USER MOD reduce.3.24.130724 H: found=0, std=0, add=773, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 771 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 43 GLN : amide:sc= -2.58 K(o=-4.7,f=-6.7!) USER MOD Set 1.2: A 91 HIS : no HD1:sc= -2.12 K(o=-4.7,f=-5.9!) USER MOD Set 2.1: A 16 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 80 THR OG1 : rot 47:sc= 1.16 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 50:sc= 0.439 USER MOD Single : A 6 SER OG : rot 9:sc= 1.08 USER MOD Single : A 9 MET CE :methyl -172:sc= -1.62 (180deg=-1.93) USER MOD Single : A 20 ASN : amide:sc= -0.839 X(o=-0.84,f=-1.3!) USER MOD Single : A 28 THR OG1 : rot 180:sc= -1.23 USER MOD Single : A 29 CYS SG : rot 117:sc= 0.974 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 149:sc=-0.00195 (180deg=-1.4) USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 40 ASN : amide:sc= -0.303 X(o=-0.3,f=0) USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.0853) USER MOD Single : A 49 MET CE :methyl -133:sc= -3.04! (180deg=-9.48!) USER MOD Single : A 52 LYS NZ :NH3+ -160:sc= -0.0723 (180deg=-0.361) USER MOD Single : A 55 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0414) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot -42:sc= 0.483 USER MOD Single : A 63 THR OG1 : rot 180:sc= -0.166 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 69 HIS :FLIP no HD1:sc= -1.89 F(o=-2.9!,f=-1.9) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 ASN : amide:sc= -0.208 K(o=-0.21,f=-1.9) USER MOD Single : A 74 ASN : amide:sc= -4.26 K(o=-4.3,f=-7.9!) USER MOD Single : A 75 SER OG : rot 37:sc= 1.08 USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 44:sc= 0.694 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 13:sc= 0.702 USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 SER OG : rot 12:sc= 0.361! USER MOD Single : A 100 ASN : amide:sc= 0 X(o=0,f=-0.093) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -5.688 1.278 16.658 1.00 0.00 N ATOM 2 CA GLY A 1 -4.763 0.583 17.534 1.00 0.00 C ATOM 3 C GLY A 1 -3.591 1.451 17.946 1.00 0.00 C ATOM 4 O GLY A 1 -2.471 1.260 17.471 1.00 0.00 O ATOM 0 H1 GLY A 1 -6.471 0.642 16.405 1.00 0.00 H new ATOM 0 H2 GLY A 1 -6.066 2.115 17.146 1.00 0.00 H new ATOM 0 H3 GLY A 1 -5.191 1.576 15.794 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -5.294 0.248 18.425 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -4.391 -0.309 17.030 1.00 0.00 H new ATOM 8 N SER A 2 -3.848 2.408 18.831 1.00 0.00 N ATOM 9 CA SER A 2 -2.805 3.313 19.303 1.00 0.00 C ATOM 10 C SER A 2 -2.040 2.698 20.470 1.00 0.00 C ATOM 11 O SER A 2 -2.417 2.862 21.630 1.00 0.00 O ATOM 12 CB SER A 2 -3.415 4.651 19.726 1.00 0.00 C ATOM 13 OG SER A 2 -4.164 5.227 18.670 1.00 0.00 O ATOM 0 H SER A 2 -4.769 2.577 19.236 1.00 0.00 H new ATOM 0 HA SER A 2 -2.107 3.483 18.483 1.00 0.00 H new ATOM 0 HB2 SER A 2 -4.058 4.503 20.593 1.00 0.00 H new ATOM 0 HB3 SER A 2 -2.623 5.335 20.030 1.00 0.00 H new ATOM 0 HG SER A 2 -4.545 6.080 18.966 1.00 0.00 H new ATOM 19 N SER A 3 -0.962 1.988 20.154 1.00 0.00 N ATOM 20 CA SER A 3 -0.144 1.344 21.175 1.00 0.00 C ATOM 21 C SER A 3 1.253 1.956 21.218 1.00 0.00 C ATOM 22 O SER A 3 1.938 2.039 20.200 1.00 0.00 O ATOM 23 CB SER A 3 -0.046 -0.159 20.908 1.00 0.00 C ATOM 24 OG SER A 3 -1.285 -0.802 21.154 1.00 0.00 O ATOM 0 H SER A 3 -0.635 1.844 19.199 1.00 0.00 H new ATOM 0 HA SER A 3 -0.622 1.504 22.141 1.00 0.00 H new ATOM 0 HB2 SER A 3 0.257 -0.329 19.875 1.00 0.00 H new ATOM 0 HB3 SER A 3 0.726 -0.595 21.542 1.00 0.00 H new ATOM 0 HG SER A 3 -1.197 -1.761 20.975 1.00 0.00 H new ATOM 30 N GLY A 4 1.669 2.383 22.406 1.00 0.00 N ATOM 31 CA GLY A 4 2.982 2.983 22.561 1.00 0.00 C ATOM 32 C GLY A 4 4.099 2.048 22.142 1.00 0.00 C ATOM 33 O GLY A 4 4.503 2.035 20.979 1.00 0.00 O ATOM 0 H GLY A 4 1.121 2.324 23.264 1.00 0.00 H new ATOM 0 HA2 GLY A 4 3.034 3.895 21.967 1.00 0.00 H new ATOM 0 HA3 GLY A 4 3.125 3.272 23.602 1.00 0.00 H new ATOM 37 N SER A 5 4.601 1.265 23.091 1.00 0.00 N ATOM 38 CA SER A 5 5.682 0.326 22.816 1.00 0.00 C ATOM 39 C SER A 5 5.149 -1.099 22.703 1.00 0.00 C ATOM 40 O SER A 5 5.219 -1.876 23.654 1.00 0.00 O ATOM 41 CB SER A 5 6.743 0.401 23.915 1.00 0.00 C ATOM 42 OG SER A 5 6.166 0.202 25.194 1.00 0.00 O ATOM 0 H SER A 5 4.276 1.262 24.058 1.00 0.00 H new ATOM 0 HA SER A 5 6.136 0.601 21.864 1.00 0.00 H new ATOM 0 HB2 SER A 5 7.510 -0.353 23.737 1.00 0.00 H new ATOM 0 HB3 SER A 5 7.237 1.372 23.882 1.00 0.00 H new ATOM 0 HG SER A 5 5.602 -0.599 25.177 1.00 0.00 H new ATOM 48 N SER A 6 4.617 -1.434 21.531 1.00 0.00 N ATOM 49 CA SER A 6 4.069 -2.764 21.294 1.00 0.00 C ATOM 50 C SER A 6 3.948 -3.042 19.798 1.00 0.00 C ATOM 51 O SER A 6 3.858 -2.120 18.989 1.00 0.00 O ATOM 52 CB SER A 6 2.699 -2.900 21.961 1.00 0.00 C ATOM 53 OG SER A 6 2.829 -3.071 23.362 1.00 0.00 O ATOM 0 H SER A 6 4.554 -0.803 20.732 1.00 0.00 H new ATOM 0 HA SER A 6 4.751 -3.495 21.729 1.00 0.00 H new ATOM 0 HB2 SER A 6 2.100 -2.013 21.754 1.00 0.00 H new ATOM 0 HB3 SER A 6 2.167 -3.751 21.535 1.00 0.00 H new ATOM 0 HG SER A 6 3.761 -2.922 23.625 1.00 0.00 H new ATOM 59 N GLY A 7 3.947 -4.322 19.439 1.00 0.00 N ATOM 60 CA GLY A 7 3.837 -4.701 18.043 1.00 0.00 C ATOM 61 C GLY A 7 5.049 -4.285 17.232 1.00 0.00 C ATOM 62 O GLY A 7 5.109 -3.166 16.722 1.00 0.00 O ATOM 0 H GLY A 7 4.020 -5.103 20.091 1.00 0.00 H new ATOM 0 HA2 GLY A 7 3.709 -5.781 17.972 1.00 0.00 H new ATOM 0 HA3 GLY A 7 2.944 -4.246 17.615 1.00 0.00 H new ATOM 66 N ARG A 8 6.018 -5.187 17.114 1.00 0.00 N ATOM 67 CA ARG A 8 7.235 -4.907 16.363 1.00 0.00 C ATOM 68 C ARG A 8 6.908 -4.283 15.010 1.00 0.00 C ATOM 69 O ARG A 8 6.042 -4.771 14.283 1.00 0.00 O ATOM 70 CB ARG A 8 8.043 -6.190 16.162 1.00 0.00 C ATOM 71 CG ARG A 8 7.334 -7.229 15.309 1.00 0.00 C ATOM 72 CD ARG A 8 8.113 -8.534 15.258 1.00 0.00 C ATOM 73 NE ARG A 8 7.902 -9.344 16.455 1.00 0.00 N ATOM 74 CZ ARG A 8 8.502 -10.509 16.669 1.00 0.00 C ATOM 75 NH1 ARG A 8 9.346 -10.999 15.771 1.00 0.00 N ATOM 76 NH2 ARG A 8 8.259 -11.188 17.783 1.00 0.00 N ATOM 0 H ARG A 8 5.983 -6.118 17.529 1.00 0.00 H new ATOM 0 HA ARG A 8 7.830 -4.197 16.937 1.00 0.00 H new ATOM 0 HB2 ARG A 8 8.996 -5.940 15.697 1.00 0.00 H new ATOM 0 HB3 ARG A 8 8.268 -6.624 17.136 1.00 0.00 H new ATOM 0 HG2 ARG A 8 6.338 -7.414 15.712 1.00 0.00 H new ATOM 0 HG3 ARG A 8 7.202 -6.843 14.298 1.00 0.00 H new ATOM 0 HD2 ARG A 8 7.811 -9.102 14.378 1.00 0.00 H new ATOM 0 HD3 ARG A 8 9.176 -8.318 15.149 1.00 0.00 H new ATOM 0 HE ARG A 8 7.258 -8.996 17.165 1.00 0.00 H new ATOM 0 HH11 ARG A 8 9.536 -10.481 14.913 1.00 0.00 H new ATOM 0 HH12 ARG A 8 9.805 -11.894 15.938 1.00 0.00 H new ATOM 0 HH21 ARG A 8 7.610 -10.815 18.476 1.00 0.00 H new ATOM 0 HH22 ARG A 8 8.721 -12.083 17.946 1.00 0.00 H new ATOM 90 N MET A 9 7.604 -3.201 14.678 1.00 0.00 N ATOM 91 CA MET A 9 7.387 -2.510 13.412 1.00 0.00 C ATOM 92 C MET A 9 8.045 -3.266 12.262 1.00 0.00 C ATOM 93 O MET A 9 9.106 -3.870 12.428 1.00 0.00 O ATOM 94 CB MET A 9 7.938 -1.085 13.483 1.00 0.00 C ATOM 95 CG MET A 9 7.493 -0.322 14.720 1.00 0.00 C ATOM 96 SD MET A 9 5.810 -0.733 15.221 1.00 0.00 S ATOM 97 CE MET A 9 4.889 0.580 14.424 1.00 0.00 C ATOM 0 H MET A 9 8.323 -2.783 15.268 1.00 0.00 H new ATOM 0 HA MET A 9 6.313 -2.467 13.229 1.00 0.00 H new ATOM 0 HB2 MET A 9 9.027 -1.124 13.463 1.00 0.00 H new ATOM 0 HB3 MET A 9 7.622 -0.537 12.595 1.00 0.00 H new ATOM 0 HG2 MET A 9 8.176 -0.539 15.541 1.00 0.00 H new ATOM 0 HG3 MET A 9 7.559 0.748 14.525 1.00 0.00 H new ATOM 0 HE1 MET A 9 3.851 0.548 14.754 1.00 0.00 H new ATOM 0 HE2 MET A 9 5.325 1.543 14.690 1.00 0.00 H new ATOM 0 HE3 MET A 9 4.930 0.449 13.343 1.00 0.00 H new ATOM 107 N LEU A 10 7.411 -3.227 11.095 1.00 0.00 N ATOM 108 CA LEU A 10 7.935 -3.908 9.917 1.00 0.00 C ATOM 109 C LEU A 10 8.250 -2.911 8.806 1.00 0.00 C ATOM 110 O LEU A 10 7.584 -1.884 8.674 1.00 0.00 O ATOM 111 CB LEU A 10 6.930 -4.947 9.415 1.00 0.00 C ATOM 112 CG LEU A 10 6.392 -5.922 10.463 1.00 0.00 C ATOM 113 CD1 LEU A 10 5.182 -6.670 9.925 1.00 0.00 C ATOM 114 CD2 LEU A 10 7.479 -6.898 10.889 1.00 0.00 C ATOM 0 H LEU A 10 6.533 -2.731 10.940 1.00 0.00 H new ATOM 0 HA LEU A 10 8.859 -4.412 10.200 1.00 0.00 H new ATOM 0 HB2 LEU A 10 6.085 -4.421 8.970 1.00 0.00 H new ATOM 0 HB3 LEU A 10 7.401 -5.524 8.619 1.00 0.00 H new ATOM 0 HG LEU A 10 6.080 -5.351 11.338 1.00 0.00 H new ATOM 0 HD11 LEU A 10 4.813 -7.359 10.685 1.00 0.00 H new ATOM 0 HD12 LEU A 10 4.398 -5.957 9.670 1.00 0.00 H new ATOM 0 HD13 LEU A 10 5.467 -7.230 9.035 1.00 0.00 H new ATOM 0 HD21 LEU A 10 7.079 -7.585 11.635 1.00 0.00 H new ATOM 0 HD22 LEU A 10 7.821 -7.463 10.022 1.00 0.00 H new ATOM 0 HD23 LEU A 10 8.317 -6.346 11.316 1.00 0.00 H new ATOM 126 N ASP A 11 9.267 -3.222 8.011 1.00 0.00 N ATOM 127 CA ASP A 11 9.669 -2.354 6.909 1.00 0.00 C ATOM 128 C ASP A 11 9.054 -2.825 5.595 1.00 0.00 C ATOM 129 O ASP A 11 9.618 -3.673 4.902 1.00 0.00 O ATOM 130 CB ASP A 11 11.193 -2.319 6.790 1.00 0.00 C ATOM 131 CG ASP A 11 11.663 -1.471 5.624 1.00 0.00 C ATOM 132 OD1 ASP A 11 11.187 -1.703 4.493 1.00 0.00 O ATOM 133 OD2 ASP A 11 12.507 -0.577 5.842 1.00 0.00 O ATOM 0 H ASP A 11 9.828 -4.068 8.108 1.00 0.00 H new ATOM 0 HA ASP A 11 9.306 -1.348 7.119 1.00 0.00 H new ATOM 0 HB2 ASP A 11 11.618 -1.928 7.714 1.00 0.00 H new ATOM 0 HB3 ASP A 11 11.569 -3.335 6.671 1.00 0.00 H new ATOM 138 N PHE A 12 7.895 -2.270 5.257 1.00 0.00 N ATOM 139 CA PHE A 12 7.202 -2.635 4.027 1.00 0.00 C ATOM 140 C PHE A 12 7.653 -1.751 2.867 1.00 0.00 C ATOM 141 O PHE A 12 7.336 -0.563 2.819 1.00 0.00 O ATOM 142 CB PHE A 12 5.688 -2.516 4.215 1.00 0.00 C ATOM 143 CG PHE A 12 5.082 -3.679 4.947 1.00 0.00 C ATOM 144 CD1 PHE A 12 4.688 -4.817 4.262 1.00 0.00 C ATOM 145 CD2 PHE A 12 4.907 -3.635 6.321 1.00 0.00 C ATOM 146 CE1 PHE A 12 4.130 -5.889 4.933 1.00 0.00 C ATOM 147 CE2 PHE A 12 4.351 -4.704 6.997 1.00 0.00 C ATOM 148 CZ PHE A 12 3.961 -5.832 6.302 1.00 0.00 C ATOM 0 H PHE A 12 7.416 -1.566 5.818 1.00 0.00 H new ATOM 0 HA PHE A 12 7.451 -3.670 3.791 1.00 0.00 H new ATOM 0 HB2 PHE A 12 5.469 -1.599 4.762 1.00 0.00 H new ATOM 0 HB3 PHE A 12 5.214 -2.426 3.237 1.00 0.00 H new ATOM 0 HD1 PHE A 12 4.818 -4.867 3.191 1.00 0.00 H new ATOM 0 HD2 PHE A 12 5.209 -2.755 6.870 1.00 0.00 H new ATOM 0 HE1 PHE A 12 3.827 -6.770 4.387 1.00 0.00 H new ATOM 0 HE2 PHE A 12 4.221 -4.658 8.068 1.00 0.00 H new ATOM 0 HZ PHE A 12 3.525 -6.668 6.829 1.00 0.00 H new ATOM 158 N ARG A 13 8.394 -2.342 1.935 1.00 0.00 N ATOM 159 CA ARG A 13 8.890 -1.609 0.776 1.00 0.00 C ATOM 160 C ARG A 13 7.941 -1.759 -0.409 1.00 0.00 C ATOM 161 O ARG A 13 7.903 -2.803 -1.059 1.00 0.00 O ATOM 162 CB ARG A 13 10.285 -2.105 0.392 1.00 0.00 C ATOM 163 CG ARG A 13 10.862 -1.411 -0.832 1.00 0.00 C ATOM 164 CD ARG A 13 10.475 -2.131 -2.114 1.00 0.00 C ATOM 165 NE ARG A 13 11.339 -1.760 -3.232 1.00 0.00 N ATOM 166 CZ ARG A 13 11.461 -2.486 -4.338 1.00 0.00 C ATOM 167 NH1 ARG A 13 10.778 -3.614 -4.474 1.00 0.00 N ATOM 168 NH2 ARG A 13 12.268 -2.082 -5.311 1.00 0.00 N ATOM 0 H ARG A 13 8.664 -3.325 1.960 1.00 0.00 H new ATOM 0 HA ARG A 13 8.947 -0.553 1.042 1.00 0.00 H new ATOM 0 HB2 ARG A 13 10.959 -1.956 1.235 1.00 