9.590 24.590 7.815 1.00 0.00 C ATOM 734 O LYS A 47 -10.628 24.774 7.180 1.00 0.00 O ATOM 735 CB LYS A 47 -8.759 25.435 10.018 1.00 0.00 C ATOM 736 CG LYS A 47 -8.471 25.124 11.477 1.00 0.00 C ATOM 737 CD LYS A 47 -8.730 26.329 12.366 1.00 0.00 C ATOM 738 CE LYS A 47 -8.249 26.085 13.788 1.00 0.00 C ATOM 739 NZ LYS A 47 -8.580 27.225 14.688 1.00 0.00 N ATOM 0 H LYS A 47 -8.531 23.009 10.470 1.00 0.00 H new ATOM 0 HA LYS A 47 -10.657 24.490 9.665 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -7.815 25.525 9.481 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -9.256 26.403 9.953 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -9.094 24.290 11.802 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -7.433 24.808 11.585 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -8.224 27.202 11.954 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -9.797 26.554 12.375 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -8.704 25.173 14.174 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -7.171 25.926 13.785 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -8.236 27.021 15.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -8.125 28.090 14.334 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -9.611 27.361 14.711 1.00 0.00 H new ATOM 753 N GLN A 48 -8.389 24.559 7.247 1.00 0.00 N ATOM 754 CA GLN A 48 -8.219 24.744 5.811 1.00 0.00 C ATOM 755 C GLN A 48 -7.991 23.407 5.113 1.00 0.00 C ATOM 756 O GLN A 48 -8.203 22.344 5.700 1.00 0.00 O ATOM 757 CB GLN A 48 -7.046 25.685 5.532 1.00 0.00 C ATOM 758 CG GLN A 48 -7.116 26.991 6.306 1.00 0.00 C ATOM 759 CD GLN A 48 -7.283 28.197 5.402 1.00 0.00 C ATOM 760 OE1 GLN A 48 -6.316 28.689 4.820 1.00 0.00 O ATOM 761 NE2 GLN A 48 -8.514 28.680 5.281 1.00 0.00 N ATOM 0 H GLN A 48 -7.520 24.408 7.759 1.00 0.00 H new ATOM 0 HA GLN A 48 -9.133 25.188 5.417 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -6.115 25.175 5.780 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -7.014 25.906 4.465 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -7.949 26.949 7.007 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -6.208 27.108 6.897 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -9.286 28.240 5.782 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -8.688 29.491 4.687 1.00 0.00 H new ATOM 770 N LEU A 49 -7.559 23.466 3.859 1.00 0.00 N ATOM 771 CA LEU A 49 -7.302 22.259 3.080 1.00 0.00 C ATOM 772 C LEU A 49 -5.834 22.177 2.672 1.00 0.00 C ATOM 773 O LEU A 49 -5.488 22.393 1.511 1.00 0.00 O ATOM 774 CB LEU A 49 -8.191 22.233 1.836 1.00 0.00 C ATOM 775 CG LEU A 49 -9.687 22.031 2.084 1.00 0.00 C ATOM 776 CD1 LEU A 49 -9.943 20.674 2.722 1.00 0.00 C ATOM 777 CD2 LEU A 49 -10.238 23.147 2.959 1.00 0.00 C ATOM 0 H LEU A 49 -7.379 24.337 3.359 1.00 0.00 H new ATOM 0 HA LEU A 49 -7.535 21.396 3.704 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -8.056 23.171 1.298 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -7.841 21.436 1.180 1.00 0.00 H new ATOM 0 HG LEU A 49 -10.203 22.062 1.124 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -11.012 20.547 2.891 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -9.585 19.887 2.059 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -9.415 20.614 3.674 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -11.303 22.987 3.125 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -9.718 23.149 3.917 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -10.088 24.106 2.463 1.00 0.00 H new ATOM 789 N LYS A 50 -4.975 21.859 3.635 1.00 0.00 N ATOM 790 CA LYS A 50 -3.545 21.744 3.376 1.00 0.00 C ATOM 791 C LYS A 50 -2.990 20.448 3.959 1.00 0.00 C ATOM 792 O LYS A 50 -3.649 19.782 4.757 1.00 0.00 O ATOM 793 CB LYS A 50 -2.800 22.942 3.969 1.00 0.00 C ATOM 794 CG LYS A 50 -2.874 23.014 5.485 1.00 0.00 C ATOM 795 CD LYS A 50 -1.660 22.370 6.134 1.00 0.00 C ATOM 796 CE LYS A 50 -0.774 23.405 6.809 1.00 0.00 C ATOM 797 NZ LYS A 50 -1.514 24.180 7.843 1.00 0.00 N ATOM 0 H LYS A 50 -5.245 21.676 4.602 1.00 0.00 H new ATOM 0 HA LYS A 50 -3.396 21.730 2.296 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -1.754 22.895 3.666 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -3.212 23.860 3.549 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -2.945 24.056 5.798 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -3.780 22.515 5.830 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -1.986 21.634 6.869 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -1.085 21.833 5.380 1.00 0.00 H new ATOM 0 HE2 LYS A 50 0.079 22.907 7.270 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -0.377 24.088 6.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -0.859 24.461 8.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -1.928 25.030 7.410 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -2.272 23.591 8.242 1.00 0.00 H new ATOM 811 N VAL A 51 -1.773 20.096 3.555 1.00 0.00 N ATOM 812 CA VAL A 51 -1.128 18.881 4.039 1.00 0.00 C ATOM 813 C VAL A 51 0.376 19.078 4.185 1.00 0.00 C ATOM 814 O VAL A 51 1.028 19.637 3.302 1.00 0.00 O ATOM 815 CB VAL A 51 -1.390 17.693 3.095 1.00 0.00 C ATOM 816 CG1 VAL A 51 -0.592 16.475 3.535 1.00 0.00 C ATOM 817 CG2 VAL A 51 -2.877 17.375 3.040 1.00 0.00 C ATOM 0 H VAL A 51 -1.214 20.635 2.894 1.00 0.00 H new ATOM 0 HA VAL A 51 -1.559 18.661 5.016 1.00 0.00 H new ATOM 0 HB VAL A 51 -1.063 17.969 2.092 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -0.790 15.646 2.856 1.00 0.00 H new ATOM 0 HG12 VAL A 51 0.472 16.712 3.518 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -0.885 16.194 4.546 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -3.044 16.533 2.368 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -3.231 17.119 4.038 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -3.422 18.245 2.674 1.00 0.00 H new ATOM 827 N ASP A 52 0.922 18.616 5.304 1.00 0.00 N ATOM 828 CA ASP A 52 2.352 18.739 5.565 1.00 0.00 C ATOM 829 C ASP A 52 2.922 17.429 6.100 1.00 0.00 C ATOM 830 O ASP A 52 2.197 16.613 6.669 1.00 0.00 O ATOM 831 CB ASP A 52 2.614 19.868 6.563 1.00 0.00 C ATOM 832 CG ASP A 52 1.511 20.909 6.563 1.00 0.00 C ATOM 833 OD1 ASP A 52 0.440 20.639 7.147 1.00 0.00 O ATOM 834 OD2 ASP A 52 1.719 21.993 5.979 1.00 0.00 O ATOM 0 H ASP A 52 0.396 18.153 6.045 1.00 0.00 H new ATOM 0 HA ASP A 52 2.849 18.973 4.624 1.00 0.00 H new ATOM 0 HB2 ASP A 52 2.713 19.448 7.564 1.00 0.00 H new ATOM 0 HB3 ASP A 52 3.563 20.348 6.323 1.00 0.00 H new ATOM 839 N GLN A 53 4.223 17.235 5.912 1.00 0.00 N ATOM 840 CA GLN A 53 4.889 16.023 6.373 1.00 0.00 C ATOM 841 C GLN A 53 5.699 16.295 7.637 1.00 0.00 C ATOM 842 O GLN A 53 6.336 17.339 7.765 1.00 0.00 O ATOM 843 CB GLN A 53 5.801 15.468 5.278 1.00 0.00 C ATOM 844 CG GLN A 53 6.053 13.974 5.395 1.00 0.00 C ATOM 845 CD GLN A 53 6.757 13.403 4.180 1.00 0.00 C ATOM 846 OE1 GLN A 53 6.732 13.993 3.100 1.00 0.00 O ATOM 847 NE2 GLN A 53 7.392 12.249 4.351 1.00 0.00 N ATOM 0 H GLN A 53 4.837 17.902 5.444 1.00 0.00 H new ATOM 0 HA GLN A 53 4.123 15.284 6.606 1.00 0.00 H new ATOM 0 HB2 GLN A 53 5.356 15.678 4.305 1.00 0.00 H new ATOM 0 HB3 GLN A 53 6.756 15.993 5.312 1.00 0.00 H new ATOM 0 HG2 GLN A 53 6.654 13.779 6.283 1.00 0.00 H new ATOM 0 HG3 GLN A 53 5.102 13.459 5.535 1.00 0.00 H new ATOM 0 HE21 GLN A 53 7.387 11.794 5.264 1.00 