0.00 H new ATOM 0 HB3 ARG A 13 10.241 -3.178 0.204 1.00 0.00 H new ATOM 0 HG2 ARG A 13 10.506 -0.382 -0.870 1.00 0.00 H new ATOM 0 HG3 ARG A 13 11.948 -1.370 -0.750 1.00 0.00 H new ATOM 0 HD2 ARG A 13 10.530 -3.208 -1.956 1.00 0.00 H new ATOM 0 HD3 ARG A 13 9.440 -1.897 -2.363 1.00 0.00 H new ATOM 0 HE ARG A 13 11.878 -0.897 -3.160 1.00 0.00 H new ATOM 0 HH11 ARG A 13 10.156 -3.927 -3.728 1.00 0.00 H new ATOM 0 HH12 ARG A 13 10.874 -4.169 -5.324 1.00 0.00 H new ATOM 0 HH21 ARG A 13 12.794 -1.214 -5.210 1.00 0.00 H new ATOM 0 HH22 ARG A 13 12.362 -2.639 -6.160 1.00 0.00 H new ATOM 182 N VAL A 14 7.174 -0.708 -0.683 1.00 0.00 N ATOM 183 CA VAL A 14 6.225 -0.722 -1.790 1.00 0.00 C ATOM 184 C VAL A 14 6.862 -0.183 -3.067 1.00 0.00 C ATOM 185 O VAL A 14 7.201 0.996 -3.152 1.00 0.00 O ATOM 186 CB VAL A 14 4.971 0.110 -1.464 1.00 0.00 C ATOM 187 CG1 VAL A 14 3.968 0.034 -2.605 1.00 0.00 C ATOM 188 CG2 VAL A 14 4.344 -0.360 -0.160 1.00 0.00 C ATOM 0 H VAL A 14 7.191 0.164 -0.154 1.00 0.00 H new ATOM 0 HA VAL A 14 5.933 -1.761 -1.944 1.00 0.00 H new ATOM 0 HB VAL A 14 5.269 1.151 -1.343 1.00 0.00 H new ATOM 0 HG11 VAL A 14 3.089 0.628 -2.356 1.00 0.00 H new ATOM 0 HG12 VAL A 14 4.423 0.423 -3.516 1.00 0.00 H new ATOM 0 HG13 VAL A 14 3.673 -1.004 -2.761 1.00 0.00 H new ATOM 0 HG21 VAL A 14 3.459 0.239 0.055 1.00 0.00 H new ATOM 0 HG22 VAL A 14 4.059 -1.408 -0.250 1.00 0.00 H new ATOM 0 HG23 VAL A 14 5.064 -0.248 0.651 1.00 0.00 H new ATOM 198 N GLU A 15 7.020 -1.056 -4.057 1.00 0.00 N ATOM 199 CA GLU A 15 7.616 -0.668 -5.329 1.00 0.00 C ATOM 200 C GLU A 15 6.543 -0.229 -6.321 1.00 0.00 C ATOM 201 O GLU A 15 5.830 -1.058 -6.888 1.00 0.00 O ATOM 202 CB GLU A 15 8.424 -1.827 -5.915 1.00 0.00 C ATOM 203 CG GLU A 15 9.270 -1.435 -7.115 1.00 0.00 C ATOM 204 CD GLU A 15 9.761 -2.636 -7.900 1.00 0.00 C ATOM 205 OE1 GLU A 15 10.206 -3.617 -7.266 1.00 0.00 O ATOM 206 OE2 GLU A 15 9.700 -2.596 -9.146 1.00 0.00 O ATOM 0 H GLU A 15 6.743 -2.036 -4.002 1.00 0.00 H new ATOM 0 HA GLU A 15 8.284 0.174 -5.146 1.00 0.00 H new ATOM 0 HB2 GLU A 15 9.074 -2.234 -5.140 1.00 0.00 H new ATOM 0 HB3 GLU A 15 7.740 -2.624 -6.208 1.00 0.00 H new ATOM 0 HG2 GLU A 15 8.686 -0.791 -7.772 1.00 0.00 H new ATOM 0 HG3 GLU A 15 10.127 -0.852 -6.776 1.00 0.00 H new ATOM 213 N TYR A 16 6.433 1.079 -6.526 1.00 0.00 N ATOM 214 CA TYR A 16 5.446 1.628 -7.447 1.00 0.00 C ATOM 215 C TYR A 16 6.125 2.350 -8.607 1.00 0.00 C ATOM 216 O TYR A 16 7.246 2.840 -8.476 1.00 0.00 O ATOM 217 CB TYR A 16 4.511 2.589 -6.711 1.00 0.00 C ATOM 218 CG TYR A 16 3.523 3.288 -7.619 1.00 0.00 C ATOM 219 CD1 TYR A 16 2.719 2.565 -8.491 1.00 0.00 C ATOM 220 CD2 TYR A 16 3.395 4.671 -7.604 1.00 0.00 C ATOM 221 CE1 TYR A 16 1.816 3.199 -9.322 1.00 0.00 C ATOM 222 CE2 TYR A 16 2.494 5.314 -8.431 1.00 0.00 C ATOM 223 CZ TYR A 16 1.707 4.573 -9.289 1.00 0.00 C ATOM 224 OH TYR A 16 0.808 5.209 -10.114 1.00 0.00 O ATOM 0 H TYR A 16 7.016 1.779 -6.066 1.00 0.00 H new ATOM 0 HA TYR A 16 4.862 0.800 -7.850 1.00 0.00 H new ATOM 0 HB2 TYR A 16 3.962 2.036 -5.948 1.00 0.00 H new ATOM 0 HB3 TYR A 16 5.109 3.339 -6.193 1.00 0.00 H new ATOM 0 HD1 TYR A 16 2.801 1.489 -8.520 1.00 0.00 H new ATOM 0 HD2 TYR A 16 4.010 5.254 -6.934 1.00 0.00 H new ATOM 0 HE1 TYR A 16 1.199 2.621 -9.994 1.00 0.00 H new ATOM 0 HE2 TYR A 16 2.406 6.390 -8.406 1.00 0.00 H new ATOM 0 HH TYR A 16 0.856 6.177 -9.966 1.00 0.00 H new ATOM 234 N ARG A 17 5.436 2.411 -9.742 1.00 0.00 N ATOM 235 CA ARG A 17 5.971 3.072 -10.926 1.00 0.00 C ATOM 236 C ARG A 17 6.817 4.281 -10.538 1.00 0.00 C ATOM 237 O ARG A 17 8.015 4.328 -10.818 1.00 0.00 O ATOM 238 CB ARG A 17 4.833 3.509 -11.851 1.00 0.00 C ATOM 239 CG ARG A 17 4.002 2.352 -12.381 1.00 0.00 C ATOM 240 CD ARG A 17 2.937 2.832 -13.355 1.00 0.00 C ATOM 241 NE ARG A 17 3.422 2.851 -14.732 1.00 0.00 N ATOM 242 CZ ARG A 17 2.773 3.436 -15.732 1.00 0.00 C ATOM 243 NH1 ARG A 17 1.617 4.046 -15.509 1.00 0.00 N ATOM 244 NH2 ARG A 17 3.279 3.411 -16.958 1.00 0.00 N ATOM 0 H ARG A 17 4.506 2.011 -9.866 1.00 0.00 H new ATOM 0 HA ARG A 17 6.606 2.360 -11.453 1.00 0.00 H new ATOM 0 HB2 ARG A 17 4.181 4.197 -11.312 1.00 0.00 H new ATOM 0 HB3 ARG A 17 5.252 4.061 -12.693 1.00 0.00 H new ATOM 0 HG2 ARG A 17 4.653 1.632 -12.877 1.00 0.00 H new ATOM 0 HG3 ARG A 17 3.528 1.832 -11.549 1.00 0.00 H new ATOM 0 HD2 ARG A 17 2.065 2.182 -13.287 1.00 0.00 H new ATOM 0 HD3 ARG A 17 2.612 3.833 -13.072 1.00 0.00 H new ATOM 0 HE ARG A 17 4.308 2.389 -14.937 1.00 0.00 H new ATOM 0 HH11 ARG A 17 1.224 4.067 -14.568 1.00 0.00 H new ATOM 0 HH12 ARG A 17 1.120 4.495 -16.279 1.00 0.00 H new ATOM 0 HH21 ARG A 17 4.168 2.942 -17.134 1.00 0.00 H new ATOM 0 HH22 ARG A 17 2.779 3.861 -17.725 1.00 0.00 H new ATOM 258 N ASP A 18 6.186 5.256 -9.893 1.00 0.00 N ATOM 259 CA ASP A 18 6.881 6.465 -9.466 1.00 0.00 C ATOM 260 C ASP A 18 8.220 6.123 -8.820 1.00 0.00 C ATOM 261 O ASP A 18 9.279 6.483 -9.336 1.00 0.00 O ATOM 262 CB ASP A 18 6.015 7.256 -8.484 1.00 0.00 C ATOM 263 CG ASP A 18 4.983 8.117 -9.186 1.00 0.00 C ATOM 264 OD1 ASP A 18 3.903 7.590 -9.524 1.00 0.00 O ATOM 265 OD2 ASP A 18 5.256 9.317 -9.398 1.00 0.00 O ATOM 0 H ASP A 18 5.195 5.233 -9.654 1.00 0.00 H new ATOM 0 HA ASP A 18 7.069 7.077 -10.348 1.00 0.00 H new ATOM 0 HB2 ASP A 18 5.509 6.564 -7.811 1.00 0.00 H new ATOM 0 HB3 ASP A 18 6.654 7.889 -7.869 1.00 0.00 H new ATOM 270 N ARG A 19 8.166 5.427 -7.689 1.00 0.00 N ATOM 271 CA ARG A 19 9.374 5.038 -6.972 1.00 0.00 C ATOM 272 C ARG A 19 9.037 4.147 -5.781 1.00 0.00 C ATOM 273 O ARG A 19 7.869 3.973 -5.434 1.00 0.00 O ATOM 274 CB ARG A 19 10.132 6.279 -6.497 1.00 0.00 C ATOM 275 CG ARG A 19 9.393 7.073 -5.432 1.00 0.00 C ATOM 276 CD ARG A 19 10.255 8.194 -4.873 1.00 0.00 C ATOM 277 NE ARG A 19 11.094 7.739 -3.767 1.00 0.00 N ATOM 278 CZ ARG A 19 10.635 7.510 -2.542 1.00 0.00 C ATOM 279 NH1 ARG A 19 9.350 7.693 -2.267 1.00 0.00 N ATOM 280 NH2 ARG A 19 11.460 7.098 -1.589 1.00 0.00 N ATOM 0 H ARG A 19 7.298 5.121 -7.249 1.00 0.00 H new ATOM 0 HA ARG A 19 10.007 4.474 -7.657 1.00 0.00 H new ATOM 0 HB2 ARG A 19 11.102 5.974 -6.103 1.00 0.00 H new ATOM 0 HB3 ARG A 19 10.325 6.926 -7.353 1.00 0.00 H new ATOM 0 HG2 ARG A 19 8.481 7.492 -5.857 1.00 0.00 H new ATOM 0 HG3 ARG A 19 9.092 6.407 -4.624 1.00 0.00 H new ATOM 0 HD2 ARG A 19 10.886 8.596 -5.666 1.00 0.00 H new ATOM 0 HD3 ARG A 19 9.615 9.008 -4.532 1.00 0.00 H new ATOM 0 HE ARG A 19 12.087 7.589 -3.945 1.00 0.00 H new ATOM 0 HH11 ARG A 19 8.712 8.010 -2.997 1.00 0.00 H new ATOM 0 HH12 ARG A 19 9.000 7.516 -1.325 1.00 0.00 H new ATOM 0 HH21 ARG A 19 12.449 6.957 -1.796 1.00 0.00 H new ATOM 0 HH22 ARG A 19 11.106 6.923 -0.649 1.00 0.00 H new ATOM 294 N ASN A 20 10.068 3.585 -5.158 1.00 0.00 N ATOM 295 CA ASN A 20 9.880 2.711 -4.006 1.00 0.00 C ATOM 296 C ASN A 20 9.826 3.519 -2.713 1.00 0.00 C ATOM 297 O ASN A 20 10.623 4.434 -2.506 1.00 0.00 O ATOM 298 CB ASN A 20 11.011 1.683 -3.930 1.00 0.00 C ATOM 299 CG ASN A 20 12.370 2.296 -4.211 1.00 0.00 C ATOM 300 OD1 ASN A 20 12.576 3.493 -4.012 1.00 0.00 O ATOM 301 ND2 ASN A 20 13.304 1.475 -4.675 1.00 0.00 N ATOM 0 H ASN A 20 11.041 3.719 -5.431 1.00 0.00 H new ATOM 0 HA ASN A 20 8.931 2.190 -4.128 1.00 0.00 H new ATOM 0 HB2 ASN A 20 11.019 1.228 -2.940 1.00 0.00 H new ATOM 0 HB3 ASN A 20 10.821 0.884 -4.647 1.00 0.00 H new ATOM 0 HD21 ASN A 20 14.238 1.830 -4.882 1.00 0.00 H new ATOM 0 HD22 ASN A 20 13.088 0.489 -4.825 1.00 0.00 H new ATOM 308 N VAL A 21 8.879 3.174 -1.846 1.00 0.00 N ATOM 309 CA VAL A 21 8.720 3.866 -0.572 1.00 0.00 C ATOM 310 C VAL A 21 8.736 2.883 0.593 1.00 0.00 C ATOM 311 O VAL A 21 8.252 1.757 0.475 1.00 0.00 O ATOM 312 CB VAL A 21 7.409 4.673 -0.531 1.00 0.00 C ATOM 313 CG1 VAL A 21 6.213 3.761 -0.755 1.00 0.00 C ATOM 314 CG2 VAL A 21 7.283 5.417 0.790 1.00 0.00 C ATOM 0 H VAL A 21 8.210 2.420 -2.003 1.00 0.00 H new ATOM 0 HA VAL A 21 9.562 4.551 -0.477 1.00 0.00 H new ATOM 0 HB VAL A 21 7.430 5.408 -1.335 1.00 0.00 H new ATOM 0 HG11 VAL A 21 5.296 4.349 -0.723 1.00 0.00 H new ATOM 0 HG12 VAL A 21 6.301 3.279 -1.729 1.00 0.00 H new ATOM 0 HG13 VAL A 21 6.184 3.001 0.025 1.00 0.00 H new ATOM 0 HG21 VAL A 21 6.351 5.982 0.802 1.00 0.00 H new ATOM 0 HG22 VAL A 21 7.284 4.701 1.612 1.00 0.00 H new ATOM 0 HG23 VAL A 21 8.124 6.101 0.904 1.00 0.00 H new ATOM 324 N ASP A 22 9.294 3.316 1.718 1.00 0.00 N ATOM 325 CA ASP A 22 9.371 2.475 2.906 1.00 0.00 C ATOM 326 C ASP A 22 8.232 2.791 3.871 1.00 0.00 C ATOM 327 O ASP A 22 7.977 3.953 4.187 1.00 0.00 O ATOM 328 CB ASP A 22 10.717 2.666 3.607 1.00 0.00 C ATOM 329 CG ASP A 22 10.697 2.183 5.043 1.00 0.00 C ATOM 330 OD1 ASP A 22 9.926 1.246 5.344 1.00 0.00 O ATOM 331 OD2 ASP A 22 11.451 2.740 5.867 1.00 0.00 O ATOM 0 H ASP A 22 9.700 4.245 1.832 1.00 0.00 H new ATOM 0 HA ASP A 22 9.279 1.436 2.591 1.00 0.00 H new ATOM 0 HB2 ASP A 22 11.489 2.128 3.057 1.00 0.00 H new ATOM 0 HB3 ASP A 22 10.987 3.722 3.586 1.00 0.00 H new ATOM 336 N VAL A 23 7.550 1.749 4.335 1.00 0.00 N ATOM 337 CA VAL A 23 6.438 1.916 5.264 1.00 0.00 C ATOM 338 C VAL A 23 6.710 1.197 6.581 1.00 0.00 C ATOM 339 O VAL A 23 7.220 0.077 6.596 1.00 0.00 O ATOM 340 CB VAL A 23 5.122 1.385 4.665 1.00 0.00 C ATOM 341 CG1 VAL A 23 3.987 1.518 5.669 1.00 0.00 C ATOM 342 CG2 VAL A 23 4.791 2.119 3.374 1.00 0.00 C ATOM 0 H VAL A 23 7.748 0.781 4.083 1.00 0.00 H new ATOM 0 HA VAL A 23 6.339 2.985 5.450 1.00 0.00 H new ATOM 0 HB VAL A 23 5.248 0.327 4.433 1.00 0.00 H new ATOM 0 HG11 VAL A 23 3.065 1.138 5.229 1.00 0.00 H new ATOM 0 HG12 VAL A 23 4.225 0.944 6.565 1.00 0.00 H new ATOM 0 HG13 VAL A 23 3.857 2.567 5.934 1.00 0.00 H new ATOM 0 HG21 VAL A 23 3.858 1.732 2.964 1.00 0.00 H new ATOM 0 HG22 VAL A 23 4.683 3.184 3.579 1.00 0.00 H new ATOM 0 HG23 VAL A 23 5.595 1.968 2.653 1.00 0.00 H new ATOM 352 N VAL A 24 6.365 1.850 7.687 1.00 0.00 N ATOM 353 CA VAL A 24 6.570 1.273 9.010 1.00 0.00 C ATOM 354 C VAL A 24 5.258 1.186 9.781 1.00 0.00 C ATOM 355 O VAL A 24 4.685 2.205 10.170 1.00 0.00 O ATOM 356 CB VAL A 24 7.581 2.095 9.830 1.00 0.00 C ATOM 357 CG1 VAL A 24 7.391 1.846 11.318 1.00 0.00 C ATOM 358 CG2 VAL A 24 9.004 1.768 9.404 1.00 0.00 C ATOM 0 H VAL A 24 5.943 2.778 7.692 1.00 0.00 H new ATOM 0 HA VAL A 24 6.967 0.269 8.859 1.00 0.00 H new ATOM 0 HB VAL A 24 7.403 3.153 9.638 1.00 0.00 H new ATOM 0 HG11 VAL A 24 8.115 2.436 11.881 1.00 0.00 H new ATOM 0 HG12 VAL A 24 6.381 2.136 11.609 1.00 0.00 H new ATOM 0 HG13 VAL A 24 7.541 0.788 11.532 1.00 0.00 H new ATOM 0 HG21 VAL A 24 9.705 2.358 9.994 1.00 0.00 H new ATOM 0 HG22 VAL A 24 9.197 0.707 9.565 1.00 0.00 H new ATOM 0 HG23 VAL A 24 9.131 2.004 8.347 1.00 0.00 H new ATOM 368 N LEU A 25 4.786 -0.036 9.999 1.00 0.00 N ATOM 369 CA LEU A 25 3.540 -0.257 10.725 1.00 0.00 C ATOM 370 C LEU A 25 3.621 -1.523 11.573 1.00 0.00 C ATOM 371 O LEU A 25 4.025 -2.580 11.089 1.00 0.00 O ATOM 372 CB LEU A 25 2.368 -0.359 9.747 1.00 0.00 C ATOM 373 CG LEU A 25 2.079 -1.752 9.188 1.00 0.00 C ATOM 374 CD1 LEU A 25 0.703 -1.793 8.541 1.00 0.00 C ATOM 375 CD2 LEU A 25 3.153 -2.159 8.190 1.00 0.00 C ATOM 0 H LEU A 25 5.247 -0.889 9.684 1.00 0.00 H new ATOM 0 HA LEU A 25 3.379 0.593 11.388 1.00 0.00 H new ATOM 0 HB2 LEU A 25 1.470 