0.00 H new ATOM 0 HE22 GLN A 53 7.885 11.817 3.569 1.00 0.00 H new ATOM 856 N GLY A 54 5.669 15.346 8.568 1.00 0.00 N ATOM 857 CA GLY A 54 6.404 15.503 9.810 1.00 0.00 C ATOM 858 C GLY A 54 5.496 15.517 11.023 1.00 0.00 C ATOM 859 O GLY A 54 4.358 15.053 10.962 1.00 0.00 O ATOM 0 H GLY A 54 5.149 14.472 8.485 1.00 0.00 H new ATOM 0 HA2 GLY A 54 7.124 14.690 9.908 1.00 0.00 H new ATOM 0 HA3 GLY A 54 6.974 16.431 9.776 1.00 0.00 H new ATOM 863 N VAL A 55 6.001 16.050 12.132 1.00 0.00 N ATOM 864 CA VAL A 55 5.227 16.122 13.366 1.00 0.00 C ATOM 865 C VAL A 55 4.920 17.569 13.738 1.00 0.00 C ATOM 866 O VAL A 55 5.826 18.356 14.013 1.00 0.00 O ATOM 867 CB VAL A 55 5.971 15.450 14.535 1.00 0.00 C ATOM 868 CG1 VAL A 55 7.348 16.070 14.718 1.00 0.00 C ATOM 869 CG2 VAL A 55 5.156 15.554 15.815 1.00 0.00 C ATOM 0 H VAL A 55 6.942 16.438 12.201 1.00 0.00 H new ATOM 0 HA VAL A 55 4.293 15.590 13.186 1.00 0.00 H new ATOM 0 HB VAL A 55 6.103 14.394 14.300 1.00 0.00 H new ATOM 0 HG11 VAL A 55 7.859 15.583 15.548 1.00 0.00 H new ATOM 0 HG12 VAL A 55 7.930 15.938 13.806 1.00 0.00 H new ATOM 0 HG13 VAL A 55 7.243 17.134 14.931 1.00 0.00 H new ATOM 0 HG21 VAL A 55 5.697 15.074 16.631 1.00 0.00 H new ATOM 0 HG22 VAL A 55 4.991 16.604 16.057 1.00 0.00 H new ATOM 0 HG23 VAL A 55 4.195 15.059 15.676 1.00 0.00 H new ATOM 879 N PHE A 56 3.636 17.912 13.745 1.00 0.00 N ATOM 880 CA PHE A 56 3.209 19.264 14.084 1.00 0.00 C ATOM 881 C PHE A 56 3.790 19.699 15.426 1.00 0.00 C ATOM 882 O PHE A 56 3.953 18.886 16.336 1.00 0.00 O ATOM 883 CB PHE A 56 1.681 19.343 14.127 1.00 0.00 C ATOM 884 CG PHE A 56 1.147 20.732 13.920 1.00 0.00 C ATOM 885 CD1 PHE A 56 0.221 21.270 14.799 1.00 0.00 C ATOM 886 CD2 PHE A 56 1.569 21.498 12.846 1.00 0.00 C ATOM 887 CE1 PHE A 56 -0.273 22.547 14.612 1.00 0.00 C ATOM 888 CE2 PHE A 56 1.080 22.776 12.654 1.00 0.00 C ATOM 889 CZ PHE A 56 0.157 23.301 13.538 1.00 0.00 C ATOM 0 H PHE A 56 2.874 17.273 13.520 1.00 0.00 H new ATOM 0 HA PHE A 56 3.580 19.939 13.313 1.00 0.00 H new ATOM 0 HB2 PHE A 56 1.269 18.686 13.361 1.00 0.00 H new ATOM 0 HB3 PHE A 56 1.333 18.968 15.089 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -0.119 20.684 15.640 1.00 0.00 H new ATOM 0 HD2 PHE A 56 2.289 21.092 12.151 1.00 0.00 H new ATOM 0 HE1 PHE A 56 -0.994 22.955 15.305 1.00 0.00 H new ATOM 0 HE2 PHE A 56 1.419 23.364 11.814 1.00 0.00 H new ATOM 0 HZ PHE A 56 -0.227 24.299 13.389 1.00 0.00 H new ATOM 899 N ALA A 57 4.100 20.986 15.541 1.00 0.00 N ATOM 900 CA ALA A 57 4.661 21.530 16.771 1.00 0.00 C ATOM 901 C ALA A 57 3.743 21.261 17.959 1.00 0.00 C ATOM 902 O ALA A 57 4.199 21.160 19.098 1.00 0.00 O ATOM 903 CB ALA A 57 4.911 23.023 16.623 1.00 0.00 C ATOM 0 H ALA A 57 3.972 21.672 14.797 1.00 0.00 H new ATOM 0 HA ALA A 57 5.612 21.031 16.959 1.00 0.00 H new ATOM 0 HB1 ALA A 57 5.330 23.415 17.550 1.00 0.00 H new ATOM 0 HB2 ALA A 57 5.612 23.195 15.806 1.00 0.00 H new ATOM 0 HB3 ALA A 57 3.970 23.530 16.407 1.00 0.00 H new ATOM 909 N SER A 58 2.447 21.146 17.686 1.00 0.00 N ATOM 910 CA SER A 58 1.465 20.894 18.733 1.00 0.00 C ATOM 911 C SER A 58 0.101 20.569 18.131 1.00 0.00 C ATOM 912 O SER A 58 -0.805 21.402 18.097 1.00 0.00 O ATOM 913 CB SER A 58 1.351 22.107 19.658 1.00 0.00 C ATOM 914 OG SER A 58 0.798 21.742 20.911 1.00 0.00 O ATOM 0 H SER A 58 2.053 21.223 16.748 1.00 0.00 H new ATOM 0 HA SER A 58 1.801 20.035 19.313 1.00 0.00 H new ATOM 0 HB2 SER A 58 2.336 22.549 19.807 1.00 0.00 H new ATOM 0 HB3 SER A 58 0.727 22.868 19.189 1.00 0.00 H new ATOM 0 HG SER A 58 0.737 22.534 21.485 1.00 0.00 H new ATOM 920 N PRO A 59 -0.050 19.329 17.644 1.00 0.00 N ATOM 921 CA PRO A 59 -1.300 18.864 17.034 1.00 0.00 C ATOM 922 C PRO A 59 -2.419 18.704 18.057 1.00 0.00 C ATOM 923 O PRO A 59 -2.164 18.548 19.252 1.00 0.00 O ATOM 924 CB PRO A 59 -0.921 17.506 16.439 1.00 0.00 C ATOM 925 CG PRO A 59 0.235 17.043 17.258 1.00 0.00 C ATOM 926 CD PRO A 59 0.987 18.284 17.650 1.00 0.00 C ATOM 0 HA PRO A 59 -1.684 19.573 16.301 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -1.752 16.803 16.495 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -0.650 17.596 15.387 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -0.104 16.498 18.139 1.00 0.00 H new ATOM 0 HG3 PRO A 59 0.870 16.365 16.688 1.00 0.00 H new ATOM 0 HD2 PRO A 59 1.448 18.181 18.633 1.00 0.00 H new ATOM 0 HD3 PRO A 59 1.787 18.508 16.945 1.00 0.00 H new ATOM 934 N ASP A 60 -3.659 18.743 17.582 1.00 0.00 N ATOM 935 CA ASP A 60 -4.818 18.601 18.456 1.00 0.00 C ATOM 936 C ASP A 60 -4.976 17.155 18.917 1.00 0.00 C ATOM 937 O ASP A 60 -5.346 16.895 20.062 1.00 0.00 O ATOM 938 CB ASP A 60 -6.086 19.061 17.735 1.00 0.00 C ATOM 939 CG ASP A 60 -5.996 20.500 17.268 1.00 0.00 C ATOM 940 OD1 ASP A 60 -6.860 21.310 17.667 1.00 0.00 O ATOM 941 OD2 ASP A 60 -5.062 20.818 16.502 1.00 0.00 O ATOM 0 H ASP A 60 -3.888 18.872 16.596 1.00 0.00 H new ATOM 0 HA ASP A 60 -4.661 19.228 19.333 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -6.267 18.414 16.877 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -6.940 18.952 18.403 1.00 0.00 H new ATOM 946 N VAL A 61 -4.695 16.218 18.017 1.00 0.00 N ATOM 947 CA VAL A 61 -4.806 14.799 18.331 1.00 0.00 C ATOM 948 C VAL A 61 -3.744 13.988 17.596 1.00 0.00 C ATOM 949 O VAL A 61 -3.295 14.369 16.514 1.00 0.00 O ATOM 950 CB VAL A 61 -6.199 14.251 17.967 1.00 0.00 C ATOM 951 CG1 VAL A 61 -6.372 12.836 18.498 1.00 0.00 C ATOM 952 CG2 VAL A 61 -7.288 15.167 18.501 1.00 0.00 C ATOM 0 H VAL A 61 -4.389 16.416 17.065 1.00 0.00 H new ATOM 0 HA VAL A 61 -4.654 14.700 19.406 1.00 0.00 H new ATOM 0 HB VAL A 61 -6.285 14.218 16.881 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -7.362 12.466 18.231 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -5.612 12.188 18.061 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -6.266 12.839 19.583 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -8.265 14.764 18.235 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -7.207 15.235 19.586 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -7.174 16.160 18.066 1.00 0.00 H new ATOM 962 N THR A 62 -3.346 12.868 18.190 1.00 0.00 N ATOM 963 CA THR A 62 -2.337 12.003 17.593 1.00 0.00 C ATOM 964 C THR A 62 -2.895 10.610 17.325 1.00 0.00 C ATOM 965 O THR A 62 -3.213 9.868 18.254 1.00 0.00 O ATOM 966 CB THR A 62 -1.095 11.881 18.496 1.00 0.00 C ATOM 967 OG1 THR A 62 -0.742 13.167 19.018 1.00 0.00 O ATOM 968 CG2 THR A 62 0.080 11.300 17.725 1.00 0.00 C ATOM 0 H THR A 62 -3.708 12.538 19.085 1.00 0.00 H new ATOM 0 HA THR A 62 -2.046 12.463 16.648 1.00 0.00 H new ATOM 0 HB THR A 62 -1.336 11.209 19.319 1.00 0.00 H new ATOM 0 HG1 THR A 62 0.047 13.081 19.592 1.00 0.00 H new ATOM 0 HG21 THR A 62 0.945 11.223 18.384 1.00 0.00 H new ATOM 0 HG22 THR A 62 -0.182 10.309 17.354 1.00 0.00 H new ATOM 0 HG23 THR A 62 0.321 11.950 16.884 1.00 0.00 H new ATOM 976 N VAL A 63 -3.010 10.259 16.048 1.00 0.00 N ATOM 977 CA VAL A 63 -3.529 8.953 15.658 1.00 0.00 C ATOM 978 C VAL A 63 -2.438 8.096 15.024 1.00 0.00 C ATOM 979 O VAL A 63 -1.626 8.585 14.239 1.00 0.00 O ATOM 980 CB VAL A 63 -4.701 9.088 14.667 1.00 0.00 C ATOM 981 CG1 VAL A 63 -4.184 9.229 13.244 1.00 0.00 C ATOM 982 CG2 VAL A 63 -5.638 7.896 14.787 1.00 0.00 C ATOM 0 H VAL A 63 -2.751 10.861 15.266 1.00 0.00 H new ATOM 0 HA VAL