0.003 10.248 1.00 0.00 H new ATOM 0 HB3 LEU A 25 2.559 0.314 8.911 1.00 0.00 H new ATOM 0 HG LEU A 25 2.090 -2.464 10.014 1.00 0.00 H new ATOM 0 HD11 LEU A 25 0.515 -2.792 8.149 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -0.056 -1.546 9.284 1.00 0.00 H new ATOM 0 HD13 LEU A 25 0.662 -1.070 7.726 1.00 0.00 H new ATOM 0 HD21 LEU A 25 2.931 -3.153 7.802 1.00 0.00 H new ATOM 0 HD22 LEU A 25 3.174 -1.445 7.367 1.00 0.00 H new ATOM 0 HD23 LEU A 25 4.124 -2.171 8.685 1.00 0.00 H new ATOM 387 N GLU A 26 3.231 -1.407 12.839 1.00 0.00 N ATOM 388 CA GLU A 26 3.259 -2.543 13.752 1.00 0.00 C ATOM 389 C GLU A 26 2.459 -3.715 13.189 1.00 0.00 C ATOM 390 O GLU A 26 1.677 -3.552 12.252 1.00 0.00 O ATOM 391 CB GLU A 26 2.700 -2.141 15.119 1.00 0.00 C ATOM 392 CG GLU A 26 1.207 -1.858 15.106 1.00 0.00 C ATOM 393 CD GLU A 26 0.890 -0.409 14.792 1.00 0.00 C ATOM 394 OE1 GLU A 26 1.020 -0.014 13.615 1.00 0.00 O ATOM 395 OE2 GLU A 26 0.513 0.331 15.725 1.00 0.00 O ATOM 0 H GLU A 26 2.893 -0.539 13.255 1.00 0.00 H new ATOM 0 HA GLU A 26 4.297 -2.856 13.869 1.00 0.00 H new ATOM 0 HB2 GLU A 26 2.904 -2.938 15.834 1.00 0.00 H new ATOM 0 HB3 GLU A 26 3.227 -1.254 15.471 1.00 0.00 H new ATOM 0 HG2 GLU A 26 0.726 -2.499 14.368 1.00 0.00 H new ATOM 0 HG3 GLU A 26 0.784 -2.116 16.077 1.00 0.00 H new ATOM 402 N ASP A 27 2.663 -4.894 13.765 1.00 0.00 N ATOM 403 CA ASP A 27 1.962 -6.093 13.321 1.00 0.00 C ATOM 404 C ASP A 27 0.522 -6.099 13.826 1.00 0.00 C ATOM 405 O ASP A 27 -0.268 -6.975 13.473 1.00 0.00 O ATOM 406 CB ASP A 27 2.691 -7.346 13.808 1.00 0.00 C ATOM 407 CG ASP A 27 2.515 -7.577 15.296 1.00 0.00 C ATOM 408 OD1 ASP A 27 2.587 -6.594 16.062 1.00 0.00 O ATOM 409 OD2 ASP A 27 2.304 -8.742 15.694 1.00 0.00 O ATOM 0 H ASP A 27 3.308 -5.045 14.540 1.00 0.00 H new ATOM 0 HA ASP A 27 1.946 -6.092 12.231 1.00 0.00 H new ATOM 0 HB2 ASP A 27 2.320 -8.214 13.262 1.00 0.00 H new ATOM 0 HB3 ASP A 27 3.753 -7.256 13.580 1.00 0.00 H new ATOM 414 N THR A 28 0.188 -5.116 14.656 1.00 0.00 N ATOM 415 CA THR A 28 -1.155 -5.008 15.212 1.00 0.00 C ATOM 416 C THR A 28 -2.113 -4.367 14.214 1.00 0.00 C ATOM 417 O THR A 28 -3.323 -4.589 14.271 1.00 0.00 O ATOM 418 CB THR A 28 -1.160 -4.186 16.514 1.00 0.00 C ATOM 419 OG1 THR A 28 -1.324 -2.795 16.214 1.00 0.00 O ATOM 420 CG2 THR A 28 0.131 -4.394 17.290 1.00 0.00 C ATOM 0 H THR A 28 0.830 -4.383 14.958 1.00 0.00 H new ATOM 0 HA THR A 28 -1.489 -6.022 15.431 1.00 0.00 H new ATOM 0 HB THR A 28 -1.993 -4.525 17.129 1.00 0.00 H new ATOM 0 HG1 THR A 28 -1.328 -2.279 17.047 1.00 0.00 H new ATOM 0 HG21 THR A 28 0.104 -3.803 18.206 1.00 0.00 H new ATOM 0 HG22 THR A 28 0.238 -5.449 17.542 1.00 0.00 H new ATOM 0 HG23 THR A 28 0.977 -4.079 16.680 1.00 0.00 H new ATOM 428 N CYS A 29 -1.565 -3.571 13.303 1.00 0.00 N ATOM 429 CA CYS A 29 -2.372 -2.897 12.292 1.00 0.00 C ATOM 430 C CYS A 29 -2.979 -3.903 11.320 1.00 0.00 C ATOM 431 O CYS A 29 -2.453 -5.002 11.137 1.00 0.00 O ATOM 432 CB CYS A 29 -1.524 -1.879 11.528 1.00 0.00 C ATOM 433 SG CYS A 29 -1.443 -0.251 12.310 1.00 0.00 S ATOM 0 H CYS A 29 -0.566 -3.376 13.243 1.00 0.00 H new ATOM 0 HA CYS A 29 -3.183 -2.375 12.800 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -0.512 -2.271 11.423 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -1.928 -1.767 10.522 1.00 0.00 H new ATOM 0 HG CYS A 29 -0.214 0.008 12.647 1.00 0.00 H new ATOM 439 N THR A 30 -4.091 -3.523 10.699 1.00 0.00 N ATOM 440 CA THR A 30 -4.772 -4.392 9.748 1.00 0.00 C ATOM 441 C THR A 30 -4.177 -4.251 8.351 1.00 0.00 C ATOM 442 O THR A 30 -3.783 -3.159 7.941 1.00 0.00 O ATOM 443 CB THR A 30 -6.280 -4.085 9.685 1.00 0.00 C ATOM 444 OG1 THR A 30 -6.796 -3.894 11.007 1.00 0.00 O ATOM 445 CG2 THR A 30 -7.034 -5.215 9.000 1.00 0.00 C ATOM 0 H THR A 30 -4.540 -2.618 10.838 1.00 0.00 H new ATOM 0 HA THR A 30 -4.632 -5.415 10.098 1.00 0.00 H new ATOM 0 HB THR A 30 -6.419 -3.173 9.105 1.00 0.00 H new ATOM 0 HG1 THR A 30 -7.755 -3.698 10.959 1.00 0.00 H new ATOM 0 HG21 THR A 30 -8.097 -4.976 8.967 1.00 0.00 H new ATOM 0 HG22 THR A 30 -6.659 -5.340 7.984 1.00 0.00 H new ATOM 0 HG23 THR A 30 -6.887 -6.140 9.557 1.00 0.00 H new ATOM 453 N VAL A 31 -4.117 -5.362 7.623 1.00 0.00 N ATOM 454 CA VAL A 31 -3.573 -5.361 6.271 1.00 0.00 C ATOM 455 C VAL A 31 -4.150 -4.216 5.447 1.00 0.00 C ATOM 456 O VAL A 31 -3.533 -3.754 4.488 1.00 0.00 O ATOM 457 CB VAL A 31 -3.857 -6.692 5.551 1.00 0.00 C ATOM 458 CG1 VAL A 31 -3.088 -7.829 6.206 1.00 0.00 C ATOM 459 CG2 VAL A 31 -5.350 -6.984 5.541 1.00 0.00 C ATOM 0 H VAL A 31 -4.439 -6.274 7.948 1.00 0.00 H new ATOM 0 HA VAL A 31 -2.495 -5.230 6.364 1.00 0.00 H new ATOM 0 HB VAL A 31 -3.520 -6.605 4.518 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -3.302 -8.761 5.683 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -2.019 -7.622 6.156 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -3.391 -7.920 7.249 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -5.533 -7.928 5.028 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -5.714 -7.051 6.566 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -5.874 -6.182 5.022 1.00 0.00 H new ATOM 469 N GLY A 32 -5.341 -3.762 5.827 1.00 0.00 N ATOM 470 CA GLY A 32 -5.983 -2.674 5.112 1.00 0.00 C ATOM 471 C GLY A 32 -5.257 -1.355 5.291 1.00 0.00 C ATOM 472 O GLY A 32 -5.167 -0.558 4.358 1.00 0.00 O ATOM 0 H GLY A 32 -5.872 -4.128 6.617 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -6.030 -2.918 4.051 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -7.010 -2.570 5.461 1.00 0.00 H new ATOM 476 N GLU A 33 -4.741 -1.124 6.494 1.00 0.00 N ATOM 477 CA GLU A 33 -4.022 0.109 6.792 1.00 0.00 C ATOM 478 C GLU A 33 -2.987 0.410 5.713 1.00 0.00 C ATOM 479 O GLU A 33 -3.051 1.445 5.048 1.00 0.00 O ATOM 480 CB GLU A 33 -3.338 0.010 8.157 1.00 0.00 C ATOM 481 CG GLU A 33 -4.210 0.476 9.311 1.00 0.00 C ATOM 482 CD GLU A 33 -5.663 0.079 9.141 1.00 0.00 C ATOM 483 OE1 GLU A 33 -5.920 -1.064 8.708 1.00 0.00 O ATOM 484 OE2 GLU A 33 -6.544 0.912 9.441 1.00 0.00 O ATOM 0 H GLU A 33 -4.807 -1.774 7.277 1.00 0.00 H new ATOM 0 HA GLU A 33 -4.745 0.924 6.815 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -3.042 -1.024 8.331 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -2.425 0.604 8.140 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -3.829 0.056 10.242 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -4.141 1.560 9.399 1.00 0.00 H new ATOM 491 N ILE A 34 -2.034 -0.500 5.545 1.00 0.00 N ATOM 492 CA ILE A 34 -0.986 -0.333 4.546 1.00 0.00 C ATOM 493 C ILE A 34 -1.517 0.375 3.304 1.00 0.00 C ATOM 494 O ILE A 34 -0.871 1.273 2.764 1.00 0.00 O ATOM 495 CB ILE A 34 -0.381 -1.688 4.132 1.00 0.00 C ATOM 496 CG1 ILE A 34 0.113 -2.448 5.364 1.00 0.00 C ATOM 497 CG2 ILE A 34 0.753 -1.481 3.140 1.00 0.00 C ATOM 498 CD1 ILE A 34 0.811 -3.749 5.031 1.00 0.00 C ATOM 0 H ILE A 34 -1.966 -1.361 6.088 1.00 0.00 H new ATOM 0 HA ILE A 34 -0.208 0.278 5.004 1.00 0.00 H new ATOM 0 HB ILE A 34 -1.156 -2.283 3.648 1.00 0.00 H new ATOM 0 HG12 ILE A 34 0.797 -1.811 5.924 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -0.735 -2.656 6.017 1.00 0.00 H new ATOM 0 HG21 ILE A 34 1.170 -2.448 2.857 1.00 0.00 H new ATOM 0 HG22 ILE A 34 0.372 -0.976 2.252 1.00 0.00 H new ATOM 0 HG23 ILE A 34 1.531 -0.870 3.599 1.00 0.00 H new ATOM 0 HD11 ILE A 34 1.135 -4.234 5.952 1.00 0.00 H new ATOM 0 HD12 ILE A 34 0.123 -4.405 4.498 1.00 0.00 H new ATOM 0 HD13 ILE A 34 1.679 -3.546 4.404 1.00 0.00 H new ATOM 510 N LYS A 35 -2.700 -0.034 2.858 1.00 0.00 N ATOM 511 CA LYS A 35 -3.321 0.562 1.681 1.00 0.00 C ATOM 512 C LYS A 35 -3.501 2.066 1.864 1.00 0.00 C ATOM 513 O LYS A 35 -2.940 2.862 1.112 1.00 0.00 O ATOM 514 CB LYS A 35 -4.676 -0.095 1.407 1.00 0.00 C ATOM 515 CG LYS A 35 -4.589 -1.592 1.166 1.00 0.00 C ATOM 516 CD LYS A 35 -5.866 -2.132 0.545 1.00 0.00 C ATOM 517 CE LYS A 35 -5.812 -2.079 -0.974 1.00 0.00 C ATOM 518 NZ LYS A 35 -7.164 -1.898 -1.571 1.00 0.00 N ATOM 0 H LYS A 35 -3.248 -0.776 3.294 1.00 0.00 H new ATOM 0 HA LYS A 35 -2.663 0.394 0.828 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -5.338 0.090 2.253 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -5.131 0.379 0.537 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -3.745 -1.807 0.510 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -4.398 -2.103 2.110 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -6.023 -3.161 0.869 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -6.718 -1.553 0.900 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -5.165 -1.259 -1.286 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -5.367 -2.999 -1.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -7.082 -1.364 -2.460 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -7.586 -2.829 -1.764 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -7.769 -1.374 -0.907 1.00 0.00 H new ATOM 532 N GLN A 36 -4.285 2.446 2.867 1.00 0.00 N ATOM 533 CA GLN A 36 -4.537 3.854 3.148 1.00 0.00 C ATOM 534 C GLN A 36 -3.235 4.593 3.437 1.00 0.00 C ATOM 535 O GLN A 36 -3.090 5.769 3.103 1.00 0.00 O ATOM 536 CB GLN A 36 -5.492 3.996 4.334 1.00 0.00 C ATOM 537 CG GLN A 36 -5.854 5.438 4.655 1.00 0.00 C ATOM 538 CD GLN A 36 -7.231 5.571 5.274 1.00 0.00 C ATOM 539 OE1 GLN A 36 -7.372 5.635 6.496 1.00 0.00 O ATOM 540 NE2 GLN A 36 -8.257 5.613 4.432 1.00 0.00 N ATOM 0 H GLN A 36 -4.757 1.799 3.499 1.00 0.00 H new ATOM 0 HA GLN A 36 -4.997 4.298 2.265 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -6.405 3.439 4.123 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -5.037 3.540 5.213 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -5.112 5.851 5.338 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -5.812 6.031 3.741 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -8.094 5.557 3.427 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -9.208 5.702 4.791 1.00 0.00 H new ATOM 549 N ILE A 37 -2.291 3.896 4.060 1.00 0.00 N ATOM 550 CA ILE A 37 -1.000 4.486 4.393 1.00 0.00 C ATOM 551 C ILE A 37 -0.299 5.014 3.146 1.00 0.00 C ATOM 552 O ILE A 37 0.202 6.139 3.131 1.00 0.00 O ATOM 553 CB ILE A 37 -0.080 3.470 5.094 1.00 0.00 C ATOM 554 CG1 ILE A 37 -0.711 2.998 6.406 1.00 0.00 C ATOM 555 CG2 ILE A 37 1.289 4.082 5.348 1.00 0.00 C ATOM 556 CD1 ILE A 37 -0.057 1.761 6.980 1.00 0.00 C ATOM 0 H ILE A 37 -2.396 2.922 4.344 1.00 0.00 H new ATOM 0 HA ILE A 37 -1.198 5.314 5.074 1.00 0.00 H new ATOM 0 HB ILE A 37 0.046 2.606 4.442 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -0.652 3.803 7.138 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -1.769 2.796 6.239 1.00 0.00 H new ATOM 0 HG21 ILE A 37 1.928 3.351 5.844 1.00 0.00 H new ATOM 0 HG22 ILE A 37 1.739 4.373 4.399 1.00 0.00 H new ATOM 0 HG23 ILE A 37 1.182 4.961 5.983 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -0.555 1.484 7.909 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -0.139 0.942 6.266 1.00 0.00 H new ATOM 0 HD13 ILE A 37 0.995 1.965 7.179 1.00 0.00 H new ATOM 568 N LEU A 38 -0.269 4.196 2.100 1.00 0.00 N ATOM 569 CA LEU A 38 0.369 4.580 0.846 1.00 0.00 C ATOM 570 C LEU A 38 -0.240 5.866 0.296 1.00 0.00 C ATOM 571 O LEU A 38 0.395 6.586 -0.473 1.00 0.00 O ATOM 572 CB LEU A 38 0.234 3.457 -0.184 1.00 0.00 C ATOM 573 CG LEU A 38 1.109 2.225 0.047 1.00 0.00 C ATOM 574 CD1 LEU A 38 0.672 1.083 -0.857 1.00 0.00 C ATOM 575 CD2 LEU A 38 2.575 2.561 -0.185 1.00 0.00 C ATOM 0 H LEU A 38 -0.679 3.262 2.095 1.00 0.00 H new ATOM 0 HA LEU A 38 1.426 4.756 1.045 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -0.808 3.138 -0.209 1.00 0.00 H new ATOM 0 HB3 LEU A 38 0.467 3.864 -1.168 1.00 0.00 H new ATOM 0 HG LEU A 38 0.990 1.907 1.083 1.00 0.00 H new ATOM 0 HD11 LEU A 38 1.306 0.215 -0.679 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -0.365 0.825 -0.642 1.00 0.00 H new ATOM 0 HD13 LEU A 38 0.761 1.389 -1.899 1.00 0.00 H new ATOM 0 HD21 LEU A 38 3.183 1.672 -0.016 1.00 0.00 H new ATOM 0 HD22 LEU A 38 2.712 2.905 -1.210 1.00 0.00 H new ATOM 0 HD23 LEU A 38 2.882 3.347 0.505 1.00 0.00 H new ATOM 587 N GLU A 39 -1.476 6.148 0.698 1.00 0.00 N ATOM 588 CA GLU A 39 -2.170 7.348 0.247 1.00 0.00 C ATOM 589 C GLU A 39 -1.687 8.577 1.012 1.00 0.00 C ATOM 590 O GLU A 39 -1.926 9.711 0.600 1.00 0.00 O ATOM 591 CB GLU A 39 -3.682 7.186 0.422 1.00 0.00 C ATOM 592 CG GLU A 39 -4.486 8.355 -0.122 1.00 0.00 C ATOM 593 CD GLU A 39 -5.977 8.193 0.105 1.00 0.00 C ATOM 594 OE1 GLU A 39 -6.534 7.164 -0.332 1.00 0.00 O ATOM 595 OE2 GLU A 39 -6.585 9.094 0.720 1.00 0.00 O ATOM 0 H GLU A 39 -2.016 5.562 1.334 1.00 0.00 H new ATOM 0 HA GLU A 39 -1.947 7.489 -0.810 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -4.001 6.272 -0.079 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -3.906 7.064 1.482 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -4.148 9.276 0.353 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -4.294 8.458 -1.190 1.00 0.00 H new ATOM 602 N ASN A 40 -1.006 8.341 2.128 1.00 0.00 N ATOM 603 CA ASN A 40 -0.489 9.428 2.952 1.00 0.00 C ATOM 604 C ASN A 40 0.964 9.734 2.601 1.00 0.00 C ATOM 605 O ASN A 40 1.543 10.698 3.100 1.00 0.00 O ATOM 606 CB ASN A 40 -0.603 9.070 4.435 1.00 0.00 C ATOM 607 CG ASN A 40 -1.976 9.377 5.001 1.00 0.00 C ATOM 608 OD1 ASN A 40 -2.106 10.121 5.973 1.00 0.00 O ATOM 609 ND2 ASN A 40 -3.008 8.805 4.393 1.00 0.00 N ATOM 0 H ASN A 40 -0.799 7.407 2.483 1.00 0.00 H new ATOM 0 HA ASN A 40 -1.087 10.317 2.753 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -0.387 8.010 4.567 1.00 0.00 H new ATOM 0 HB3 ASN A 40 0.150 9.621 4.998 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -3.956 8.975 4.729 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -2.853 8.195 3.590 1.00 0.00 H new ATOM 616 N GLU A 41 1.545 8.906 1.739 1.00 0.00 N ATOM 617 CA GLU A 41 2.931 9.088 1.321 1.00 0.00 C ATOM 618 C GLU A 41 3.023 9.277 -0.190 1.00 0.00 C ATOM 619 O GLU A 41 3.858 10.036 -0.683 1.00 0.00 O ATOM 620 CB GLU A 41 3.778 7.889 1.750 1.00 0.00 C ATOM 621 CG GLU A 41 3.716 7.601 3.241 1.00 0.00 C ATOM 622 CD GLU A 41 4.993 6.977 3.768 1.00 0.00 C ATOM 623 OE1 GLU A 41 5.198 5.766 3.542 1.00 0.00 O ATOM 624 OE2 GLU A 41 5.788 7.698 4.406 1.00 0.00 O ATOM 0 H GLU A 41 1.079 8.103 1.317 1.00 0.00 H new ATOM 0 HA GLU A 41 3.315 9.986 1.805 1.00 0.00 H new ATOM 0 HB2 GLU A 41 3.445 7.006 1.204 1.00 0.00 H new ATOM 0 HB3 GLU A 41 4.815 8.067 1.466 1.00 0.00 H new ATOM 0 HG2 GLU A 41 3.521 8.529 3.779 1.00 0.00 H new ATOM 0 HG3 GLU A 41 2.879 6.933 3.444 1.00 0.00 H new ATOM 631 N LEU A 42 2.160 8.579 -0.921 1.00 0.00 N ATOM 632 CA LEU A 42 2.144 8.668 -2.377 1.00 0.00 C ATOM 633 C LEU A 42 0.931 9.456 -2.861 1.00 0.00 C ATOM 634 O LEU A 42 0.798 9.739 -4.051 1.00 0.00 O ATOM 635 CB LEU A 42 2.135 7.268 -2.993 1.00 0.00 C ATOM 636 CG LEU A 42 3.312 6.364 -2.622 1.00 0.00 C ATOM 637 CD1 LEU A 42 2.987 4.911 -2.932 1.00 0.00 C ATOM 638 CD2 LEU A 42 4.571 6.800 -3.357 1.00 0.00 C ATOM 0 H LEU A 42 1.463 7.946 -0.529 1.00 0.00 H new ATOM 0 HA LEU A 42 3.045 9.192 -2.694 1.00 0.00 H new ATOM 0 HB2 LEU A 42 1.212 6.769 -2.698 1.00 0.00 H new ATOM 0 HB3 LEU A 42 2.109 7.370 -4.078 1.00 0.00 H new ATOM 0 HG LEU A 42 3.491 6.454 -1.551 1.00 0.00 H new ATOM 0 HD11 LEU A 42 3.836 4.283 -2.662 1.00 0.00 H new ATOM 0 HD12 LEU A 42 2.111 4.604 -2.360 1.00 0.00 H new ATOM 0 HD13 LEU A 42 2.781 4.804 -3.997 1.00 0.00 H new ATOM 0 HD21 LEU A 42 5.398 6.146 -3.081 1.00 0.00 H new ATOM 0 HD22 LEU A 42 4.404 6.740 -4.432 1.00 0.00 H new ATOM 0 HD23 LEU A 42 4.814 7.827 -3.085 1.00 0.00 H new ATOM 650 N GLN A 43 0.051 9.809 -1.929 1.00 0.00 N ATOM 651 CA GLN A 43 -1.150 10.567 -2.261 1.00 0.00 C ATOM 652 C GLN A 43 -2.013 9.807 -3.263 1.00 0.00 C ATOM 653 O GLN A 43 -2.722 10.410 -4.069 1.00 0.00 O ATOM 654 CB GLN A 43 -0.774 11.936 -2.830 1.00 0.00 C ATOM 655 CG GLN A 43 -0.306 12.926 -1.775 1.00 0.00 C ATOM 656 CD GLN A 43 1.191 12.867 -1.543 1.00 0.00 C ATOM 657 OE1 GLN A 43 1.933 13.746 -1.984 1.00 0.00 O ATOM 658 NE2 GLN A 43 1.643 11.830 -0.849 1.00 0.00 N ATOM 0 H GLN A 43 0.147 9.582 -0.939 1.00 0.00 H new ATOM 0 HA GLN A 43 -1.725 10.707 -1.346 1.00 0.00 H new ATOM 0 HB2 GLN A 43 0.015 11.808 -3.571 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -1.636 12.353 -3.351 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -0.583 13.935 -2.081 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -0.823 12.724 -0.837 1.00 0.00 H new ATOM 0 HE21 GLN A 43 0.992 11.125 -0.503 1.00 0.00 H new ATOM 0 HE22 GLN A 43 2.641 11.738 -0.662 1.00 0.00 H new ATOM 667 N ILE A 44 -1.948 8.481 -3.206 1.00 0.00 N ATOM 668 CA ILE A 44 -2.724 7.639 -4.108 1.00 0.00 C ATOM 669 C ILE A 44 -3.932 7.039 -3.396 1.00 0.00 C ATOM 670 O ILE A 44 -3.844 6.563 -2.264 1.00 0.00 O ATOM 671 CB ILE A 44 -1.868 6.500 -4.691 1.00 0.00 C ATOM 672 CG1 ILE A 44 -0.528 7.044 -5.190 1.00 0.00 C ATOM 673 CG2 ILE A 44 -2.614 5.800 -5.818 1.00 0.00 C ATOM 674 CD1 ILE A 44 0.308 6.015 -5.919 1.00 0.00 C ATOM 0 H ILE A 44 -1.366 7.967 -2.545 1.00 0.00 H new ATOM 0 HA ILE A 44 -3.065 8.279 -4.922 1.00 0.00 H new ATOM 0 HB ILE A 44 -1.673 5.772 -3.903 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -0.713 7.888 -5.855 1.00 0.00 H new ATOM 0 HG13 ILE A 44 0.039 7.426 -4.341 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -1.996 4.997 -6.220 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -3.545 5.383 -5.434 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -2.836 6.517 -6.608 1.00 0.00 H new ATOM 0 HD11 ILE A 44 1.243 6.470 -6.244 1.00 0.00 H new ATOM 0 HD12 ILE A 44 0.523 5.181 -5.251 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -0.240 5.651 -6.788 1.00 0.00 H new ATOM 686 N PRO A 45 -5.089 7.059 -4.074 1.00 0.00 N ATOM 687 CA PRO A 45 -6.337 6.518 -3.527 1.00 0.00 C ATOM 688 C PRO A 45 -6.313 4.997 -3.421 1.00 0.00 C ATOM 689 O PRO A 45 -5.991 4.303 -4.385 1.00 0.00 O ATOM 690 CB PRO A 45 -7.392 6.966 -4.542 1.00 0.00 C ATOM 691 CG PRO A 45 -6.642 7.140 -5.817 1.00 0.00 C ATOM 692 CD PRO A 45 -5.268 7.610 -5.428 1.00 0.00 C ATOM 0 HA PRO A 45 -6.524 6.870 -2.513 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -8.182 6.222 -4.646 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -7.869 7.896 -4.233 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -6.592 6.203 -6.371 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -7.134 7.866 -6.463 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -4.507 7.241 -6.116 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -5.200 8.698 -5.431 1.00 0.00 H new ATOM 700 N VAL A 46 -6.655 4.485 -2.243 1.00 0.00 N ATOM 701 CA VAL A 46 -6.674 3.046 -2.011 1.00 0.00 C ATOM 702 C VAL A 46 -7.568 2.338 -3.023 1.00 0.00 C ATOM 703 O VAL A 46 -7.447 1.132 -3.237 1.00 0.00 O ATOM 704 CB VAL A 46 -7.162 2.713 -0.589 1.00 0.00 C ATOM 705 CG1 VAL A 46 -7.234 1.207 -0.388 1.00 0.00 C ATOM 706 CG2 VAL A 46 -6.255 3.355 0.449 1.00 0.00 C ATOM 0 H VAL A 46 -6.923 5.046 -1.434 1.00 0.00 H new ATOM 0 HA VAL A 46 -5.649 2.693 -2.127 1.00 0.00 H new ATOM 0 HB VAL A 46 -8.165 3.120 -0.463 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -7.581 0.991 0.623 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -7.928 0.776 -1.110 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -6.245 0.773 -0.533 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -6.615 3.109 1.448 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -5.239 2.980 0.326 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -6.260 4.437 0.317 1.00 0.00 H new ATOM 716 N SER A 47 -8.466 3.097 -3.643 1.00 0.00 N ATOM 717 CA SER A 47 -9.384 2.542 -4.631 1.00 0.00 C ATOM 718 C SER A 47 -8.649 2.196 -5.923 1.00 0.00 C ATOM 719 O SER A 47 -8.907 1.163 -6.541 1.00 0.00 O ATOM 720 CB SER A 47 -10.513 3.532 -4.922 1.00 0.00 C ATOM 721 OG SER A 47 -11.418 3.609 -3.835 1.00 0.00 O ATOM 0 H SER A 47 -8.577 4.098 -3.479 1.00 0.00 H new ATOM 0 HA SER A 47 -9.810 1.627 -4.220 1.00 0.00 H new ATOM 0 HB2 SER A 47 -10.094 4.518 -5.120 1.00 0.00 H new ATOM 0 HB3 SER A 47 -11.046 3.226 -5.822 1.00 0.00 H new ATOM 0 HG SER A 47 -12.129 4.250 -4.046 1.00 0.00 H new ATOM 727 N LYS A 48 -7.732 3.069 -6.325 1.00 0.00 N ATOM 728 CA LYS A 48 -6.957 2.859 -7.542 1.00 0.00 C ATOM 729 C LYS A 48 -5.777 1.928 -7.281 1.00 0.00 C ATOM 730 O LYS A 48 -5.276 1.275 -8.196 1.00 0.00 O ATOM 731 CB LYS A 48 -6.454 4.197 -8.088 1.00 0.00 C ATOM 732 CG LYS A 48 -7.567 5.175 -8.422 1.00 0.00 C ATOM 733 CD LYS A 48 -8.033 5.020 -9.860 1.00 0.00 C ATOM 734 CE LYS A 48 -9.386 5.678 -10.081 1.00 0.00 C ATOM 735 NZ LYS A 48 -9.721 5.785 -11.528 1.00 0.00 N ATOM 0 H LYS A 48 -7.507 3.929 -5.825 1.00 0.00 H new ATOM 0 HA LYS A 48 -7.608 2.393 -8.282 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -5.790 4.653 -7.354 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -5.861 4.014 -8.984 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -8.408 5.015 -7.747 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -7.217 6.195 -8.260 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -7.298 5.463 -10.532 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -8.097 3.961 -10.111 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -10.158 5.101 -9.571 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -9.384 6.672 -9.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -10.520 6.439 -11.