A 63 -3.886 8.469 16.567 1.00 0.00 H new ATOM 0 HB VAL A 63 -5.262 9.989 14.914 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -5.026 9.323 12.559 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -3.556 10.117 13.171 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -3.599 8.348 12.981 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -6.460 8.007 14.080 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -5.091 6.979 14.566 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -6.035 7.846 15.801 1.00 0.00 H new ATOM 992 N THR A 64 -2.426 6.813 15.370 1.00 0.00 N ATOM 993 CA THR A 64 -1.436 5.886 14.837 1.00 0.00 C ATOM 994 C THR A 64 -2.105 4.688 14.174 1.00 0.00 C ATOM 995 O THR A 64 -2.756 3.881 14.838 1.00 0.00 O ATOM 996 CB THR A 64 -0.485 5.384 15.939 1.00 0.00 C ATOM 997 OG1 THR A 64 -0.002 6.489 16.711 1.00 0.00 O ATOM 998 CG2 THR A 64 0.690 4.628 15.338 1.00 0.00 C ATOM 0 H THR A 64 -3.092 6.392 16.018 1.00 0.00 H new ATOM 0 HA THR A 64 -0.859 6.434 14.092 1.00 0.00 H new ATOM 0 HB THR A 64 -1.041 4.705 16.585 1.00 0.00 H new ATOM 0 HG1 THR A 64 0.601 6.161 17.410 1.00 0.00 H new ATOM 0 HG21 THR A 64 1.348 4.283 16.136 1.00 0.00 H new ATOM 0 HG22 THR A 64 0.321 3.770 14.776 1.00 0.00 H new ATOM 0 HG23 THR A 64 1.244 5.288 14.671 1.00 0.00 H new ATOM 1006 N VAL A 65 -1.940 4.576 12.859 1.00 0.00 N ATOM 1007 CA VAL A 65 -2.527 3.474 12.106 1.00 0.00 C ATOM 1008 C VAL A 65 -1.479 2.776 11.247 1.00 0.00 C ATOM 1009 O VAL A 65 -0.416 3.332 10.972 1.00 0.00 O ATOM 1010 CB VAL A 65 -3.674 3.961 11.201 1.00 0.00 C ATOM 1011 CG1 VAL A 65 -4.534 2.790 10.752 1.00 0.00 C ATOM 1012 CG2 VAL A 65 -4.515 5.004 11.923 1.00 0.00 C ATOM 0 H VAL A 65 -1.405 5.235 12.294 1.00 0.00 H new ATOM 0 HA VAL A 65 -2.924 2.768 12.836 1.00 0.00 H new ATOM 0 HB VAL A 65 -3.242 4.425 10.314 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -5.339 3.154 10.114 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -3.921 2.081 10.195 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -4.959 2.295 11.625 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -5.321 5.337 11.269 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -4.938 4.567 12.828 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -3.889 5.855 12.190 1.00 0.00 H new ATOM 1022 N GLY A 66 -1.786 1.553 10.825 1.00 0.00 N ATOM 1023 CA GLY A 66 -0.860 0.798 10.001 1.00 0.00 C ATOM 1024 C GLY A 66 -0.913 1.210 8.543 1.00 0.00 C ATOM 1025 O GLY A 66 -1.852 1.881 8.114 1.00 0.00 O ATOM 0 H GLY A 66 -2.659 1.072 11.039 1.00 0.00 H new ATOM 0 HA2 GLY A 66 0.153 0.937 10.378 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -1.088 -0.265 10.084 1.00 0.00 H new ATOM 1029 N LEU A 67 0.098 0.811 7.780 1.00 0.00 N ATOM 1030 CA LEU A 67 0.165 1.144 6.362 1.00 0.00 C ATOM 1031 C LEU A 67 -0.960 0.463 5.589 1.00 0.00 C ATOM 1032 O LEU A 67 -1.716 1.116 4.871 1.00 0.00 O ATOM 1033 CB LEU A 67 1.519 0.731 5.783 1.00 0.00 C ATOM 1034 CG LEU A 67 2.737 1.001 6.667 1.00 0.00 C ATOM 1035 CD1 LEU A 67 3.510 -0.284 6.919 1.00 0.00 C ATOM 1036 CD2 LEU A 67 3.637 2.050 6.029 1.00 0.00 C ATOM 0 H LEU A 67 0.883 0.256 8.120 1.00 0.00 H new ATOM 0 HA LEU A 67 0.049 2.223 6.262 1.00 0.00 H new ATOM 0 HB2 LEU A 67 1.486 -0.335 5.560 1.00 0.00 H new ATOM 0 HB3 LEU A 67 1.660 1.251 4.835 1.00 0.00 H new ATOM 0 HG LEU A 67 2.388 1.384 7.626 1.00 0.00 H new ATOM 0 HD11 LEU A 67 4.373 -0.072 7.550 1.00 0.00 H new ATOM 0 HD12 LEU A 67 2.864 -1.005 7.419 1.00 0.00 H new ATOM 0 HD13 LEU A 67 3.848 -0.698 5.969 1.00 0.00 H new ATOM 0 HD21 LEU A 67 4.499 2.230 6.672 1.00 0.00 H new ATOM 0 HD22 LEU A 67 3.978 1.694 5.057 1.00 0.00 H new ATOM 0 HD23 LEU A 67 3.080 2.978 5.901 1.00 0.00 H new ATOM 1048 N GLU A 68 -1.065 -0.853 5.744 1.00 0.00 N ATOM 1049 CA GLU A 68 -2.099 -1.622 5.061 1.00 0.00 C ATOM 1050 C GLU A 68 -3.468 -0.971 5.240 1.00 0.00 C ATOM 1051 O GLU A 68 -4.194 -0.751 4.270 1.00 0.00 O ATOM 1052 CB GLU A 68 -2.132 -3.057 5.591 1.00 0.00 C ATOM 1053 CG GLU A 68 -0.823 -3.806 5.403 1.00 0.00 C ATOM 1054 CD GLU A 68 -0.878 -4.798 4.257 1.00 0.00 C ATOM 1055 OE1 GLU A 68 -0.398 -5.937 4.437 1.00 0.00 O ATOM 1056 OE2 GLU A 68 -1.399 -4.436 3.182 1.00 0.00 O ATOM 0 H GLU A 68 -0.447 -1.409 6.336 1.00 0.00 H new ATOM 0 HA GLU A 68 -1.860 -1.640 3.998 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -2.381 -3.038 6.652 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -2.929 -3.603 5.087 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -0.022 -3.090 5.221 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -0.575 -4.334 6.324 1.00 0.00 H new ATOM 1063 N ASP A 69 -3.814 -0.667 6.486 1.00 0.00 N ATOM 1064 CA ASP A 69 -5.095 -0.041 6.792 1.00 0.00 C ATOM 1065 C ASP A 69 -5.304 1.211 5.947 1.00 0.00 C ATOM 1066 O ASP A 69 -6.298 1.329 5.230 1.00 0.00 O ATOM 1067 CB ASP A 69 -5.171 0.313 8.278 1.00 0.00 C ATOM 1068 CG ASP A 69 -6.597 0.350 8.792 1.00 0.00 C ATOM 1069 OD1 ASP A 69 -6.922 1.269 9.574 1.00 0.00 O ATOM 1070 OD2 ASP A 69 -7.388 -0.538 8.412 1.00 0.00 O ATOM 0 H ASP A 69 -3.226 -0.844 7.300 1.00 0.00 H new ATOM 0 HA ASP A 69 -5.885 -0.753 6.555 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -4.600 -0.417 8.852 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -4.704 1.284 8.442 1.00 0.00 H new ATOM 1075 N MET A 70 -4.362 2.144 6.037 1.00 0.00 N ATOM 1076 CA MET A 70 -4.443 3.387 5.280 1.00 0.00 C ATOM 1077 C MET A 70 -4.623 3.107 3.791 1.00 0.00 C ATOM 1078 O MET A 70 -5.180 3.925 3.058 1.00 0.00 O ATOM 1079 CB MET A 70 -3.185 4.229 5.504 1.00 0.00 C ATOM 1080 CG MET A 70 -3.012 4.692 6.941 1.00 0.00 C ATOM 1081 SD MET A 70 -2.946 6.488 7.089 1.00 0.00 S ATOM 1082 CE MET A 70 -4.676 6.870 7.352 1.00 0.00 C ATOM 0 H MET A 70 -3.534 2.063 6.627 1.00 0.00 H new ATOM 0 HA MET A 70 -5.311 3.943 5.635 1.00 0.00 H new ATOM 0 HB2 MET A 70 -2.311 3.647 5.211 1.00 0.00 H new ATOM 0 HB3 MET A 70 -3.221 5.101 4.852 1.00 0.00 H new ATOM 0 HG2 MET A 70 -3.837 4.312 7.543 1.00 0.00 H new ATOM 0 HG3 MET A 70 -2.096 4.264 7.349 1.00 0.00 H new ATOM 0 HE1 MET A 70 -4.798 7.948 7.462 1.00 0.00 H new ATOM 0 HE2 MET A 70 -5.259 6.524 6.498 1.00 0.00 H new ATOM 0 HE3 MET A 70 -5.025 6.371 8.256 1.00 0.00 H new ATOM 1092 N LEU A 71 -4.148 1.947 3.351 1.00 0.00 N ATOM 1093 CA LEU A 71 -4.256 1.559 1.948 1.00 0.00 C ATOM 1094 C LEU A 71 -5.707 1.275 1.573 1.00 0.00 C ATOM 1095 O LEU A 71 -6.207 1.774 0.565 1.00 0.00 O ATOM 1096 CB LEU A 71 -3.395 0.326 1.672 1.00 0.00 C ATOM 1097 CG LEU A 71 -2.816 0.214 0.261 1.00 0.00 C ATOM 1098 CD1 LEU A 71 -3.912 0.382 -0.780 1.00 0.00 C ATOM 1099 CD2 LEU A 71 -1.716 1.244 0.053 1.00 0.00 C ATOM 0 H LEU A 71 -3.685 1.259 3.945 1.00 0.00 H new ATOM 0 HA LEU A 71 -3.898 2.388 1.338 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -2.569 0.317 2.384 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -3.995 -0.563 1.869 1.00 0.00 H new ATOM 0 HG LEU A 71 -2.382 -0.779 0.144 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -3.482 0.299 -1.778 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -4.665 -0.394 -0.644 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -4.376 1.362 -0.665 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -1.315 1.150 -0.956 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -2.125 2.245 0.189 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -0.919 1.076 0.777 1.00 0.00 H new ATOM 1111 N ALA A 72 -6.378 0.471 2.391 1.00 0.00 N ATOM 1112 CA ALA A 72 -7.773 0.123 2.147 1.00 0.00 C ATOM 1113 C ALA A 72 -8.662 1.362 2.185 1.00 0.00 C ATOM 1114 O ALA A 72 -9.589 1.496 1.386 1.00 0.00 O ATOM 1115 CB ALA A 72 -8.248 -0.901 3.167 1.00 0.00 C ATOM 0 H ALA A 72 -5.978 0.048 3.229 1.00 0.00 H new ATOM 0 HA ALA A 72 -7.844 -0.313 1.151 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -9.291 -1.151 2.973 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -7.638 -1.801 3.090 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -8.156 -0.485 4.170 1.00 0.00 H new ATOM 1121 N ILE A 73 -8.373 2.264 3.117 1.00 0.00 N ATOM 1122 CA ILE A 73 -9.146 3.491 3.257 1.00 0.00 C ATOM 1123 C ILE A 73 -8.811 4.482 2.147 1.00 0.00 C ATOM 1124 O ILE A 73 -9.670 4.845 1.344 1.00 0.00 O ATOM 1125 CB ILE A 73 -8.896 4.161 4.621 1.00 0.00 C ATOM 1126 CG1 ILE A 73 -8.966 3.124 5.744 1.00 0.00 C ATOM 1127 CG2 ILE A 73 -9.906 5.274 4.857 1.00 0.00 C ATOM 1128 CD1 ILE A 73 -8.608 3.681 7.104 1.00 0.00 C ATOM 0 H ILE A 73 -7.609 2.168 3.786 1.00 0.00 H new ATOM 0 HA ILE A 73 -10.197 3.212 3.186 1.00 0.00 H new ATOM 0 HB ILE A 73 -7.897 4.598 4.617 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -9.974 2.711 5.783 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -8.292 2.300 5.509 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -9.717 5.738 5.825 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -9.812 6.023 4.071 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -10.914 4.859 4.845 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -8.679 2.891 7.851 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -7.590 4.069 7.082 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -9.297 4.486 7.360 1.00 0.00 H new ATOM 1140 N SER A 74 -7.555 4.916 2.108 1.00 0.00 N ATOM 1141 CA SER A 74 -7.105 5.866 1.098 1.00 0.00 C ATOM 1142 C SER A 74 -7.389 5.342 -0.306 1.00 0.00 C ATOM 1143 O SER A 74 -7.598 6.116 -1.240 1.00 0.00 O ATOM 1144 CB SER A 74 -5.609 6.144 1.258 1.00 0.00 C ATOM 1145 OG SER A 74 -5.263 7.403 0.709 1.00 0.00 O ATOM 0 H SER A 74 -6.831 4.624 2.765 1.00 0.00 H new ATOM 0 HA SER A 74 -7.657 6.795 1.239 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.342 6.119 2.315 1.00 0.00 H new ATOM 0 HB3 SER A 74 -5.035 5.359 0.765 1.00 0.00 H new ATOM 0 HG SER A 74 -5.035 8.024 1.432 1.00 0.00 H new ATOM 1151 N GLY A 75 -7.396 4.020 -0.448 1.00 0.00 N ATOM 1152 CA GLY A 75 -7.655 3.413 -1.740 1.00 0.00 C ATOM 1153 C GLY A 75 -9.127 3.425 -2.102 1.00 0.00 C ATOM 1154 O GLY A 75 -9.515 2.956 -3.172 1.00 0.00 O ATOM 0 H GLY A 75 -7.227 3.358 0.310 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -7.091 3.944 -2.507 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -7.294 2.385 -1.734 1.00 0.00 H new ATOM 1158 N LYS A 76 -9.950 3.962 -1.207 1.00 0.00 N ATOM 1159 CA LYS A 76 -11.388 4.034 -1.436 1.00 0.00 C ATOM 1160 C LYS A 76 -11.995 2.637 -1.523 1.00 0.00 C ATOM 1161 O LYS A 76 -12.635 2.287 -2.515 1.00 0.00 O ATOM 1162 CB LYS A 76 -11.682 4.810 -2.721 1.00 0.00 C ATOM 1163 CG LYS A 76 -13.003 5.559 -2.690 1.00 0.00 C ATOM 1164 CD LYS A 76 -13.625 5.651 -4.074 1.00 0.00 C ATOM 1165 CE LYS A 76 -14.394 4.387 -4.425 1.00 0.00 C ATOM 1166 NZ LYS A 76 -15.776 4.689 -4.890 1.00 0.00 N ATOM 0 H LYS A 76 -9.645 4.354 -0.316 1.00 0.00 H new ATOM 0 HA LYS A 76 -11.840 4.556 -0.592 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -10.875 5.521 -2.899 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -11.687 4.116 -3.562 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -13.692 5.054 -2.013 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -12.844 6.562 -2.294 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -14.295 6.509 -4.116 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -12.843 5.820 -4.815 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -13.860 3.842 -5.203 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -14.439 3.735 -3.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -16.267 3.801 -5.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -16.294 5.187 -4.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -15.733 5.290 -5.738 1.00 0.00 H new ATOM 1180 N THR A 77 -11.793 1.843 -0.476 1.00 0.00 N ATOM 1181 CA THR A 77 -12.321 0.485 -0.434 1.00 0.00 C ATOM 1182 C THR A 77 -12.975 0.190 0.911 1.00 0.00 C ATOM 1183 O THR A 77 -14.163 -0.128 0.980 1.00 0.00 O ATOM 1184 CB THR A 77 -11.216 -0.556 -0.694 1.00 0.00 C ATOM 1185 OG1 THR A 77 -10.553 -0.268 -1.930 1.00 0.00 O ATOM 1186 CG2 THR A 77 -11.796 -1.962 -0.739 1.00 0.00 C ATOM 0 H THR A 77 -11.268 2.117 0.354 1.00 0.00 H new ATOM 0 HA THR A 77 -13.070 0.413 -1.222 1.00 0.00 H new ATOM 0 HB THR A 77 -10.498 -0.503 0.124 1.00 0.00 H new ATOM 0 HG1 THR A 77 -9.851 -0.933 -2.087 1.00 0.00 H new ATOM 0 HG21 THR A 77 -10.997 -2.680 -0.924 1.00 0.00 H new ATOM 0 HG22 THR A 77 -12.274 -2.189 0.214 1.00 0.00 H new ATOM 0 HG23 THR A 77 -12.533 -2.026 -1.539 1.00 0.00 H new ATOM 1194 N LEU A 78 -12.193 0.299 1.980 1.00 0.00 N ATOM 1195 CA LEU A 78 -12.696 0.045 3.325 1.00 0.00 C ATOM 1196 C LEU A 78 -13.351 1.294 3.906 1.00 0.00 C ATOM 1197 O LEU A 78 -13.240 2.385 3.346 1.00 0.00 O ATOM 1198 CB LEU A 78 -11.559 -0.420 4.237 1.00 0.00 C ATOM 1199 CG LEU A 78 -11.536 -1.911 4.574 1.00 0.00 C ATOM 1200 CD1 LEU A 78 -10.231 -2.283 5.260 1.00 0.00 C ATOM 1201 CD2 LEU A 78 -12.725 -2.279 5.449 1.00 0.00 C ATOM 0 H LEU A 78 -11.208 0.562 1.941 1.00 0.00 H new ATOM 0 HA LEU A 78 -13.448 -0.742 3.263 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -10.612 -0.160 3.765 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -11.615 0.142 5.169 1.00 0.00 H new ATOM 0 HG LEU A 78 -11.607 -2.475 3.644 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -10.233 -3.348 5.492 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -9.395 -2.057 4.598 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -10.129 -1.711 6.182 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -12.692 -3.344 5.679 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -12.686 -1.707 6.376 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -13.650 -2.050 4.920 1.00 0.00 H new ATOM 1213 N THR A 79 -14.034 1.127 5.035 1.00 0.00 N ATOM 1214 CA THR A 79 -14.706 2.240 5.693 1.00 0.00 C ATOM 1215 C THR A 79 -14.123 2.492 7.079 1.00 0.00 C ATOM 1216 O THR A 79 -13.621 1.575 7.729 1.00 0.00 O ATOM 1217 CB THR A 79 -16.219 1.985 5.823 1.00 0.00 C ATOM 1218 OG1 THR A 79 -16.457 0.891 6.716 1.00 0.00 O ATOM 1219 CG2 THR A 79 -16.835 1.682 4.466 1.00 0.00 C ATOM 0 H THR A 79 -14.136 0.231 5.512 1.00 0.00 H new ATOM 0 HA THR A 79 -14.546 3.119 5.069 1.00 0.00 H new ATOM 0 HB THR A 79 -16.684 2.886 6.222 1.00 0.00 H new ATOM 0 HG1 THR A 79 -17.422 0.737 6.794 1.00 0.00 H new ATOM 0 HG21 THR A 79 -17.904 1.505 4.583 1.00 0.00 H new ATOM 0 HG22 THR A 79 -16.678 2.529 3.798 1.00 0.00 H new ATOM 0 HG23 THR A 79 -16.365 0.794 4.043 1.00 0.00 H new ATOM 1227 N VAL A 80 -14.195 3.742 7.528 1.00 0.00 N ATOM 1228 CA VAL A 80 -13.676 4.114 8.839 1.00 0.00 C ATOM 1229 C VAL A 80 -14.202 3.180 9.923 1.00 0.00 C ATOM 1230 O VAL A 80 -13.466 2.782 10.825 1.00 0.00 O ATOM 1231 CB VAL A 80 -14.050 5.564 9.199 1.00 0.00 