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -8.896 6.144 -12.050 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -9.981 4.847 -11.894 1.00 0.00 H new ATOM 749 N MET A 49 -5.338 1.873 -6.028 1.00 0.00 N ATOM 750 CA MET A 49 -4.218 1.019 -5.648 1.00 0.00 C ATOM 751 C MET A 49 -4.686 -0.410 -5.394 1.00 0.00 C ATOM 752 O MET A 49 -5.740 -0.632 -4.796 1.00 0.00 O ATOM 753 CB MET A 49 -3.529 1.572 -4.399 1.00 0.00 C ATOM 754 CG MET A 49 -2.657 2.787 -4.673 1.00 0.00 C ATOM 755 SD MET A 49 -1.336 2.982 -3.462 1.00 0.00 S ATOM 756 CE MET A 49 -2.203 3.841 -2.151 1.00 0.00 C ATOM 0 H MET A 49 -5.740 2.409 -5.259 1.00 0.00 H new ATOM 0 HA MET A 49 -3.505 1.008 -6.473 1.00 0.00 H new ATOM 0 HB2 MET A 49 -4.288 1.838 -3.663 1.00 0.00 H new ATOM 0 HB3 MET A 49 -2.916 0.788 -3.955 1.00 0.00 H new ATOM 0 HG2 MET A 49 -2.222 2.700 -5.669 1.00 0.00 H new ATOM 0 HG3 MET A 49 -3.278 3.682 -4.674 1.00 0.00 H new ATOM 0 HE1 MET A 49 -1.605 4.687 -1.813 1.00 0.00 H new ATOM 0 HE2 MET A 49 -3.162 4.200 -2.524 1.00 0.00 H new ATOM 0 HE3 MET A 49 -2.370 3.159 -1.317 1.00 0.00 H new ATOM 766 N LEU A 50 -3.897 -1.376 -5.851 1.00 0.00 N ATOM 767 CA LEU A 50 -4.231 -2.785 -5.673 1.00 0.00 C ATOM 768 C LEU A 50 -3.129 -3.514 -4.911 1.00 0.00 C ATOM 769 O LEU A 50 -2.105 -3.887 -5.484 1.00 0.00 O ATOM 770 CB LEU A 50 -4.453 -3.452 -7.032 1.00 0.00 C ATOM 771 CG LEU A 50 -5.438 -2.752 -7.970 1.00 0.00 C ATOM 772 CD1 LEU A 50 -5.333 -3.323 -9.375 1.00 0.00 C ATOM 773 CD2 LEU A 50 -6.860 -2.882 -7.444 1.00 0.00 C ATOM 0 H LEU A 50 -3.022 -1.210 -6.347 1.00 0.00 H new ATOM 0 HA LEU A 50 -5.151 -2.844 -5.091 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -3.491 -3.528 -7.539 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -4.805 -4.470 -6.862 1.00 0.00 H new ATOM 0 HG LEU A 50 -5.183 -1.693 -8.010 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -6.041 -2.813 -10.029 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -4.321 -3.177 -9.752 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -5.562 -4.388 -9.353 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -7.547 -2.378 -8.124 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -7.127 -3.936 -7.374 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -6.926 -2.425 -6.457 1.00 0.00 H new ATOM 785 N LEU A 51 -3.346 -3.715 -3.616 1.00 0.00 N ATOM 786 CA LEU A 51 -2.373 -4.401 -2.774 1.00 0.00 C ATOM 787 C LEU A 51 -2.134 -5.825 -3.268 1.00 0.00 C ATOM 788 O LEU A 51 -3.063 -6.628 -3.353 1.00 0.00 O ATOM 789 CB LEU A 51 -2.853 -4.427 -1.322 1.00 0.00 C ATOM 790 CG LEU A 51 -1.759 -4.443 -0.253 1.00 0.00 C ATOM 791 CD1 LEU A 51 -0.738 -5.530 -0.551 1.00 0.00 C ATOM 792 CD2 LEU A 51 -1.081 -3.083 -0.163 1.00 0.00 C ATOM 0 H LEU A 51 -4.188 -3.412 -3.126 1.00 0.00 H new ATOM 0 HA LEU A 51 -1.432 -3.854 -2.829 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -3.485 -3.555 -1.154 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -3.481 -5.307 -1.184 1.00 0.00 H new ATOM 0 HG LEU A 51 -2.222 -4.661 0.710 1.00 0.00 H new ATOM 0 HD11 LEU A 51 0.033 -5.527 0.220 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -1.233 -6.501 -0.564 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -0.280 -5.343 -1.522 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -0.306 -3.113 0.602 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -0.632 -2.836 -1.125 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -1.819 -2.325 0.098 1.00 0.00 H new ATOM 804 N LYS A 52 -0.882 -6.131 -3.590 1.00 0.00 N ATOM 805 CA LYS A 52 -0.518 -7.458 -4.072 1.00 0.00 C ATOM 806 C LYS A 52 0.874 -7.851 -3.587 1.00 0.00 C ATOM 807 O LYS A 52 1.577 -7.049 -2.973 1.00 0.00 O ATOM 808 CB LYS A 52 -0.567 -7.499 -5.601 1.00 0.00 C ATOM 809 CG LYS A 52 -1.937 -7.178 -6.175 1.00 0.00 C ATOM 810 CD LYS A 52 -1.889 -7.035 -7.687 1.00 0.00 C ATOM 811 CE LYS A 52 -3.258 -7.258 -8.311 1.00 0.00 C ATOM 812 NZ LYS A 52 -3.700 -8.674 -8.186 1.00 0.00 N ATOM 0 H LYS A 52 -0.102 -5.477 -3.526 1.00 0.00 H new ATOM 0 HA LYS A 52 -1.238 -8.172 -3.672 1.00 0.00 H new ATOM 0 HB2 LYS A 52 0.159 -6.790 -5.999 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -0.264 -8.490 -5.939 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -2.639 -7.967 -5.905 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -2.310 -6.254 -5.733 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -1.526 -6.041 -7.948 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -1.179 -7.752 -8.099 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -3.987 -6.606 -7.830 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -3.227 -6.979 -9.364 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -4.441 -8.870 -8.889 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -2.891 -9.306 -8.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -4.077 -8.837 -7.231 1.00 0.00 H new ATOM 826 N GLY A 53 1.266 -9.090 -3.869 1.00 0.00 N ATOM 827 CA GLY A 53 2.573 -9.566 -3.455 1.00 0.00 C ATOM 828 C GLY A 53 2.595 -10.015 -2.007 1.00 0.00 C ATOM 829 O GLY A 53 3.628 -9.941 -1.343 1.00 0.00 O ATOM 0 H GLY A 53 0.702 -9.772 -4.376 1.00 0.00 H new ATOM 0 HA2 GLY A 53 2.873 -10.396 -4.094 1.00 0.00 H new ATOM 0 HA3 GLY A 53 3.307 -8.773 -3.597 1.00 0.00 H new ATOM 833 N TRP A 54 1.452 -10.480 -1.517 1.00 0.00 N ATOM 834 CA TRP A 54 1.343 -10.942 -0.138 1.00 0.00 C ATOM 835 C TRP A 54 2.140 -12.225 0.072 1.00 0.00 C ATOM 836 O TRP A 54 2.801 -12.713 -0.845 1.00 0.00 O ATOM 837 CB TRP A 54 -0.123 -11.172 0.231 1.00 0.00 C ATOM 838 CG TRP A 54 -0.824 -9.927 0.685 1.00 0.00 C ATOM 839 CD1 TRP A 54 -1.861 -9.297 0.059 1.00 0.00 C ATOM 840 CD2 TRP A 54 -0.537 -9.162 1.860 1.00 0.00 C ATOM 841 NE1 TRP A 54 -2.236 -8.185 0.775 1.00 0.00 N ATOM 842 CE2 TRP A 54 -1.440 -8.081 1.884 1.00 0.00 C ATOM 843 CE3 TRP A 54 0.393 -9.286 2.896 1.00 0.00 C ATOM 844 CZ2 TRP A 54 -1.437 -7.132 2.903 1.00 0.00 C ATOM 845 CZ3 TRP A 54 0.395 -8.343 3.906 1.00 0.00 C ATOM 846 CH2 TRP A 54 -0.516 -7.278 3.904 1.00 0.00 C ATOM 0 H TRP A 54 0.587 -10.547 -2.054 1.00 0.00 H new ATOM 0 HA TRP A 54 1.757 -10.170 0.510 1.00 0.00 H new ATOM 0 HB2 TRP A 54 -0.648 -11.581 -0.632 1.00 0.00 H new ATOM 0 HB3 TRP A 54 -0.178 -11.920 1.022 1.00 0.00 H new ATOM 0 HD1 TRP A 54 -2.319 -9.624 -0.863 1.00 0.00 H new ATOM 0 HE1 TRP A 54 -2.986 -7.542 0.521 1.00 0.00 H new ATOM 0 HE3 TRP A 54 1.098 -10.104 2.907 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 -2.137 -6.310 2.903 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 1.111 -8.428 4.710 1.00 0.00 H new ATOM 0 HH2 TRP A 54 -0.490 -6.558 4.709 1.00 0.00 H new ATOM 857 N LYS A 55 2.074 -12.766 1.283 1.00 0.00 N ATOM 858 CA LYS A 55 2.788 -13.994 1.613 1.00 0.00 C ATOM 859 C LYS A 55 2.015 -15.219 1.135 1.00 0.00 C ATOM 860 O LYS A 55 2.544 -16.052 0.398 1.00 0.00 O ATOM 861 CB LYS A 55 3.022 -14.082 3.123 1.00 0.00 C ATOM 862 CG LYS A 55 3.797 -15.318 3.547 1.00 0.00 C ATOM 863 CD LYS A 55 4.261 -15.217 4.990 1.00 0.00 C ATOM 864 CE LYS A 55 5.089 -16.426 5.395 1.00 0.00 C ATOM 865 NZ LYS A 55 6.432 -16.419 4.751 1.00 0.00 N ATOM 0 H LYS A 55 1.533 -12.373 2.053 1.00 0.00 H new ATOM 0 HA LYS A 55 3.751 -13.973 1.103 1.00 0.00 H new ATOM 0 HB2 LYS A 55 3.563 -13.194 3.451 1.00 0.00 H new ATOM 0 HB3 LYS A 55 2.059 -14.075 3.633 1.00 0.00 H new ATOM 0 HG2 LYS A 55 3.170 -16.201 3.427 1.00 0.00 H new ATOM 0 HG3 LYS A 55 4.660 -15.449 2.895 1.00 0.00 H new ATOM 0 HD2 LYS A 55 4.851 -14.310 5.121 1.00 0.00 H new ATOM 0 HD3 LYS A 55 3.395 -15.131 5.647 1.00 0.00 H new ATOM 0 HE2 LYS A 55 5.206 -16.440 6.479 1.00 0.00 H new ATOM 0 HE3 LYS A 55 4.559 -17.338 5.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 7.002 -17.202 5.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 6.325 -16.534 3.723 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 6.908 -15.516 4.951 1.00 0.00 H new ATOM 879 N THR A 56 0.759 -15.322 1.557 1.00 0.00 N ATOM 880 CA THR A 56 -0.087 -16.444 1.172 1.00 0.00 C ATOM 881 C THR A 56 -1.220 -15.991 0.258 1.00 0.00 C ATOM 882 O THR A 56 -2.047 -15.164 0.642 1.00 0.00 O ATOM 883 CB THR A 56 -0.687 -17.145 2.405 1.00 0.00 C ATOM 884 OG1 THR A 56 -1.443 -18.291 1.998 1.00 0.00 O ATOM 885 CG2 THR A 56 -1.580 -16.194 3.187 1.00 0.00 C ATOM 0 H THR A 56 0.305 -14.641 2.166 1.00 0.00 H new ATOM 0 HA THR A 56 0.549 -17.149 0.636 1.00 0.00 H new ATOM 0 HB THR A 56 0.133 -17.462 3.050 1.00 0.00 H new ATOM 0 HG1 THR A 56 -1.820 -18.732 2.788 1.00 0.00 H new ATOM 0 HG21 THR A 56 -1.992 -16.712 4.053 1.00 0.00 H new ATOM 0 HG22 THR A 56 -0.995 -15.337 3.521 1.00 0.00 H new ATOM 0 HG23 THR A 56 -2.394 -15.851 2.548 1.00 0.00 H new ATOM 893 N GLY A 57 -1.253 -16.538 -0.953 1.00 0.00 N ATOM 894 CA GLY A 57 -2.290 -16.177 -1.902 1.00 0.00 C ATOM 895 C GLY A 57 -2.690 -14.719 -1.798 1.00 0.00 C ATOM 896 O GLY A 57 -1.837 -13.831 -1.823 1.00 0.00 O ATOM 0 H GLY A 57 -0.580 -17.225 -1.294 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -1.940 -16.383 -2.914 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -3.166 -16.804 -1.734 1.00 0.00 H new ATOM 900 N ASP A 58 -3.989 -14.470 -1.682 1.00 0.00 N ATOM 901 CA ASP A 58 -4.501 -13.109 -1.574 1.00 0.00 C ATOM 902 C ASP A 58 -5.050 -12.844 -0.176 1.00 0.00 C ATOM 903 O ASP A 58 -5.909 -13.578 0.315 1.00 0.00 O ATOM 904 CB ASP A 58 -5.592 -12.867 -2.618 1.00 0.00 C ATOM 905 CG ASP A 58 -5.825 -11.392 -2.882 1.00 0.00 C ATOM 906 OD1 ASP A 58 -4.837 -10.627 -2.888 1.00 0.00 O ATOM 907 OD2 ASP A 58 -6.994 -11.003 -3.082 1.00 0.00 O ATOM 0 H ASP A 58 -4.708 -15.193 -1.660 1.00 0.00 H new ATOM 0 HA ASP A 58 -3.675 -12.421 -1.757 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -5.315 -13.360 -3.550 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -6.522 -13.324 -2.280 1.00 0.00 H new ATOM 912 N VAL A 59 -4.548 -11.792 0.462 1.00 0.00 N ATOM 913 CA VAL A 59 -4.988 -11.430 1.804 1.00 0.00 C ATOM 914 C VAL A 59 -6.103 -10.391 1.755 1.00 0.00 C ATOM 915 O VAL A 59 -6.085 -9.485 0.923 1.00 0.00 O ATOM 916 CB VAL A 59 -3.824 -10.877 2.647 1.00 0.00 C ATOM 917 CG1 VAL A 59 -4.304 -10.501 4.040 1.00 0.00 C ATOM 918 CG2 VAL A 59 -2.691 -11.890 2.719 1.00 0.00 C ATOM 0 H VAL A 59 -3.836 -11.175 0.071 1.00 0.00 H new ATOM 0 HA VAL A 59 -5.363 -12.341 2.270 1.00 0.00 H new ATOM 0 HB VAL A 59 -3.445 -9.976 2.165 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -3.467 -10.112 4.621 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -5.079 -9.738 3.964 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -4.711 -11.383 4.535 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -1.877 -11.483 3.318 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -3.054 -12.810 3.177 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -2.329 -12.104 1.713 1.00 0.00 H new ATOM 928 N GLU A 60 -7.073 -10.530 2.654 1.00 0.00 N ATOM 929 CA GLU A 60 -8.198 -9.603 2.713 1.00 0.00 C ATOM 930 C GLU A 60 -7.969 -8.537 3.780 1.00 0.00 C ATOM 931 O GLU A 60 -7.287 -8.778 4.777 1.00 0.00 O ATOM 932 CB GLU A 60 -9.496 -10.359 3.001 1.00 0.00 C ATOM 933 CG GLU A 60 -9.488 -11.097 4.329 1.00 0.00 C ATOM 934 CD GLU A 60 -10.710 -11.977 4.515 1.00 0.00 C ATOM 935 OE1 GLU A 60 -11.835 -11.486 4.286 1.00 0.00 O ATOM 936 OE2 GLU A 60 -10.539 -13.156 4.889 1.00 0.00 O ATOM 0 H GLU A 60 -7.103 -11.275 3.351 1.00 0.00 H new ATOM 0 HA GLU A 60 -8.281 -9.110 1.744 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -10.327 -9.654 2.992 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -9.676 -11.074 2.198 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -8.590 -11.711 4.394 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -9.439 -10.373 5.142 1.00 0.00 H new ATOM 943 N ASP A 61 -8.542 -7.358 3.564 1.00 0.00 N ATOM 944 CA ASP A 61 -8.402 -6.255 4.507 1.00 0.00 C ATOM 945 C ASP A 61 -8.891 -6.660 5.894 1.00 0.00 C ATOM 946 O ASP A 61 -8.605 -5.987 6.884 1.00 0.00 O ATOM 947 CB ASP A 61 -9.180 -5.033 4.015 1.00 0.00 C ATOM 948 CG ASP A 61 -10.523 -5.404 3.419 1.00 0.00 C ATOM 949 OD1 ASP A 61 -11.508 -5.487 4.182 1.00 0.00 O ATOM 950 OD2 ASP A 61 -10.590 -5.613 2.189 1.00 0.00 O ATOM 0 H ASP A 61 -9.108 -7.142 2.744 1.00 0.00 H new ATOM 0 HA ASP A 61 -7.344 -6.000 4.575 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -9.332 -4.344 4.846 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -8.587 -4.505 3.268 1.00 0.00 H new ATOM 955 N SER A 62 -9.629 -7.763 5.956 1.00 0.00 N ATOM 956 CA SER A 62 -10.162 -8.255 7.222 1.00 0.00 C ATOM 957 C SER A 62 -9.132 -9.116 7.947 1.00 0.00 C ATOM 958 O SER A 62 -9.453 -9.806 8.916 1.00 0.00 O ATOM 959 CB SER A 62 -11.440 -9.063 6.981 1.00 0.00 C ATOM 960 OG SER A 62 -12.108 -9.335 8.201 1.00 0.00 O ATOM 0 H SER A 62 -9.872 -8.333 5.146 1.00 0.00 H new ATOM 0 HA SER A 62 -10.396 -7.395 7.849 1.00 0.00 H new ATOM 0 HB2 SER A 62 -12.103 -8.511 6.315 1.00 0.00 H new ATOM 0 HB3 SER A 62 -11.193 -10.000 6.481 1.00 0.00 H new ATOM 0 HG SER A 62 -11.453 -9.594 8.882 1.00 0.00 H new ATOM 966 N THR A 63 -7.892 -9.070 7.471 1.00 0.00 N ATOM 967 CA THR A 63 -6.814 -9.845 8.072 1.00 0.00 C ATOM 968 C THR A 63 -5.799 -8.937 8.757 1.00 0.00 C ATOM 969 O THR A 63 -5.525 -7.832 8.290 1.00 0.00 O ATOM 970 CB THR A 63 -6.087 -10.706 7.021 1.00 0.00 C ATOM 971 OG1 THR A 63 -7.040 -11.454 6.257 1.00 0.00 O ATOM 972 CG2 THR A 63 -5.104 -11.657 7.686 1.00 0.00 C ATOM 0 H THR A 63 -7.609 -8.504 6.671 1.00 0.00 H new ATOM 0 HA THR A 63 -7.272 -10.499 8.814 1.00 0.00 H new ATOM 0 HB THR A 63 -5.533 -10.041 6.359 1.00 0.00 H new ATOM 0 HG1 THR A 63 -6.571 -11.997 5.590 1.00 0.00 H new ATOM 0 HG21 THR A 63 -4.603 -12.254 6.924 1.00 0.00 H new ATOM 0 HG22 THR A 63 -4.363 -11.084 8.243 1.00 0.00 H new ATOM 0 HG23 THR A 63 -5.640 -12.316 8.369 1.00 0.00 H new ATOM 980 N VAL A 64 -5.244 -9.410 9.869 1.00 0.00 N ATOM 981 CA VAL A 64 -4.258 -8.641 10.618 1.00 0.00 C ATOM 982 C VAL A 64 -2.843 -9.127 10.323 1.00 0.00 C ATOM 983 O VAL A 64 -2.618 -10.316 10.095 1.00 0.00 O ATOM 984 CB VAL A 64 -4.513 -8.727 12.134 1.00 0.00 C ATOM 985 CG1 VAL A 64 -4.317 -10.153 12.629 1.00 0.00 C ATOM 986 CG2 VAL A 64 -3.604 -7.765 12.883 1.00 0.00 C ATOM 0 H VAL A 64 -5.461 -10.322 10.271 1.00 0.00 H new ATOM 0 HA VAL A 64 -4.357 -7.603 10.299 1.00 0.00 H new ATOM 0 HB VAL A 64 -5.546 -8.439 12.327 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -4.501 -10.194 13.702 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -5.014 -10.815 12.115 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -3.295 -10.472 12.424 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -3.798 -7.839 13.953 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -2.563 -8.019 12.685 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -3.799 -6.746 12.549 1.00 0.00 H new ATOM 996 N LEU A 65 -1.892 -8.199 10.330 1.00 0.00 N ATOM 997 CA LEU A 65 -0.497 -8.532 10.064 1.00 0.00 C ATOM 998 C LEU A 65 -0.018 -9.650 10.985 1.00 0.00 C ATOM 999 O LEU A 65 0.409 -10.709 10.525 1.00 0.00 O ATOM 1000 CB LEU A 65 0.386 -7.295 10.243 1.00 0.00 C ATOM 1001 CG LEU A 65 -0.007 -6.066 9.425 1.00 0.00 C ATOM 1002 CD1 LEU A 65 0.377 -4.790 10.159 1.00 0.00 C ATOM 1003 CD2 LEU A 65 0.645 -6.109 8.050 1.00 0.00 C ATOM 0 H LEU A 65 -2.062 -7.211 10.517 1.00 0.00 H new ATOM 0 HA LEU A 65 -0.422 -8.879 9.033 1.00 0.00 H new ATOM 0 HB2 LEU A 65 0.383 -7.021 11.298 1.00 0.00 H new ATOM 0 HB3 LEU A 65 1.411 -7.565 9.987 1.00 0.00 H new ATOM 0 HG LEU A 65 -1.089 -6.073 9.293 1.00 0.00 H new ATOM 0 HD11 LEU A 65 0.089 -3.925 9.561 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -0.137 -4.754 11.120 1.00 0.00 H new ATOM 0 HD13 LEU A 65 1.454 -4.775 10.323 1.00 0.00 H new ATOM 0 HD21 LEU A 65 0.354 -5.226 7.481 1.00 0.00 H new ATOM 0 HD22 LEU A 65 1.729 -6.127 8.162 1.00 0.00 H new ATOM 0 HD23 LEU A 65 0.320 -7.005 7.521 1.00 0.00 H new ATOM 1015 N LYS A 66 -0.095 -9.409 12.290 1.00 0.00 N ATOM 1016 CA LYS A 66 0.326 -10.395 13.277 1.00 0.00 C ATOM 1017 C LYS A 66 -0.134 -11.794 12.879 1.00 0.00 C ATOM 1018 O LYS A 66 0.452 -12.793 13.296 1.00 0.00 O ATOM 1019 CB LYS A 66 -0.232 -10.037 14.656 1.00 0.00 C ATOM 1020 CG LYS A 66 -1.694 -10.407 14.836 1.00 0.00 C ATOM 1021 CD LYS A 66 -2.299 -9.717 16.047 1.00 0.00 C ATOM 1022 CE LYS A 66 -1.576 -10.102 17.328 1.00 0.00 C ATOM 1023 NZ LYS A 66 -1.951 -11.469 17.786 1.00 0.00 N ATOM 0 H LYS A 66 -0.446 -8.538 12.688 1.00 0.00 H new ATOM 0 HA LYS A 66 1.415 -10.388 13.319 1.00 0.00 H new ATOM 0 HB2 LYS A 66 0.359 -10.543 15.420 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -0.114 -8.966 14.819 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -2.253 -10.131 13.942 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -1.786 -11.487 14.948 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -2.252 -8.636 15.912 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -3.353 -9.982 16.129 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -0.499 -10.056 17.165 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -1.812 -9.380 18.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -1.437 -11.695 18.662 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -2.975 -11.506 17.966 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -1.703 -12.162 17.051 1.00 0.00 H new ATOM 1037 N SER A 67 -1.185 -11.858 12.068 1.00 0.00 N ATOM 1038 CA SER A 67 -1.724 -13.135 11.615 1.00 0.00 C ATOM 1039 C SER A 67 -0.731 -13.853 10.707 1.00 0.00 C ATOM 1040 O SER A 67 -0.425 -15.029 10.909 1.00 0.00 O ATOM 1041 CB SER A 67 -3.046 -12.921 10.875 1.00 0.00 C ATOM 1042 OG SER A 67 -3.736 -14.146 10.698 1.00 0.00 O ATOM 0 H SER A 67 -1.680 -11.041 11.711 1.00 0.00 H new ATOM 0 HA SER A 67 -1.903 -13.757 12.492 1.00 0.00 H new ATOM 0 HB2 SER A 67 -3.671 -12.226 11.435 1.00 0.00 H new ATOM 0 HB3 SER A 67 -2.853 -12.465 9.904 1.00 0.00 H new ATOM 0 HG SER A 67 -4.578 -13.982 10.224 1.00 0.00 H new ATOM 1048 N LEU A 68 -0.229 -13.138 9.707 1.00 0.00 N ATOM 1049 CA LEU A 68 0.731 -13.705 8.766 1.00 0.00 C ATOM 1050 C LEU A 68 2.151 -13.616 9.317 1.00 0.00 C ATOM 1051 O LEU A 68 3.037 -14.364 8.902 1.00 0.00 O ATOM 1052 CB LEU A 68 0.647 -12.980 7.422 1.00 0.00 C ATOM 1053 CG LEU A 68 -0.736 -12.927 6.773 1.00 0.00 C ATOM 1054 CD1 LEU A 68 -0.847 -11.724 5.850 1.00 0.00 C ATOM 1055 CD2 LEU A 68 -1.018 -14.214 6.011 1.00 0.00 C ATOM 0 H LEU A 68 -0.471 -12.164 9.526 1.00 0.00 H new ATOM 0 HA LEU A 68 0.482 -14.756 8.621 1.00 0.00 H new ATOM 0 HB2 LEU A 68 1.001 -11.958 7.560 1.00 0.00 H new ATOM 0 HB3 LEU A 68 1.334 -13.464 6.727 1.00 0.00 H new ATOM 0 HG LEU A 68 -1.482 -12.824 7.561 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -1.838 -11.703 5.397 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -0.690 -10.810 6.423 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -0.092 -11.795 5.067 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -2.007 -14.158 5.556 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -0.267 -14.348 5.232 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -0.982 -15.059 6.698 1.00 0.00 H new ATOM 1067 N HIS A 69 2.359 -12.698 10.256 1.00 0.00 N ATOM 1068 CA HIS A 69 3.671 -12.514 10.866 1.00 0.00 C ATOM 1069 C HIS A 69 4.728 -12.222 9.805 1.00 0.00 C ATOM 1070 O HIS A 69 5.764 -12.886 9.747 1.00 0.00 O ATOM 1071 CB HIS A 69 4.064 -13.756 11.666 1.00 0.00 C ATOM 1072 CG HIS A 69 3.535 -13.759 13.067 1.00 0.00 C ATOM 1073 ND1 HIS A 69 2.454 -14.372 13.604 1.00 0.00 N flip ATOM 1074 CD2 HIS A 69 4.134 -13.068 14.100 1.00 0.00 C flip ATOM 1075 CE1 HIS A 69 2.421 -14.045 14.938 1.00 0.00 C flip ATOM 1076 NE2 HIS A 69 3.445 -13.258 15.211 1.00 0.00 N flip ATOM 0 H HIS A 69 1.637 -12.071 10.610 1.00 0.00 H new ATOM 0 HA HIS A 69 3.614 -11.660 11.541 1.00 0.00 H new ATOM 0 HB2 HIS A 69 3.700 -14.643 11.147 1.00 0.00 H new ATOM 0 HB3 HIS A 69 5.151 -13.829 11.697 1.00 0.00 H new ATOM 0 HD2 HIS A 69 5.026 -12.466 14.014 1.00 0.00 H new ATOM 0 HE1 HIS A 69 1.678 -14.378 15.648 1.00 0.00 H new ATOM 0 HE2 HIS A 69 3.667 -12.863 16.125 1.00 0.00 H new ATOM 1085 N LEU A 70 4.459 -11.227 8.968 1.00 0.00 N ATOM 1086 CA LEU A 70 5.387 -10.847 7.908 1.00 0.00 C ATOM 1087 C LEU A 70 6.810 -10.730 8.445 1.00 0.00 C ATOM 1088 O LEU A 70 7.039 -10.304 9.577 1.00 0.00 O ATOM 1089 CB LEU A 70 4.957 -9.522 7.277 1.00 0.00 C ATOM 1090 CG LEU A 70 3.726 -9.577 6.372 1.00 0.00 C ATOM 1091 CD1 LEU A 70 3.675 -10.899 5.621 1.00 0.00 C ATOM 1092 CD2 LEU A 70 2.456 -9.374 7.185 1.00 0.00 C ATOM 0 H LEU A 70 3.606 -10.668 9.002 1.00 0.00 H new ATOM 0 HA LEU A 70 5.369 -11.627 7.147 1.00 0.00 H new ATOM 0 HB2 LEU A 70 4.763 -8.808 8.077 1.00 0.00 H new ATOM 0 HB3 LEU A 70 5.793 -9.131 6.696 1.00 0.00 H new ATOM 0 HG LEU A 70 3.799 -8.770 5.643 1.00 0.00 H new ATOM 0 HD11 LEU A 70 2.792 -10.921 4.982 1.00 0.00 H new ATOM 0 HD12 LEU A 70 4.570 -11.004 5.008 1.00 0.00 H new ATOM 0 HD13 LEU A 70 3.626 -11.721 6.335 1.00 0.00 H new ATOM 0 HD21 LEU A 70 1.590 -9.416 6.524 1.00 0.00 H new ATOM 0 HD22 LEU A 70 2.377 -10.158 7.938 1.00 0.00 H new ATOM 0 HD23 LEU A 70 2.490 -8.402 7.676 1.00 0.00 H new ATOM 1104 N PRO A 71 7.790 -11.115 7.614 1.00 0.00 N ATOM 1105 CA PRO A 71 9.208 -11.059 7.983 1.00 0.00 C ATOM 1106 C PRO A 71 9.724 -9.628 8.088 1.00 0.00 C ATOM 1107 O PRO A 71 9.216 -8.724 7.425 1.00 0.00 O ATOM 1108 CB PRO A 71 9.902 -11.796 6.835 1.00 0.00 C ATOM 1109 CG PRO A 71 8.979 -11.645 5.675 1.00 0.00 C ATOM 1110 CD PRO A 71 7.590 -11.632 6.250 1.00 0.00 C ATOM 0 HA PRO A 71 9.392 -11.499 8.963 1.00 0.00 H new ATOM 0 HB2 PRO A 71 10.880 -11.365 6.621 1.00 0.00 H new ATOM 0 HB3 PRO A 71 10.063 -12.846 7.079 1.00 0.00 H new ATOM 0 HG2 PRO A 71 9.184 -10.724 5.130 1.00 0.00 H new ATOM 0 HG3 PRO A 71 9.102 -12.467 4.969 1.00 0.00 H new ATOM 0 HD2 PRO A 71 6.922 -10.993 5.672 1.00 0.00 H new ATOM 0 HD3 PRO A 71 7.149 -12.629 6.259 1.00 0.00 H new ATOM 1118 N LYS A 72 10.737 -9.430 8.924 1.00 0.00 N ATOM 1119 CA LYS A 72 11.325 -8.109 9.115 1.00 0.00 C ATOM 1120 C LYS A 72 11.427 -7.362 7.789 1.00 0.00 C ATOM 1121 O LYS A 72 10.996 -6.216 7.676 1.00 0.00 O ATOM 1122 CB LYS A 72 12.711 -8.232 9.752 1.00 0.00 C ATOM 1123 CG LYS A 72 13.336 -6.895 10.111 1.00 0.00 C ATOM 1124 CD LYS A 72 14.828 -7.028 10.367 1.00 0.00 C ATOM 1125 CE LYS A 72 15.109 -7.528 11.775 1.00 0.00 C ATOM 1126 NZ LYS A 72 16.539 -7.905 11.954 1.00 0.00 N ATOM 0 H LYS A 72 11.168 -10.168 9.481 1.00 0.00 H new ATOM 0 HA LYS A 72 10.675 -7.542 9.782 1.00 0.00 H new ATOM 0 HB2 LYS A 72 12.635 -8.842 10.652 1.00 0.00 H new ATOM 0 HB3 LYS A 72 13.372 -8.760 9.065 1.00 0.00 H new ATOM 0 HG2 LYS A 72 13.167 -6.184 9.302 1.00 0.00 H new ATOM 0 HG3 LYS A 72 12.848 -6.491 10.998 1.00 0.00 H new ATOM 0 HD2 LYS A 72 15.263 -7.716 9.642 1.00 0.00 H new ATOM 0 HD3 LYS A 72 15.311 -6.062 10.219 1.00 0.00 H new ATOM 0 HE2 LYS A 72 14.845 -6.754 12.495 1.00 0.00 H new ATOM 0 HE3 LYS A 72 14.477 -8.390 11.987 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 16.690 -8.241 12.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 16.785 -8.662 11.