C ATOM 1232 CG1 VAL A 80 -13.256 6.547 8.352 1.00 0.00 C ATOM 1233 CG2 VAL A 80 -15.545 5.786 9.028 1.00 0.00 C ATOM 0 H VAL A 80 -14.607 4.513 7.003 1.00 0.00 H new ATOM 0 HA VAL A 80 -12.591 4.029 8.786 1.00 0.00 H new ATOM 0 HB VAL A 80 -13.797 5.737 10.245 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -13.534 7.566 8.621 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -12.190 6.403 8.530 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -13.474 6.378 7.298 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -15.792 6.816 9.287 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -15.825 5.595 7.992 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -16.091 5.107 9.683 1.00 0.00 H new ATOM 1243 N GLY A 81 -15.482 2.835 9.829 1.00 0.00 N ATOM 1244 CA GLY A 81 -16.086 1.950 10.809 1.00 0.00 C ATOM 1245 C GLY A 81 -15.417 0.591 10.852 1.00 0.00 C ATOM 1246 O GLY A 81 -15.196 0.034 11.928 1.00 0.00 O ATOM 0 H GLY A 81 -16.112 3.152 9.092 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -16.029 2.411 11.795 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -17.144 1.824 10.577 1.00 0.00 H new ATOM 1250 N ASP A 82 -15.095 0.054 9.680 1.00 0.00 N ATOM 1251 CA ASP A 82 -14.447 -1.249 9.588 1.00 0.00 C ATOM 1252 C ASP A 82 -13.079 -1.225 10.262 1.00 0.00 C ATOM 1253 O ASP A 82 -12.786 -2.053 11.124 1.00 0.00 O ATOM 1254 CB ASP A 82 -14.302 -1.668 8.124 1.00 0.00 C ATOM 1255 CG ASP A 82 -15.110 -2.908 7.794 1.00 0.00 C ATOM 1256 OD1 ASP A 82 -15.696 -2.958 6.692 1.00 0.00 O ATOM 1257 OD2 ASP A 82 -15.156 -3.828 8.637 1.00 0.00 O ATOM 0 H ASP A 82 -15.272 0.501 8.781 1.00 0.00 H new ATOM 0 HA ASP A 82 -15.073 -1.976 10.105 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -14.622 -0.848 7.481 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -13.251 -1.854 7.905 1.00 0.00 H new ATOM 1262 N ALA A 83 -12.244 -0.272 9.861 1.00 0.00 N ATOM 1263 CA ALA A 83 -10.907 -0.139 10.426 1.00 0.00 C ATOM 1264 C ALA A 83 -10.967 0.069 11.935 1.00 0.00 C ATOM 1265 O ALA A 83 -10.093 -0.389 12.671 1.00 0.00 O ATOM 1266 CB ALA A 83 -10.165 1.011 9.762 1.00 0.00 C ATOM 0 H ALA A 83 -12.470 0.420 9.146 1.00 0.00 H new ATOM 0 HA ALA A 83 -10.365 -1.065 10.234 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -9.168 1.098 10.194 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -10.081 0.821 8.692 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -10.713 1.939 9.924 1.00 0.00 H new ATOM 1272 N LEU A 84 -12.004 0.764 12.391 1.00 0.00 N ATOM 1273 CA LEU A 84 -12.178 1.034 13.814 1.00 0.00 C ATOM 1274 C LEU A 84 -12.490 -0.249 14.577 1.00 0.00 C ATOM 1275 O LEU A 84 -11.939 -0.495 15.651 1.00 0.00 O ATOM 1276 CB LEU A 84 -13.299 2.053 14.026 1.00 0.00 C ATOM 1277 CG LEU A 84 -13.124 3.007 15.208 1.00 0.00 C ATOM 1278 CD1 LEU A 84 -11.884 3.867 15.021 1.00 0.00 C ATOM 1279 CD2 LEU A 84 -14.360 3.880 15.377 1.00 0.00 C ATOM 0 H LEU A 84 -12.737 1.151 11.796 1.00 0.00 H new ATOM 0 HA LEU A 84 -11.244 1.445 14.198 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -13.400 2.647 13.117 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -14.235 1.511 14.158 1.00 0.00 H new ATOM 0 HG LEU A 84 -12.996 2.413 16.113 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -11.776 4.540 15.872 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -11.005 3.227 14.950 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -11.981 4.452 14.106 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -14.218 4.553 16.223 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -14.519 4.465 14.471 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -15.230 3.248 15.558 1.00 0.00 H new ATOM 1291 N LYS A 85 -13.375 -1.065 14.016 1.00 0.00 N ATOM 1292 CA LYS A 85 -13.758 -2.326 14.641 1.00 0.00 C ATOM 1293 C LYS A 85 -12.559 -3.262 14.757 1.00 0.00 C ATOM 1294 O LYS A 85 -12.432 -4.004 15.730 1.00 0.00 O ATOM 1295 CB LYS A 85 -14.870 -3.001 13.835 1.00 0.00 C ATOM 1296 CG LYS A 85 -15.143 -4.434 14.257 1.00 0.00 C ATOM 1297 CD LYS A 85 -16.274 -5.048 13.450 1.00 0.00 C ATOM 1298 CE LYS A 85 -15.824 -6.308 12.728 1.00 0.00 C ATOM 1299 NZ LYS A 85 -16.886 -6.844 11.832 1.00 0.00 N ATOM 0 H LYS A 85 -13.841 -0.876 13.129 1.00 0.00 H new ATOM 0 HA LYS A 85 -14.125 -2.109 15.644 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -15.786 -2.420 13.939 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -14.601 -2.987 12.779 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -14.239 -5.030 14.130 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -15.396 -4.460 15.317 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -17.107 -5.285 14.111 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -16.640 -4.322 12.724 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -14.930 -6.091 12.143 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -15.549 -7.067 13.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -16.540 -7.703 11.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -17.730 -7.075 12.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -17.131 -6.129 11.117 1.00 0.00 H new ATOM 1313 N GLN A 86 -11.683 -3.220 13.758 1.00 0.00 N ATOM 1314 CA GLN A 86 -10.494 -4.065 13.750 1.00 0.00 C ATOM 1315 C GLN A 86 -9.501 -3.618 14.817 1.00 0.00 C ATOM 1316 O GLN A 86 -8.899 -4.442 15.504 1.00 0.00 O ATOM 1317 CB GLN A 86 -9.830 -4.033 12.372 1.00 0.00 C ATOM 1318 CG GLN A 86 -10.702 -4.599 11.263 1.00 0.00 C ATOM 1319 CD GLN A 86 -9.971 -4.697 9.939 1.00 0.00 C ATOM 1320 OE1 GLN A 86 -8.741 -4.708 9.895 1.00 0.00 O ATOM 1321 NE2 GLN A 86 -10.727 -4.770 8.849 1.00 0.00 N ATOM 0 H GLN A 86 -11.774 -2.611 12.945 1.00 0.00 H new ATOM 0 HA GLN A 86 -10.803 -5.086 13.973 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -9.569 -3.003 12.128 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -8.898 -4.597 12.414 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -11.055 -5.589 11.553 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -11.583 -3.969 11.141 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -11.744 -4.758 8.932 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -10.291 -4.838 7.929 1.00 0.00 H new ATOM 1330 N GLY A 87 -9.334 -2.305 14.950 1.00 0.00 N ATOM 1331 CA GLY A 87 -8.412 -1.771 15.935 1.00 0.00 C ATOM 1332 C GLY A 87 -7.092 -1.346 15.323 1.00 0.00 C ATOM 1333 O GLY A 87 -6.078 -1.258 16.016 1.00 0.00 O ATOM 0 H GLY A 87 -9.821 -1.602 14.393 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -8.871 -0.916 16.432 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -8.228 -2.524 16.702 1.00 0.00 H new ATOM 1337 N LYS A 88 -7.102 -1.084 14.021 1.00 0.00 N ATOM 1338 CA LYS A 88 -5.897 -0.667 13.314 1.00 0.00 C ATOM 1339 C LYS A 88 -5.579 0.797 13.598 1.00 0.00 C ATOM 1340 O LYS A 88 -4.413 1.190 13.648 1.00 0.00 O ATOM 1341 CB LYS A 88 -6.065 -0.881 11.808 1.00 0.00 C ATOM 1342 CG LYS A 88 -6.690 -2.217 11.449 1.00 0.00 C ATOM 1343 CD LYS A 88 -6.296 -2.659 10.049 1.00 0.00 C ATOM 1344 CE LYS A 88 -5.776 -4.088 10.041 1.00 0.00 C ATOM 1345 NZ LYS A 88 -4.315 -4.148 10.323 1.00 0.00 N ATOM 0 H LYS A 88 -7.933 -1.153 13.433 1.00 0.00 H new ATOM 0 HA LYS A 88 -5.067 -1.277 13.671 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -6.683 -0.080 11.403 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -5.089 -0.805 11.328 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -6.378 -2.971 12.171 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -7.775 -2.142 11.516 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -7.157 -2.581 9.386 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -5.530 -1.990 9.657 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -6.314 -4.674 10.786 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -5.978 -4.542 9.071 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -3.999 -5.139 10.309 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -3.799 -3.610 9.598 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -4.125 -3.738 11.260 1.00 0.00 H new ATOM 1359 N ILE A 89 -6.621 1.599 13.786 1.00 0.00 N ATOM 1360 CA ILE A 89 -6.452 3.019 14.068 1.00 0.00 C ATOM 1361 C ILE A 89 -6.370 3.275 15.569 1.00 0.00 C ATOM 1362 O ILE A 89 -7.358 3.128 16.288 1.00 0.00 O ATOM 1363 CB ILE A 89 -7.605 3.852 13.478 1.00 0.00 C ATOM 1364 CG1 ILE A 89 -7.897 3.414 12.042 1.00 0.00 C ATOM 1365 CG2 ILE A 89 -7.266 5.334 13.528 1.00 0.00 C ATOM 1366 CD1 ILE A 89 -9.032 4.177 11.396 1.00 0.00 C ATOM 0 H ILE A 89 -7.592 1.289 13.748 1.00 0.00 H new ATOM 0 HA ILE A 89 -5.517 3.325 13.598 1.00 0.00 H new ATOM 0 HB ILE A 89 -8.500 3.684 14.077 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -6.996 3.542 11.442 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -8.136 2.350 12.037 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -8.090 5.910 13.108 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -7.103 5.635 14.563 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -6.361 5.520 12.949 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -9.183 3.813 10.380 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -9.945 4.029 11.973 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -8.788 5.239 11.369 1.00 0.00 H new ATOM 1378 N GLU A 90 -5.186 3.660 16.035 1.00 0.00 N ATOM 1379 CA GLU A 90 -4.976 3.938 17.451 1.00 0.00 C ATOM 1380 C GLU A 90 -5.141 5.426 17.744 1.00 0.00 C ATOM 1381 O GLU A 90 -4.744 6.275 16.945 1.00 0.00 O ATOM 1382 CB GLU A 90 -3.584 3.473 17.884 1.00 0.00 C ATOM 1383 CG GLU A 90 -3.472 1.967 18.058 1.00 0.00 C ATOM 1384 CD GLU A 90 -2.053 1.464 17.881 1.00 0.00 C ATOM 1385 OE1 GLU A 90 -1.179 1.859 18.681 1.00 0.00 O ATOM 1386 OE2 GLU A 90 -1.816 0.675 16.943 1.00 0.00 O ATOM 0 H GLU A 90 -4.358 3.786 15.453 1.00 0.00 H new ATOM 0 HA GLU A 90 -5.727 3.388 18.018 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -2.854 3.800 17.143 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -3.324 3.959 18.824 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -3.830 1.692 19.050 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -4.122 1.472 17.336 1.00 0.00 H new ATOM 1393 N LEU A 91 -5.730 5.735 18.893 1.00 0.00 N ATOM 1394 CA LEU A 91 -5.949 7.121 19.293 1.00 0.00 C ATOM 1395 C LEU A 91 -5.047 7.499 20.463 1.00 0.00 C ATOM 1396 O LEU A 91 -4.574 6.634 21.200 1.00 0.00 O ATOM 1397 CB LEU A 91 -7.415 7.338 19.673 1.00 0.00 C ATOM 1398 CG LEU A 91 -8.107 6.166 20.371 1.00 0.00 C ATOM 1399 CD1 LEU A 91 -8.992 6.667 21.502 1.00 0.00 C ATOM 1400 CD2 LEU A 91 -8.922 5.357 19.373 1.00 0.00 C ATOM 0 H LEU A 91 -6.065 5.045 19.565 1.00 0.00 H new ATOM 0 HA LEU A 91 -5.702 7.761 18.446 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -7.476 8.210 20.324 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -7.973 7.577 18.768 1.00 0.00 H new ATOM 0 HG LEU A 91 -7.341 5.517 20.795 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -9.476 5.820 21.987 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -8.383 7.203 22.230 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -9.751 7.338 21.100 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -9.407 4.527 19.887 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -9.680 5.996 18.919 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -8.264 4.967 18.597 1.00 0.00 H new ATOM 1412 N SER A 92 -4.815 8.798 20.630 1.00 0.00 N ATOM 1413 CA SER A 92 -3.969 9.291 21.710 1.00 0.00 C ATOM 1414 C SER A 92 -3.991 10.815 21.765 1.00 0.00 C ATOM 1415 O SER A 92 -3.686 11.488 20.781 1.00 0.00 O ATOM 1416 CB SER A 92 -2.533 8.797 21.527 1.00 0.00 C ATOM 1417 OG SER A 92 -1.696 9.261 22.572 1.00 0.00 O ATOM 0 H SER A 92 -5.201 9.527 20.031 1.00 0.00 H new ATOM 0 HA SER A 92 -4.362 8.905 22.651 1.00 0.00 H new ATOM 0 HB2 SER A 92 -2.520 7.707 21.504 1.00 0.00 H new ATOM 0 HB3 SER A 92 -2.146 9.141 20.568 1.00 0.00 H new ATOM 0 HG SER A 92 -0.784 8.930 22.432 1.00 0.00 H new ATOM 1423 N GLY A 93 -4.356 11.354 22.924 1.00 0.00 N ATOM 1424 CA GLY A 93 -4.412 12.795 23.088 1.00 0.00 C ATOM 1425 C GLY A 93 -5.812 13.290 23.395 1.00 0.00 C ATOM 1426 O GLY A 93 -6.344 13.036 24.475 1.00 0.00 O ATOM 0 H GLY A 93 -4.614 10.818 23.753 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -3.740 13.092 23.893 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -4.051 13.275 22.178 1.00 0.00 H new ATOM 1430 N ASP A 94 -6.409 13.999 22.443 1.00 0.00 N ATOM 1431 CA ASP A 94 -7.755 14.531 22.617 1.00 0.00 C ATOM 1432 C ASP A 94 -8.783 13.650 21.914 1.00 0.00 C ATOM 1433 O ASP A 94 -9.311 14.014 20.864 1.00 0.00 O ATOM 1434 CB ASP A 94 -7.835 15.960 22.078 1.00 0.00 C ATOM 1435 CG ASP A 94 -7.634 17.000 23.162 1.00 0.00 C ATOM 1436 OD1 ASP A 94 -8.644 17.531 23.670 1.00 0.00 O ATOM 1437 OD2 ASP A 94 -6.467 17.283 23.503 1.00 0.00 O ATOM 0 H ASP A 94 -5.982 14.218 21.543 1.00 0.00 H new ATOM 0 HA ASP A 94 -7.980 14.540 23.683 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -7.080 16.096 21.304 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -8.806 16.114 21.607 1.00 0.00 H new ATOM 1442 N ALA A 95 -9.060 12.490 22.499 1.00 0.00 N ATOM 1443 CA ALA A 95 -10.024 11.557 21.929 1.00 0.00 C ATOM 1444 C ALA A 95 -11.285 12.283 21.472 1.00 0.00 C ATOM 1445 O ALA A 95 -11.881 11.930 20.454 1.00 0.00 O ATOM 1446 CB ALA A 95 -10.374 10.476 22.941 1.00 0.00 C ATOM 0 H ALA A 95 -8.630 12.173 23.368 1.00 0.00 H new ATOM 0 HA ALA A 95 -9.568 11.089 21.057 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -11.095 9.786 22.502 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -9.472 9.931 23.217 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -10.807 10.936 23.830 1.00 0.00 H new ATOM 1452 N ASP A 96 -11.686 13.298 22.229 1.00 0.00 N ATOM 1453 CA ASP A 96 -12.876 14.074 21.901 1.00 0.00 C ATOM 1454 C ASP A 96 -12.828 14.557 20.455 1.00 0.00 C ATOM 1455 O ASP A 96 -13.801 14.424 19.711 1.00 0.00 O ATOM 1456 CB ASP A 96 -13.009 15.269 22.847 1.00 0.00 C ATOM 1457 CG ASP A 96 -14.447 15.716 23.015 1.00 0.00 C ATOM 1458 OD1 ASP A 96 -14.733 16.906 22.761 1.00 0.00 O ATOM 1459 OD2 ASP A 96 -15.289 14.877 23.399 1.00 0.00 O ATOM 0 H ASP A 96 -11.204 13.603 23.075 1.00 0.00 H new ATOM 0 HA ASP A 96 -13.745 13.428 22.021 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -12.597 15.005 23.821 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -12.416 16.099 22.464 1.00 0.00 H new ATOM 1464 N LEU A 97 -11.690 15.120 20.062 1.00 0.00 N ATOM 1465 CA LEU A 97 -11.515 15.625 18.705 1.00 0.00 C ATOM 1466 C LEU A 97 -11.529 14.483 17.693 1.00 0.00 C ATOM 1467 O LEU A 97 -12.231 14.543 16.684 1.00 0.00 O ATOM 1468 CB LEU A 97 -10.203 16.403 18.594 1.00 0.00 C ATOM 