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 17.141 -7.076 11.776 1.00 0.00 H new ATOM 1140 N ASN A 73 12.001 -8.021 6.787 1.00 0.00 N ATOM 1141 CA ASN A 73 12.159 -7.420 5.468 1.00 0.00 C ATOM 1142 C ASN A 73 11.008 -7.815 4.548 1.00 0.00 C ATOM 1143 O ASN A 73 10.898 -8.969 4.136 1.00 0.00 O ATOM 1144 CB ASN A 73 13.492 -7.845 4.848 1.00 0.00 C ATOM 1145 CG ASN A 73 14.656 -7.673 5.804 1.00 0.00 C ATOM 1146 OD1 ASN A 73 14.545 -6.982 6.817 1.00 0.00 O ATOM 1147 ND2 ASN A 73 15.781 -8.303 5.486 1.00 0.00 N ATOM 0 H ASN A 73 12.364 -8.971 6.864 1.00 0.00 H new ATOM 0 HA ASN A 73 12.150 -6.336 5.586 1.00 0.00 H new ATOM 0 HB2 ASN A 73 13.430 -8.889 4.540 1.00 0.00 H new ATOM 0 HB3 ASN A 73 13.675 -7.257 3.948 1.00 0.00 H new ATOM 0 HD21 ASN A 73 16.598 -8.225 6.092 1.00 0.00 H new ATOM 0 HD22 ASN A 73 15.828 -8.865 4.636 1.00 0.00 H new ATOM 1154 N ASN A 74 10.153 -6.848 4.230 1.00 0.00 N ATOM 1155 CA ASN A 74 9.010 -7.095 3.358 1.00 0.00 C ATOM 1156 C ASN A 74 9.127 -6.292 2.067 1.00 0.00 C ATOM 1157 O ASN A 74 9.666 -5.185 2.059 1.00 0.00 O ATOM 1158 CB ASN A 74 7.708 -6.739 4.078 1.00 0.00 C ATOM 1159 CG ASN A 74 7.380 -7.709 5.196 1.00 0.00 C ATOM 1160 OD1 ASN A 74 7.116 -8.887 4.953 1.00 0.00 O ATOM 1161 ND2 ASN A 74 7.396 -7.218 6.430 1.00 0.00 N ATOM 0 H ASN A 74 10.230 -5.887 4.563 1.00 0.00 H new ATOM 0 HA ASN A 74 8.999 -8.155 3.105 1.00 0.00 H new ATOM 0 HB2 ASN A 74 7.786 -5.731 4.487 1.00 0.00 H new ATOM 0 HB3 ASN A 74 6.889 -6.729 3.358 1.00 0.00 H new ATOM 0 HD21 ASN A 74 7.184 -7.824 7.223 1.00 0.00 H new ATOM 0 HD22 ASN A 74 7.620 -6.235 6.585 1.00 0.00 H new ATOM 1168 N SER A 75 8.618 -6.856 0.977 1.00 0.00 N ATOM 1169 CA SER A 75 8.668 -6.194 -0.322 1.00 0.00 C ATOM 1170 C SER A 75 7.318 -6.278 -1.026 1.00 0.00 C ATOM 1171 O SER A 75 6.956 -7.317 -1.580 1.00 0.00 O ATOM 1172 CB SER A 75 9.753 -6.824 -1.198 1.00 0.00 C ATOM 1173 OG SER A 75 9.453 -8.179 -1.485 1.00 0.00 O ATOM 0 H SER A 75 8.166 -7.770 0.967 1.00 0.00 H new ATOM 0 HA SER A 75 8.908 -5.144 -0.158 1.00 0.00 H new ATOM 0 HB2 SER A 75 9.845 -6.264 -2.128 1.00 0.00 H new ATOM 0 HB3 SER A 75 10.716 -6.761 -0.692 1.00 0.00 H new ATOM 0 HG SER A 75 8.486 -8.282 -1.603 1.00 0.00 H new ATOM 1179 N LEU A 76 6.576 -5.176 -1.001 1.00 0.00 N ATOM 1180 CA LEU A 76 5.264 -5.122 -1.638 1.00 0.00 C ATOM 1181 C LEU A 76 5.301 -4.249 -2.888 1.00 0.00 C ATOM 1182 O LEU A 76 6.306 -3.598 -3.173 1.00 0.00 O ATOM 1183 CB LEU A 76 4.221 -4.584 -0.656 1.00 0.00 C ATOM 1184 CG LEU A 76 3.664 -5.592 0.350 1.00 0.00 C ATOM 1185 CD1 LEU A 76 2.777 -4.894 1.369 1.00 0.00 C ATOM 1186 CD2 LEU A 76 2.893 -6.691 -0.367 1.00 0.00 C ATOM 0 H LEU A 76 6.860 -4.308 -0.547 1.00 0.00 H new ATOM 0 HA LEU A 76 4.988 -6.134 -1.933 1.00 0.00 H new ATOM 0 HB2 LEU A 76 4.665 -3.756 -0.103 1.00 0.00 H new ATOM 0 HB3 LEU A 76 3.389 -4.175 -1.229 1.00 0.00 H new ATOM 0 HG LEU A 76 4.501 -6.049 0.879 1.00 0.00 H new ATOM 0 HD11 LEU A 76 2.390 -5.627 2.077 1.00 0.00 H new ATOM 0 HD12 LEU A 76 3.359 -4.144 1.905 1.00 0.00 H new ATOM 0 HD13 LEU A 76 1.946 -4.410 0.857 1.00 0.00 H new ATOM 0 HD21 LEU A 76 2.504 -7.399 0.365 1.00 0.00 H new ATOM 0 HD22 LEU A 76 2.065 -6.251 -0.923 1.00 0.00 H new ATOM 0 HD23 LEU A 76 3.557 -7.211 -1.057 1.00 0.00 H new ATOM 1198 N TYR A 77 4.198 -4.239 -3.628 1.00 0.00 N ATOM 1199 CA TYR A 77 4.104 -3.446 -4.848 1.00 0.00 C ATOM 1200 C TYR A 77 2.651 -3.107 -5.167 1.00 0.00 C ATOM 1201 O TYR A 77 1.745 -3.902 -4.913 1.00 0.00 O ATOM 1202 CB TYR A 77 4.733 -4.199 -6.021 1.00 0.00 C ATOM 1203 CG TYR A 77 4.129 -5.566 -6.257 1.00 0.00 C ATOM 1204 CD1 TYR A 77 4.627 -6.688 -5.606 1.00 0.00 C ATOM 1205 CD2 TYR A 77 3.062 -5.735 -7.130 1.00 0.00 C ATOM 1206 CE1 TYR A 77 4.080 -7.938 -5.819 1.00 0.00 C ATOM 1207 CE2 TYR A 77 2.507 -6.981 -7.347 1.00 0.00 C ATOM 1208 CZ TYR A 77 3.020 -8.080 -6.689 1.00 0.00 C ATOM 1209 OH TYR A 77 2.471 -9.323 -6.904 1.00 0.00 O ATOM 0 H TYR A 77 3.357 -4.771 -3.405 1.00 0.00 H new ATOM 0 HA TYR A 77 4.649 -2.515 -4.689 1.00 0.00 H new ATOM 0 HB2 TYR A 77 4.624 -3.601 -6.926 1.00 0.00 H new ATOM 0 HB3 TYR A 77 5.802 -4.310 -5.839 1.00 0.00 H new ATOM 0 HD1 TYR A 77 5.456 -6.581 -4.922 1.00 0.00 H new ATOM 0 HD2 TYR A 77 2.659 -4.877 -7.648 1.00 0.00 H new ATOM 0 HE1 TYR A 77 4.481 -8.800 -5.307 1.00 0.00 H new ATOM 0 HE2 TYR A 77 1.676 -7.094 -8.028 1.00 0.00 H new ATOM 0 HH TYR A 77 1.732 -9.248 -7.544 1.00 0.00 H new ATOM 1219 N VAL A 78 2.435 -1.921 -5.726 1.00 0.00 N ATOM 1220 CA VAL A 78 1.093 -1.476 -6.082 1.00 0.00 C ATOM 1221 C VAL A 78 0.893 -1.489 -7.593 1.00 0.00 C ATOM 1222 O VAL A 78 1.787 -1.116 -8.353 1.00 0.00 O ATOM 1223 CB VAL A 78 0.813 -0.058 -5.551 1.00 0.00 C ATOM 1224 CG1 VAL A 78 -0.502 0.470 -6.105 1.00 0.00 C ATOM 1225 CG2 VAL A 78 0.800 -0.052 -4.029 1.00 0.00 C ATOM 0 H VAL A 78 3.173 -1.251 -5.942 1.00 0.00 H new ATOM 0 HA VAL A 78 0.395 -2.174 -5.620 1.00 0.00 H new ATOM 0 HB VAL A 78 1.613 0.602 -5.888 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -0.683 1.473 -5.719 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -0.451 0.504 -7.193 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -1.316 -0.188 -5.800 1.00 0.00 H new ATOM 0 HG21 VAL A 78 0.601 0.958 -3.671 1.00 0.00 H new ATOM 0 HG22 VAL A 78 0.022 -0.725 -3.669 1.00 0.00 H new ATOM 0 HG23 VAL A 78 1.768 -0.385 -3.656 1.00 0.00 H new ATOM 1235 N LEU A 79 -0.287 -1.921 -8.024 1.00 0.00 N ATOM 1236 CA LEU A 79 -0.607 -1.983 -9.446 1.00 0.00 C ATOM 1237 C LEU A 79 -1.877 -1.196 -9.753 1.00 0.00 C ATOM 1238 O LEU A 79 -2.986 -1.647 -9.463 1.00 0.00 O ATOM 1239 CB LEU A 79 -0.775 -3.438 -9.888 1.00 0.00 C ATOM 1240 CG LEU A 79 0.418 -4.359 -9.633 1.00 0.00 C ATOM 1241 CD1 LEU A 79 0.087 -5.787 -10.041 1.00 0.00 C ATOM 1242 CD2 LEU A 79 1.646 -3.860 -10.380 1.00 0.00 C ATOM 0 H LEU A 79 -1.038 -2.234 -7.409 1.00 0.00 H new ATOM 0 HA LEU A 79 0.218 -1.535 -9.999 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -1.644 -3.853 -9.378 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -0.995 -3.449 -10.955 1.00 0.00 H new ATOM 0 HG LEU A 79 0.638 -4.350 -8.565 1.00 0.00 H new ATOM 0 HD11 LEU A 79 0.948 -6.428 -9.852 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -0.765 -6.143 -9.461 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -0.160 -5.814 -11.102 1.00 0.00 H new ATOM 0 HD21 LEU A 79 2.486 -4.528 -10.187 1.00 0.00 H new ATOM 0 HD22 LEU A 79 1.438 -3.839 -11.450 1.00 0.00 H new ATOM 0 HD23 LEU A 79 1.896 -2.855 -10.039 1.00 0.00 H new ATOM 1254 N THR A 80 -1.708 -0.018 -10.345 1.00 0.00 N ATOM 1255 CA THR A 80 -2.840 0.832 -10.693 1.00 0.00 C ATOM 1256 C THR A 80 -3.131 0.774 -12.189 1.00 0.00 C ATOM 1257 O THR A 80 -2.544 1.503 -12.989 1.00 0.00 O ATOM 1258 CB THR A 80 -2.589 2.296 -10.287 1.00 0.00 C ATOM 1259 OG1 THR A 80 -1.471 2.821 -11.011 1.00 0.00 O ATOM 1260 CG2 THR A 80 -2.329 2.406 -8.792 1.00 0.00 C ATOM 0 H THR A 80 -0.798 0.369 -10.594 1.00 0.00 H new ATOM 0 HA THR A 80 -3.701 0.453 -10.143 1.00 0.00 H new ATOM 0 HB THR A 80 -3.481 2.875 -10.528 1.00 0.00 H new ATOM 0 HG1 THR A 80 -1.559 2.591 -11.960 1.00 0.00 H new ATOM 0 HG21 THR A 80 -2.154 3.449 -8.529 1.00 0.00 H new ATOM 0 HG22 THR A 80 -3.194 2.033 -8.244 1.00 0.00 H new ATOM 0 HG23 THR A 80 -1.452 1.814 -8.531 1.00 0.00 H new ATOM 1268 N PRO A 81 -4.060 -0.111 -12.578 1.00 0.00 N ATOM 1269 CA PRO A 81 -4.451 -0.284 -13.980 1.00 0.00 C ATOM 1270 C PRO A 81 -5.227 0.914 -14.517 1.00 0.00 C ATOM 1271 O PRO A 81 -4.959 1.396 -15.618 1.00 0.00 O ATOM 1272 CB PRO A 81 -5.342 -1.528 -13.949 1.00 0.00 C ATOM 1273 CG PRO A 81 -5.881 -1.574 -12.561 1.00 0.00 C ATOM 1274 CD PRO A 81 -4.801 -1.012 -11.679 1.00 0.00 C ATOM 0 HA PRO A 81 -3.586 -0.379 -14.636 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -6.145 -1.458 -14.683 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -4.773 -2.428 -14.183 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -6.797 -0.988 -12.478 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -6.129 -2.595 -12.272 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -5.217 -0.476 -10.826 1.00 0.00 H new ATOM 0 HD3 PRO A 81 -4.160 -1.797 -11.279 1.00 0.00 H new ATOM 1282 N ASP A 82 -6.189 1.389 -13.734 1.00 0.00 N ATOM 1283 CA ASP A 82 -7.003 2.532 -14.130 1.00 0.00 C ATOM 1284 C ASP A 82 -6.210 3.830 -14.015 1.00 0.00 C ATOM 1285 O ASP A 82 -6.021 4.544 -15.001 1.00 0.00 O ATOM 1286 CB ASP A 82 -8.263 2.612 -13.267 1.00 0.00 C ATOM 1287 CG ASP A 82 -9.424 3.259 -13.995 1.00 0.00 C ATOM 1288 OD1 ASP A 82 -9.194 4.260 -14.706 1.00 0.00 O ATOM 1289 OD2 ASP A 82 -10.563 2.767 -13.854 1.00 0.00 O ATOM 0 H ASP A 82 -6.424 1.000 -12.821 1.00 0.00 H new ATOM 0 HA ASP A 82 -7.294 2.396 -15.172 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -8.549 1.608 -12.953 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -8.044 3.179 -12.362 1.00 0.00 H new ATOM 1294 N LEU A 83 -5.750 4.131 -12.806 1.00 0.00 N ATOM 1295 CA LEU A 83 -4.978 5.344 -12.562 1.00 0.00 C ATOM 1296 C LEU A 83 -4.086 5.672 -13.755 1.00 0.00 C ATOM 1297 O LEU A 83 -3.202 4.902 -14.131 1.00 0.00 O ATOM 1298 CB LEU A 83 -4.125 5.185 -11.302 1.00 0.00 C ATOM 1299 CG LEU A 83 -3.693 6.481 -10.615 1.00 0.00 C ATOM 1300 CD1 LEU A 83 -4.906 7.263 -10.138 1.00 0.00 C ATOM 1301 CD2 LEU A 83 -2.758 6.182 -9.452 1.00 0.00 C ATOM 0 H LEU A 83 -5.898 3.552 -11.979 1.00 0.00 H new ATOM 0 HA LEU A 83 -5.678 6.167 -12.418 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -4.683 4.585 -10.583 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -3.230 4.620 -11.562 1.00 0.00 H new ATOM 0 HG LEU A 83 -3.155 7.092 -11.340 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -4.578 8.182 -9.652 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -5.538 7.509 -10.991 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -5.472 6.659 -9.429 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -2.461 7.116 -8.975 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -3.271 5.551 -8.726 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -1.872 5.665 -9.821 1.00 0.00 H new ATOM 1313 N PRO A 84 -4.320 6.844 -14.365 1.00 0.00 N ATOM 1314 CA PRO A 84 -3.546 7.302 -15.523 1.00 0.00 C ATOM 1315 C PRO A 84 -2.112 7.668 -15.154 1.00 0.00 C ATOM 1316 O PRO A 84 -1.753 7.763 -13.980 1.00 0.00 O ATOM 1317 CB PRO A 84 -4.311 8.542 -15.992 1.00 0.00 C ATOM 1318 CG PRO A 84 -5.016 9.035 -14.776 1.00 0.00 C ATOM 1319 CD PRO A 84 -5.357 7.812 -13.970 1.00 0.00 C ATOM 0 HA PRO A 84 -3.454 6.528 -16.284 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -3.634 9.298 -16.391 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -5.016 8.295 -16.786 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -4.382 9.714 -14.206 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -5.916 9.589 -15.044 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -5.330 8.016 -12.900 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -6.357 7.445 -14.200 1.00 0.00 H new ATOM 1327 N PRO A 85 -1.272 7.878 -16.178 1.00 0.00 N ATOM 1328 CA PRO A 85 0.136 8.238 -15.986 1.00 0.00 C ATOM 1329 C PRO A 85 0.303 9.649 -15.432 1.00 0.00 C ATOM 1330 O PRO A 85 -0.634 10.448 -15.409 1.00 0.00 O ATOM 1331 CB PRO A 85 0.721 8.146 -17.398 1.00 0.00 C ATOM 1332 CG PRO A 85 -0.440 8.369 -18.304 1.00 0.00 C ATOM 1333 CD PRO A 85 -1.633 7.781 -17.603 1.00 0.00 C ATOM 0 HA PRO A 85 0.628 7.588 -15.262 1.00 0.00 H new ATOM 0 HB2 PRO A 85 1.496 8.896 -17.555 1.00 0.00 H new ATOM 0 HB3 PRO A 85 1.179 7.173 -17.574 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -0.586 9.432 -18.497 