1469 CG LEU A 97 -10.314 17.925 18.699 1.00 0.00 C ATOM 1470 CD1 LEU A 97 -9.751 18.411 20.025 1.00 0.00 C ATOM 1471 CD2 LEU A 97 -9.597 18.594 17.535 1.00 0.00 C ATOM 0 H LEU A 97 -10.875 15.238 20.664 1.00 0.00 H new ATOM 0 HA LEU A 97 -12.347 16.294 18.483 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -9.529 16.053 19.376 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -9.738 16.158 17.639 1.00 0.00 H new ATOM 0 HG LEU A 97 -11.369 18.197 18.654 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -9.839 19.496 20.082 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -10.309 17.959 20.845 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -8.701 18.127 20.100 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -9.686 19.676 17.626 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -8.543 18.315 17.548 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -10.047 18.271 16.596 1.00 0.00 H new ATOM 1483 N ALA A 98 -10.749 13.443 17.972 1.00 0.00 N ATOM 1484 CA ALA A 98 -10.675 12.286 17.089 1.00 0.00 C ATOM 1485 C ALA A 98 -12.046 11.641 16.912 1.00 0.00 C ATOM 1486 O ALA A 98 -12.326 11.029 15.882 1.00 0.00 O ATOM 1487 CB ALA A 98 -9.678 11.272 17.630 1.00 0.00 C ATOM 0 H ALA A 98 -10.160 13.379 18.802 1.00 0.00 H new ATOM 0 HA ALA A 98 -10.335 12.628 16.111 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -9.633 10.413 16.960 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -8.692 11.732 17.697 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -9.994 10.944 18.620 1.00 0.00 H new ATOM 1493 N ALA A 99 -12.896 11.782 17.924 1.00 0.00 N ATOM 1494 CA ALA A 99 -14.237 11.214 17.880 1.00 0.00 C ATOM 1495 C ALA A 99 -15.062 11.841 16.760 1.00 0.00 C ATOM 1496 O ALA A 99 -15.832 11.158 16.086 1.00 0.00 O ATOM 1497 CB ALA A 99 -14.934 11.401 19.219 1.00 0.00 C ATOM 0 H ALA A 99 -12.679 12.285 18.784 1.00 0.00 H new ATOM 0 HA ALA A 99 -14.146 10.147 17.676 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -15.935 10.972 19.171 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -14.362 10.901 20.000 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -15.006 12.465 19.446 1.00 0.00 H new ATOM 1503 N LYS A 100 -14.895 13.145 16.568 1.00 0.00 N ATOM 1504 CA LYS A 100 -15.624 13.865 15.530 1.00 0.00 C ATOM 1505 C LYS A 100 -15.450 13.188 14.175 1.00 0.00 C ATOM 1506 O LYS A 100 -16.340 13.241 13.325 1.00 0.00 O ATOM 1507 CB LYS A 100 -15.142 15.316 15.454 1.00 0.00 C ATOM 1508 CG LYS A 100 -15.759 16.218 16.508 1.00 0.00 C ATOM 1509 CD LYS A 100 -14.771 16.538 17.617 1.00 0.00 C ATOM 1510 CE LYS A 100 -15.479 16.795 18.938 1.00 0.00 C ATOM 1511 NZ LYS A 100 -15.807 18.237 19.119 1.00 0.00 N ATOM 0 H LYS A 100 -14.261 13.725 17.118 1.00 0.00 H new ATOM 0 HA LYS A 100 -16.683 13.853 15.788 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -14.057 15.336 15.561 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -15.372 15.715 14.466 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -16.097 17.144 16.043 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -16.639 15.734 16.932 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -14.072 15.710 17.733 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -14.184 17.414 17.341 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -16.395 16.206 18.980 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -14.847 16.460 19.760 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -16.289 18.372 20.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -14.931 18.797 19.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -16.431 18.550 18.348 1.00 0.00 H new ATOM 1525 N LEU A 101 -14.300 12.552 13.979 1.00 0.00 N ATOM 1526 CA LEU A 101 -14.010 11.863 12.727 1.00 0.00 C ATOM 1527 C LEU A 101 -14.851 10.597 12.594 1.00 0.00 C ATOM 1528 O LEU A 101 -15.572 10.419 11.613 1.00 0.00 O ATOM 1529 CB LEU A 101 -12.524 11.512 12.647 1.00 0.00 C ATOM 1530 CG LEU A 101 -11.578 12.666 12.311 1.00 0.00 C ATOM 1531 CD1 LEU A 101 -10.132 12.196 12.337 1.00 0.00 C ATOM 1532 CD2 LEU A 101 -11.923 13.260 10.953 1.00 0.00 C ATOM 0 H LEU A 101 -13.553 12.499 14.672 1.00 0.00 H new ATOM 0 HA LEU A 101 -14.263 12.533 11.906 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -12.220 11.086 13.603 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -12.395 10.733 11.896 1.00 0.00 H new ATOM 0 HG LEU A 101 -11.700 13.442 13.067 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -9.474 13.031 12.096 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -9.890 11.819 13.330 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -9.994 11.401 11.604 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -11.240 14.080 10.730 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -11.830 12.492 10.186 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -12.946 13.635 10.969 1.00 0.00 H new ATOM 1544 N ALA A 102 -14.755 9.722 13.590 1.00 0.00 N ATOM 1545 CA ALA A 102 -15.510 8.475 13.587 1.00 0.00 C ATOM 1546 C ALA A 102 -17.002 8.738 13.413 1.00 0.00 C ATOM 1547 O ALA A 102 -17.724 7.914 12.853 1.00 0.00 O ATOM 1548 CB ALA A 102 -15.254 7.700 14.871 1.00 0.00 C ATOM 0 H ALA A 102 -14.162 9.854 14.409 1.00 0.00 H new ATOM 0 HA ALA A 102 -15.172 7.876 12.741 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -15.824 6.771 14.855 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -14.191 7.472 14.953 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -15.563 8.301 15.726 1.00 0.00 H new ATOM 1554 N GLU A 103 -17.456 9.889 13.898 1.00 0.00 N ATOM 1555 CA GLU A 103 -18.864 10.257 13.797 1.00 0.00 C ATOM 1556 C GLU A 103 -19.351 10.153 12.355 1.00 0.00 C ATOM 1557 O GLU A 103 -20.530 9.903 12.103 1.00 0.00 O ATOM 1558 CB GLU A 103 -19.080 11.679 14.319 1.00 0.00 C ATOM 1559 CG GLU A 103 -18.851 11.820 15.815 1.00 0.00 C ATOM 1560 CD GLU A 103 -20.142 11.772 16.609 1.00 0.00 C ATOM 1561 OE1 GLU A 103 -20.461 10.695 17.156 1.00 0.00 O ATOM 1562 OE2 GLU A 103 -20.832 12.809 16.685 1.00 0.00 O ATOM 0 H GLU A 103 -16.871 10.582 14.364 1.00 0.00 H new ATOM 0 HA GLU A 103 -19.440 9.562 14.408 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -18.408 12.356 13.792 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -20.097 11.992 14.085 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -18.190 11.023 16.154 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -18.341 12.763 16.014 1.00 0.00 H new ATOM 1569 N VAL A 104 -18.435 10.348 11.412 1.00 0.00 N ATOM 1570 CA VAL A 104 -18.771 10.276 9.994 1.00 0.00 C ATOM 1571 C VAL A 104 -19.365 8.918 9.639 1.00 0.00 C ATOM 1572 O VAL A 104 -20.061 8.778 8.633 1.00 0.00 O ATOM 1573 CB VAL A 104 -17.534 10.530 9.112 1.00 0.00 C ATOM 1574 CG1 VAL A 104 -16.593 9.336 9.153 1.00 0.00 C ATOM 1575 CG2 VAL A 104 -17.955 10.839 7.683 1.00 0.00 C ATOM 0 H VAL A 104 -17.455 10.557 11.603 1.00 0.00 H new ATOM 0 HA VAL A 104 -19.511 11.054 9.803 1.00 0.00 H new ATOM 0 HB VAL A 104 -17.000 11.395 9.505 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -15.725 9.535 8.524 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -16.266 9.166 10.179 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -17.112 8.451 8.786 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -17.069 11.016 7.073 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -18.512 