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -0.279 7.889 -19.269 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -2.544 8.336 -17.826 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -1.808 6.748 -17.904 1.00 0.00 H new ATOM 1341 N PRO A 86 1.523 9.965 -14.974 1.00 0.00 N ATOM 1342 CA PRO A 86 1.842 11.280 -14.412 1.00 0.00 C ATOM 1343 C PRO A 86 1.848 12.377 -15.471 1.00 0.00 C ATOM 1344 O PRO A 86 1.898 13.564 -15.149 1.00 0.00 O ATOM 1345 CB PRO A 86 3.246 11.088 -13.832 1.00 0.00 C ATOM 1346 CG PRO A 86 3.833 9.972 -14.625 1.00 0.00 C ATOM 1347 CD PRO A 86 2.686 9.062 -14.970 1.00 0.00 C ATOM 0 HA PRO A 86 1.103 11.599 -13.677 1.00 0.00 H new ATOM 0 HB2 PRO A 86 3.841 11.996 -13.926 1.00 0.00 H new ATOM 0 HB3 PRO A 86 3.206 10.842 -12.771 1.00 0.00 H new ATOM 0 HG2 PRO A 86 4.319 10.347 -15.526 1.00 0.00 H new ATOM 0 HG3 PRO A 86 4.593 9.442 -14.050 1.00 0.00 H new ATOM 0 HD2 PRO A 86 2.828 8.586 -15.940 1.00 0.00 H new ATOM 0 HD3 PRO A 86 2.572 8.263 -14.237 1.00 0.00 H new ATOM 1355 N SER A 87 1.797 11.972 -16.736 1.00 0.00 N ATOM 1356 CA SER A 87 1.800 12.921 -17.843 1.00 0.00 C ATOM 1357 C SER A 87 1.006 14.174 -17.487 1.00 0.00 C ATOM 1358 O SER A 87 1.494 15.294 -17.633 1.00 0.00 O ATOM 1359 CB SER A 87 1.216 12.273 -19.100 1.00 0.00 C ATOM 1360 OG SER A 87 1.908 11.080 -19.427 1.00 0.00 O ATOM 0 H SER A 87 1.753 10.993 -17.020 1.00 0.00 H new ATOM 0 HA SER A 87 2.833 13.210 -18.038 1.00 0.00 H new ATOM 0 HB2 SER A 87 0.160 12.053 -18.943 1.00 0.00 H new ATOM 0 HB3 SER A 87 1.275 12.972 -19.934 1.00 0.00 H new ATOM 0 HG SER A 87 1.515 10.684 -20.233 1.00 0.00 H new ATOM 1366 N SER A 88 -0.222 13.975 -17.019 1.00 0.00 N ATOM 1367 CA SER A 88 -1.088 15.088 -16.646 1.00 0.00 C ATOM 1368 C SER A 88 -1.423 15.039 -15.158 1.00 0.00 C ATOM 1369 O SER A 88 -2.410 14.425 -14.753 1.00 0.00 O ATOM 1370 CB SER A 88 -2.375 15.060 -17.472 1.00 0.00 C ATOM 1371 OG SER A 88 -3.060 13.831 -17.308 1.00 0.00 O ATOM 0 H SER A 88 -0.640 13.054 -16.889 1.00 0.00 H new ATOM 0 HA SER A 88 -0.555 16.016 -16.851 1.00 0.00 H new ATOM 0 HB2 SER A 88 -3.022 15.884 -17.170 1.00 0.00 H new ATOM 0 HB3 SER A 88 -2.138 15.210 -18.525 1.00 0.00 H new ATOM 0 HG SER A 88 -3.066 13.584 -16.360 1.00 0.00 H new ATOM 1377 N SER A 89 -0.595 15.692 -14.349 1.00 0.00 N ATOM 1378 CA SER A 89 -0.800 15.721 -12.906 1.00 0.00 C ATOM 1379 C SER A 89 0.189 16.670 -12.236 1.00 0.00 C ATOM 1380 O SER A 89 1.365 16.716 -12.597 1.00 0.00 O ATOM 1381 CB SER A 89 -0.653 14.316 -12.321 1.00 0.00 C ATOM 1382 OG SER A 89 -0.819 14.329 -10.913 1.00 0.00 O ATOM 0 H SER A 89 0.225 16.208 -14.669 1.00 0.00 H new ATOM 0 HA SER A 89 -1.810 16.083 -12.714 1.00 0.00 H new ATOM 0 HB2 SER A 89 -1.391 13.652 -12.771 1.00 0.00 H new ATOM 0 HB3 SER A 89 0.330 13.916 -12.571 1.00 0.00 H new ATOM 0 HG SER A 89 -0.722 13.418 -10.564 1.00 0.00 H new ATOM 1388 N SER A 90 -0.297 17.426 -11.256 1.00 0.00 N ATOM 1389 CA SER A 90 0.542 18.377 -10.537 1.00 0.00 C ATOM 1390 C SER A 90 0.157 18.434 -9.062 1.00 0.00 C ATOM 1391 O SER A 90 -0.971 18.788 -8.715 1.00 0.00 O ATOM 1392 CB SER A 90 0.422 19.769 -11.161 1.00 0.00 C ATOM 1393 OG SER A 90 -0.860 20.325 -10.923 1.00 0.00 O ATOM 0 H SER A 90 -1.267 17.398 -10.942 1.00 0.00 H new ATOM 0 HA SER A 90 1.576 18.041 -10.612 1.00 0.00 H new ATOM 0 HB2 SER A 90 1.189 20.424 -10.747 1.00 0.00 H new ATOM 0 HB3 SER A 90 0.601 19.707 -12.234 1.00 0.00 H new ATOM 0 HG SER A 90 -1.327 19.793 -10.245 1.00 0.00 H new ATOM 1399 N HIS A 91 1.102 18.081 -8.196 1.00 0.00 N ATOM 1400 CA HIS A 91 0.863 18.092 -6.757 1.00 0.00 C ATOM 1401 C HIS A 91 1.760 19.113 -6.065 1.00 0.00 C ATOM 1402 O HIS A 91 2.660 19.682 -6.682 1.00 0.00 O ATOM 1403 CB HIS A 91 1.105 16.702 -6.168 1.00 0.00 C ATOM 1404 CG HIS A 91 0.559 16.534 -4.783 1.00 0.00 C ATOM 1405 ND1 HIS A 91 -0.734 16.865 -4.439 1.00 0.00 N ATOM 1406 CD2 HIS A 91 1.140 16.066 -3.654 1.00 0.00 C ATOM 1407 CE1 HIS A 91 -0.926 16.609 -3.157 1.00 0.00 C ATOM 1408 NE2 HIS A 91 0.196 16.123 -2.658 1.00 0.00 N ATOM 0 H HIS A 91 2.040 17.784 -8.466 1.00 0.00 H new ATOM 0 HA HIS A 91 -0.176 18.374 -6.589 1.00 0.00 H new ATOM 0 HB2 HIS A 91 0.652 15.956 -6.821 1.00 0.00 H new ATOM 0 HB3 HIS A 91 2.177 16.504 -6.153 1.00 0.00 H new ATOM 0 HD2 HIS A 91 2.156 15.714 -3.555 1.00 0.00 H new ATOM 0 HE1 HIS A 91 -1.844 16.770 -2.611 1.00 0.00 H new ATOM 0 HE2 HIS A 91 0.338 15.836 -1.690 1.00 0.00 H new ATOM 1417 N ALA A 92 1.507 19.342 -4.780 1.00 0.00 N ATOM 1418 CA ALA A 92 2.292 20.294 -4.005 1.00 0.00 C ATOM 1419 C ALA A 92 3.733 19.819 -3.848 1.00 0.00 C ATOM 1420 O ALA A 92 4.673 20.601 -3.981 1.00 0.00 O ATOM 1421 CB ALA A 92 1.656 20.515 -2.640 1.00 0.00 C ATOM 0 H ALA A 92 0.764 18.881 -4.254 1.00 0.00 H new ATOM 0 HA ALA A 92 2.306 21.241 -4.545 1.00 0.00 H new ATOM 0 HB1 ALA A 92 2.253 21.228 -2.072 1.00 0.00 H new ATOM 0 HB2 ALA A 92 0.647 20.907 -2.768 1.00 0.00 H new ATOM 0 HB3 ALA A 92 1.612 19.568 -2.101 1.00 0.00 H new ATOM 1427 N GLY A 93 3.899 18.531 -3.563 1.00 0.00 N ATOM 1428 CA GLY A 93 5.228 17.974 -3.392 1.00 0.00 C ATOM 1429 C GLY A 93 5.309 17.015 -2.221 1.00 0.00 C ATOM 1430 O GLY A 93 4.404 16.964 -1.388 1.00 0.00 O ATOM 0 H GLY A 93 3.137 17.863 -3.447 1.00 0.00 H new ATOM 0 HA2 GLY A 93 5.521 17.454 -4.304 1.00 0.00 H new ATOM 0 HA3 GLY A 93 5.942 18.784 -3.244 1.00 0.00 H new ATOM 1434 N ALA A 94 6.395 16.252 -2.156 1.00 0.00 N ATOM 1435 CA ALA A 94 6.590 15.291 -1.078 1.00 0.00 C ATOM 1436 C ALA A 94 6.547 15.977 0.283 1.00 0.00 C ATOM 1437 O ALA A 94 7.118 17.053 0.466 1.00 0.00 O ATOM 1438 CB ALA A 94 7.910 14.556 -1.259 1.00 0.00 C ATOM 0 H ALA A 94 7.153 16.281 -2.838 1.00 0.00 H new ATOM 0 HA ALA A 94 5.775 14.568 -1.117 1.00 0.00 H new ATOM 0 HB1 ALA A 94 8.043 13.841 -0.447 1.00 0.00 H new ATOM 0 HB2 ALA A 94 7.904 14.026 -2.211 1.00 0.00 H new ATOM 0 HB3 ALA A 94 8.730 15.274 -1.249 1.00 0.00 H new ATOM 1444 N LEU A 95 5.867 15.348 1.236 1.00 0.00 N ATOM 1445 CA LEU A 95 5.749 15.899 2.582 1.00 0.00 C ATOM 1446 C LEU A 95 6.653 15.152 3.557 1.00 0.00 C ATOM 1447 O LEU A 95 6.302 14.077 4.044 1.00 0.00 O ATOM 1448 CB LEU A 95 4.297 15.827 3.058 1.00 0.00 C ATOM 1449 CG LEU A 95 3.934 16.723 4.243 1.00 0.00 C ATOM 1450 CD1 LEU A 95 3.875 18.180 3.812 1.00 0.00 C ATOM 1451 CD2 LEU A 95 2.609 16.290 4.852 1.00 0.00 C ATOM 0 H LEU A 95 5.389 14.457 1.102 1.00 0.00 H new ATOM 0 HA LEU A 95 6.063 16.942 2.550 1.00 0.00 H new ATOM 0 HB2 LEU A 95 3.648 16.085 2.221 1.00 0.00 H new ATOM 0 HB3 LEU A 95 4.075 14.794 3.327 1.00 0.00 H new ATOM 0 HG LEU A 95 4.710 16.622 5.002 1.00 0.00 H new ATOM 0 HD11 LEU A 95 3.615 18.802 4.668 1.00 0.00 H new ATOM 0 HD12 LEU A 95 4.847 18.484 3.424 1.00 0.00 H new ATOM 0 HD13 LEU A 95 3.120 18.299 3.035 1.00 0.00 H new ATOM 0 HD21 LEU A 95 2.366 16.938 5.694 1.00 0.00 H new ATOM 0 HD22 LEU A 95 1.823 16.361 4.101 1.00 0.00 H new ATOM 0 HD23 LEU A 95 2.687 15.260 5.199 1.00 0.00 H new ATOM 1463 N GLN A 96 7.817 15.729 3.838 1.00 0.00 N ATOM 1464 CA GLN A 96 8.770 15.118 4.756 1.00 0.00 C ATOM 1465 C GLN A 96 8.842 15.898 6.065 1.00 0.00 C ATOM 1466 O GLN A 96 9.131 17.093 6.070 1.00 0.00 O ATOM 1467 CB GLN A 96 10.157 15.048 4.114 1.00 0.00 C ATOM 1468 CG GLN A 96 11.141 14.183 4.884 1.00 0.00 C ATOM 1469 CD GLN A 96 12.484 14.069 4.190 1.00 0.00 C ATOM 1470 OE1 GLN A 96 13.341 14.943 4.323 1.00 0.00 O ATOM 1471 NE2 GLN A 96 12.675 12.987 3.444 1.00 0.00 N ATOM 0 H GLN A 96 8.122 16.618 3.443 1.00 0.00 H new ATOM 0 HA GLN A 96 8.427 14.107 4.975 1.00 0.00 H new ATOM 0 HB2 GLN A 96 10.060 14.659 3.100 1.00 0.00 H new ATOM 0 HB3 GLN A 96 10.561 16.057 4.031 1.00 0.00 H new ATOM 0 HG2 GLN A 96 11.285 14.602 5.880 1.00 0.00 H new ATOM 0 HG3 GLN A 96 10.718 13.187 5.015 1.00 0.00 H new ATOM 0 HE21 GLN A 96 11.937 12.288 3.362 1.00 0.00 H new ATOM 0 HE22 GLN A 96 13.560 12.855 2.953 1.00 0.00 H new ATOM 1480 N GLU A 97 8.576 15.212 7.172 1.00 0.00 N ATOM 1481 CA GLU A 97 8.609 15.841 8.487 1.00 0.00 C ATOM 1482 C GLU A 97 9.436 15.013 9.466 1.00 0.00 C ATOM 1483 O GLU A 97 8.907 14.154 10.171 1.00 0.00 O ATOM 1484 CB GLU A 97 7.189 16.022 9.027 1.00 0.00 C ATOM 1485 CG GLU A 97 6.443 17.187 8.400 1.00 0.00 C ATOM 1486 CD GLU A 97 5.045 17.355 8.962 1.00 0.00 C ATOM 1487 OE1 GLU A 97 4.121 16.672 8.472 1.00 0.00 O ATOM 1488 OE2 GLU A 97 4.874 18.169 9.894 1.00 0.00 O ATOM 0 H GLU A 97 8.335 14.221 7.184 1.00 0.00 H new ATOM 0 HA GLU A 97 9.077 16.820 8.381 1.00 0.00 H new ATOM 0 HB2 GLU A 97 6.625 15.105 8.855 1.00 0.00 H new ATOM 0 HB3 GLU A 97 7.236 16.170 10.106 1.00 0.00 H new ATOM 0 HG2 GLU A 97 7.008 18.105 8.562 1.00 0.00 H new ATOM 0 HG3 GLU A 97 6.382 17.036 7.322 1.00 0.00 H new ATOM 1495 N SER A 98 10.738 15.278 9.504 1.00 0.00 N ATOM 1496 CA SER A 98 11.640 14.555 10.393 1.00 0.00 C ATOM 1497 C SER A 98 12.004 15.405 11.606 1.00 0.00 C ATOM 1498 O SER A 98 12.406 16.562 11.470 1.00 0.00 O ATOM 1499 CB SER A 98 12.909 14.146 9.643 1.00 0.00 C ATOM 1500 OG SER A 98 13.788 15.247 9.489 1.00 0.00 O ATOM 0 H SER A 98 11.192 15.988 8.929 1.00 0.00 H new ATOM 0 HA SER A 98 11.127 13.658 10.741 1.00 0.00 H new ATOM 0 HB2 SER A 98 13.414 13.347 10.185 1.00 0.00 H new ATOM 0 HB3 SER A 98 12.644 13.748 8.663 1.00 0.00 H new ATOM 0 HG SER A 98 13.489 15.987 10.058 1.00 0.00 H new ATOM 1506 N LEU A 99 11.862 14.824 12.792 1.00 0.00 N ATOM 1507 CA LEU A 99 12.175 15.527 14.031 1.00 0.00 C ATOM 1508 C LEU A 99 13.626 15.997 14.038 1.00 0.00 C ATOM 1509 O LEU A 99 14.503 15.347 13.470 1.00 0.00 O ATOM 1510 CB LEU A 99 11.915 14.620 15.235 1.00 0.00 C ATOM 1511 CG LEU A 99 12.659 13.284 15.242 1.00 0.00 C ATOM 1512 CD1 LEU A 99 14.016 13.432 15.914 1.00 0.00 C ATOM 1513 CD2 LEU A 99 11.831 12.216 15.939 1.00 0.00 C ATOM 0 H LEU A 99 11.532 13.868 12.922 1.00 0.00 H new ATOM 0 HA LEU A 99 11.528 16.402 14.097 1.00 0.00 H new ATOM 0 HB2 LEU A 99 12.181 15.166 16.140 1.00 0.00 H new ATOM 0 HB3 LEU A 99 10.845 14.418 15.288 1.00 0.00 H new ATOM 0 HG LEU A 99 12.820 12.974 14.209 1.00 0.00 H new ATOM 0 HD11 LEU A 99 14.531 12.471 15.910 1.00 0.00 H new ATOM 0 HD12 LEU A 99 14.612 14.166 15.372 1.00 0.00 H new ATOM 0 HD13 LEU A 99 13.878 13.765 16.943 1.00 0.00 H new ATOM 0 HD21 LEU A 99 12.376 11.272 15.934 1.00 0.00 H new ATOM 0 HD22 LEU A 99 11.639 12.519 16.968 1.00 0.00 H new ATOM 0 HD23 LEU A 99 10.884 12.090 15.415 1.00 0.00 H new ATOM 1525 N ASN A 100 13.873 17.131 14.687 1.00 0.00 N ATOM 1526 CA ASN A 100 15.218 17.687 14.770 1.00 0.00 C ATOM 1527 C ASN A 100 16.259 16.578 14.889 1.00 0.00 C ATOM 1528 O ASN A 100 17.449 16.846 15.052 1.00 0.00 O ATOM 1529 CB ASN A 100 15.328 18.635 15.966 1.00 0.00 C ATOM 1530 CG ASN A 100 14.812 20.026 15.650 1.00 0.00 C ATOM 1531 OD1 ASN A 100 15.258 20.664 14.697 1.00 0.00 O ATOM 1532 ND2 ASN A 100 13.867 20.502 16.452 1.00 0.00 N ATOM 0 H ASN A 100 13.159 17.682 15.163 1.00 0.00 H new ATOM 0 HA ASN A 100 15.410 18.245 13.854 1.00 0.00 H new ATOM 0 HB2 ASN A 100 14.766 18.224 16.805 1.00 0.00 H new ATOM 0 HB3 ASN A 100 16.370 18.699 16.281 1.00 0.00 H new ATOM 0 HD21 ASN A 100 13.481 21.432 16.290 1.00 0.00 H new ATOM 0 HD22 ASN A 100 13.527 19.938 17.231 1.00 0.00 H new TER 1539 ASN A 100