9.995 7.277 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -18.586 11.728 7.674 1.00 0.00 H new ATOM 1585 N ILE A 105 -19.085 7.920 10.470 1.00 0.00 N ATOM 1586 CA ILE A 105 -19.594 6.573 10.244 1.00 0.00 C ATOM 1587 C ILE A 105 -21.117 6.566 10.167 1.00 0.00 C ATOM 1588 O ILE A 105 -21.715 5.675 9.562 1.00 0.00 O ATOM 1589 CB ILE A 105 -19.143 5.607 11.356 1.00 0.00 C ATOM 1590 CG1 ILE A 105 -19.437 4.160 10.954 1.00 0.00 C ATOM 1591 CG2 ILE A 105 -19.834 5.949 12.667 1.00 0.00 C ATOM 1592 CD1 ILE A 105 -18.691 3.713 9.717 1.00 0.00 C ATOM 0 H ILE A 105 -18.509 8.019 11.306 1.00 0.00 H new ATOM 0 HA ILE A 105 -19.183 6.236 9.292 1.00 0.00 H new ATOM 0 HB ILE A 105 -18.067 5.714 11.496 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -19.177 3.501 11.783 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -20.508 4.050 10.782 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -19.505 5.258 13.443 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -19.579 6.968 12.957 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -20.914 5.867 12.542 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -18.948 2.678 9.491 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -18.969 4.348 8.875 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -17.618 3.791 9.891 1.00 0.00 H new ATOM 1604 N HIS A 106 -21.740 7.566 10.783 1.00 0.00 N ATOM 1605 CA HIS A 106 -23.194 7.677 10.782 1.00 0.00 C ATOM 1606 C HIS A 106 -23.725 7.848 9.362 1.00 0.00 C ATOM 1607 O HIS A 106 -22.988 8.235 8.455 1.00 0.00 O ATOM 1608 CB HIS A 106 -23.637 8.854 11.650 1.00 0.00 C ATOM 1609 CG HIS A 106 -23.419 10.189 11.006 1.00 0.00 C ATOM 1610 ND1 HIS A 106 -24.198 11.293 11.280 1.00 0.00 N ATOM 1611 CD2 HIS A 106 -22.502 10.593 10.097 1.00 0.00 C ATOM 1612 CE1 HIS A 106 -23.770 12.319 10.566 1.00 0.00 C ATOM 1613 NE2 HIS A 106 -22.741 11.921 9.840 1.00 0.00 N ATOM 0 H HIS A 106 -21.261 8.311 11.289 1.00 0.00 H new ATOM 0 HA HIS A 106 -23.604 6.756 11.196 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -24.695 8.742 11.886 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -23.094 8.823 12.595 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -21.726 9.985 9.656 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -24.190 13.314 10.575 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -22.210 12.505 9.194 1.00 0.00 H new ATOM 1621 N HIS A 107 -25.009 7.556 9.176 1.00 0.00 N ATOM 1622 CA HIS A 107 -25.638 7.677 7.866 1.00 0.00 C ATOM 1623 C HIS A 107 -26.754 8.717 7.894 1.00 0.00 C ATOM 1624 O HIS A 107 -27.936 8.374 7.949 1.00 0.00 O ATOM 1625 CB HIS A 107 -26.196 6.326 7.417 1.00 0.00 C ATOM 1626 CG HIS A 107 -25.145 5.378 6.928 1.00 0.00 C ATOM 1627 ND1 HIS A 107 -25.410 4.065 6.598 1.00 0.00 N ATOM 1628 CD2 HIS A 107 -23.821 5.558 6.711 1.00 0.00 C ATOM 1629 CE1 HIS A 107 -24.295 3.479 6.201 1.00 0.00 C ATOM 1630 NE2 HIS A 107 -23.316 4.364 6.260 1.00 0.00 N ATOM 0 H HIS A 107 -25.633 7.234 9.916 1.00 0.00 H new ATOM 0 HA HIS A 107 -24.879 8.002 7.155 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -26.729 5.867 8.250 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -26.925 6.489 6.623 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -23.265 6.471 6.864 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -24.200 2.451 5.882 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -22.343 4.188 6.011 1.00 0.00 H new ATOM 1638 N HIS A 108 -26.372 9.990 7.856 1.00 0.00 N ATOM 1639 CA HIS A 108 -27.341 11.080 7.877 1.00 0.00 C ATOM 1640 C HIS A 108 -27.666 11.546 6.461 1.00 0.00 C ATOM 1641 O HIS A 108 -27.037 11.113 5.495 1.00 0.00 O ATOM 1642 CB HIS A 108 -26.805 12.251 8.701 1.00 0.00 C ATOM 1643 CG HIS A 108 -27.868 12.990 9.454 1.00 0.00 C ATOM 1644 ND1 HIS A 108 -28.592 12.426 10.483 1.00 0.00 N ATOM 1645 CD2 HIS A 108 -28.327 14.257 9.323 1.00 0.00 C ATOM 1646 CE1 HIS A 108 -29.451 13.313 10.952 1.00 0.00 C ATOM 1647 NE2 HIS A 108 -29.311 14.433 10.265 1.00 0.00 N ATOM 0 H HIS A 108 -25.399 10.292 7.811 1.00 0.00 H new ATOM 0 HA HIS A 108 -28.257 10.710 8.338 1.00 0.00 H new ATOM 0 HB2 HIS A 108 -26.064 11.878 9.408 1.00 0.00 H new ATOM 0 HB3 HIS A 108 -26.291 12.947 8.037 1.00 0.00 H new ATOM 0 HD2 HIS A 108 -27.983 14.992 8.611 1.00 0.00 H new ATOM 0 HE1 HIS A 108 -30.149 13.150 11.760 1.00 0.00 H new ATOM 0 HE2 HIS A 108 -29.846 15.289 10.411 1.00 0.00 H new ATOM 1655 N HIS A 109 -28.652 12.430 6.345 1.00 0.00 N ATOM 1656 CA HIS A 109 -29.060 12.954 5.047 1.00 0.00 C ATOM 1657 C HIS A 109 -28.032 13.947 4.514 1.00 0.00 C ATOM 1658 O HIS A 109 -27.567 13.828 3.380 1.00 0.00 O ATOM 1659 CB HIS A 109 -30.429 13.627 5.153 1.00 0.00 C ATOM 1660 CG HIS A 109 -31.538 12.828 4.539 1.00 0.00 C ATOM 1661 ND1 HIS A 109 -31.484 12.327 3.256 1.00 0.00 N ATOM 1662 CD2 HIS A 109 -32.734 12.442 5.042 1.00 0.00 C ATOM 1663 CE1 HIS A 109 -32.600 11.670 2.995 1.00 0.00 C ATOM 1664 NE2 HIS A 109 -33.375 11.724 4.063 1.00 0.00 N ATOM 0 H HIS A 109 -29.183 12.798 7.134 1.00 0.00 H new ATOM 0 HA HIS A 109 -29.127 12.118 4.350 1.00 0.00 H new ATOM 0 HB2 HIS A 109 -30.658 13.803 6.204 1.00 0.00 H new ATOM 0 HB3 HIS A 109 -30.384 14.603 4.669 1.00 0.00 H new ATOM 0 HD2 HIS A 109 -33.113 12.659 6.030 1.00 0.00 H new ATOM 0 HE1 HIS A 109 -32.838 11.173 2.066 1.00 0.00 H new ATOM 0 HE2 HIS A 109 -34.299 11.301 4.147 1.00 0.00 H new ATOM 1672 N HIS A 110 -27.681 14.928 5.340 1.00 0.00 N ATOM 1673 CA HIS A 110 -26.707 15.943 4.952 1.00 0.00 C ATOM 1674 C HIS A 110 -25.395 15.753 5.706 1.00 0.00 C ATOM 1675 O HIS A 110 -25.391 15.435 6.896 1.00 0.00 O ATOM 1676 CB HIS A 110 -27.264 17.342 5.217 1.00 0.00 C ATOM 1677 CG HIS A 110 -26.987 18.316 4.113 1.00 0.00 C ATOM 1678 ND1 HIS A 110 -27.804 18.456 3.011 1.00 0.00 N ATOM 1679 CD2 HIS A 110 -25.978 19.202 3.947 1.00 0.00 C ATOM 1680 CE1 HIS A 110 -27.308 19.385 2.214 1.00 0.00 C ATOM 1681 NE2 HIS A 110 -26.200 19.854 2.759 1.00 0.00 N ATOM 0 H HIS A 110 -28.056 15.042 6.282 1.00 0.00 H new ATOM 0 HA HIS A 110 -26.511 15.835 3.885 1.00 0.00 H new ATOM 0 HB2 HIS A 110 -28.341 17.273 5.367 1.00 0.00 H new ATOM 0 HB3 HIS A 110 -26.837 17.725 6.144 1.00 0.00 H new ATOM 0 HD2 HIS A 110 -25.152 19.366 4.623 1.00 0.00 H new ATOM 0 HE1 HIS A 110 -27.736 19.707 1.276 1.00 0.00 H new ATOM 0 HE2 HIS A 110 -25.606 20.582 2.362 1.00 0.00 H new ATOM 1689 N HIS A 111 -24.282 15.950 5.006 1.00 0.00 N ATOM 1690 CA HIS A 111 -22.963 15.800 5.610 1.00 0.00 C ATOM 1691 C HIS A 111 -22.531 17.091 6.300 1.00 0.00 C ATOM 1692 O HIS A 111 -23.264 18.080 6.300 1.00 0.00 O ATOM 1693 CB HIS A 111 -21.935 15.406 4.549 1.00 0.00 C ATOM 1694 CG HIS A 111 -21.047 14.274 4.966 1.00 0.00 C ATOM 1695 ND1 HIS A 111 -19.760 14.457 5.426 1.00 0.00 N ATOM 1696 CD2 HIS A 111 -21.268 12.939 4.992 1.00 0.00 C ATOM 1697 CE1 HIS A 111 -19.228 13.283 5.715 1.00 0.00 C ATOM 1698 NE2 HIS A 111 -20.123 12.345 5.461 1.00 0.00 N ATOM 0 H HIS A 111 -24.267 16.214 4.021 1.00 0.00 H new ATOM 0 HA HIS A 111 -23.021 15.011 6.359 1.00 0.00 H new ATOM 0 HB2 HIS A 111 -22.458 15.128 3.634 1.00 0.00 H new ATOM 0 HB3 HIS A 111 -21.318 16.273 4.313 1.00 0.00 H new ATOM 0 HD1 HIS A 111 -19.292 15.358 5.527 1.00 0.00 H new ATOM 0 HD2 HIS A 111 -22.177 12.435 4.698 1.00 0.00 H new ATOM 0 HE1 HIS A 111 -18.230 13.118 6.095 1.00 0.00 H new TER 1706 HIS A 111