USER MOD reduce.3.24.130724 H: found=0, std=0, add=773, rem=0, adj=26 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 16 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 80 THR OG1 : rot 65:sc= 1.08 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 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 ASN : amide:sc= -2.21 K(o=-2.2,f=-5.8!) USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.0418 USER MOD Single : A 29 CYS SG : rot -160:sc=-0.00805 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 153:sc= 0 (180deg=-0.403) USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 40 ASN : amide:sc= -0.124 K(o=-0.12,f=-2.4!) USER MOD Single : A 43 GLN :FLIP amide:sc= -0.365 F(o=-1.4,f=-0.36) USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 MET CE :methyl 134:sc= -0.675 (180deg=-0.936) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ -173:sc= -1.24 (180deg=-1.46) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 69 HIS :FLIP no HE2:sc= -3.78! C(o=-4.3!,f=-3.8!) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 74 ASN : amide:sc= -4.02! C(o=-4!,f=-7.9!) USER MOD Single : A 75 SER OG : rot 37:sc= 0.718 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 180:sc= 0 USER MOD Single : A 89 SER OG : rot 42:sc= 1.16 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 91 HIS : no HD1:sc= -0.874 X(o=-0.87,f=-0.65) USER MOD Single : A 96 GLN : amide:sc= -0.0359 X(o=-0.036,f=-0.017) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 100 ASN : amide:sc= -0.242 K(o=-0.24,f=-2.4!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 21.223 0.592 25.036 1.00 0.00 N ATOM 2 CA GLY A 1 20.857 0.067 23.734 1.00 0.00 C ATOM 3 C GLY A 1 19.429 -0.440 23.694 1.00 0.00 C ATOM 4 O GLY A 1 18.514 0.291 23.313 1.00 0.00 O ATOM 0 H1 GLY A 1 22.208 0.926 25.011 1.00 0.00 H new ATOM 0 H2 GLY A 1 20.595 1.384 25.280 1.00 0.00 H new ATOM 0 H3 GLY A 1 21.129 -0.157 25.751 1.00 0.00 H new ATOM 0 HA2 GLY A 1 20.984 0.846 22.983 1.00 0.00 H new ATOM 0 HA3 GLY A 1 21.535 -0.744 23.469 1.00 0.00 H new ATOM 8 N SER A 2 19.236 -1.695 24.086 1.00 0.00 N ATOM 9 CA SER A 2 17.910 -2.300 24.088 1.00 0.00 C ATOM 10 C SER A 2 17.130 -1.896 25.336 1.00 0.00 C ATOM 11 O SER A 2 17.090 -2.631 26.322 1.00 0.00 O ATOM 12 CB SER A 2 18.021 -3.824 24.015 1.00 0.00 C ATOM 13 OG SER A 2 16.873 -4.391 23.408 1.00 0.00 O ATOM 0 H SER A 2 19.982 -2.313 24.406 1.00 0.00 H new ATOM 0 HA SER A 2 17.372 -1.939 23.211 1.00 0.00 H new ATOM 0 HB2 SER A 2 18.910 -4.100 23.448 1.00 0.00 H new ATOM 0 HB3 SER A 2 18.144 -4.231 25.019 1.00 0.00 H new ATOM 0 HG SER A 2 16.970 -5.366 23.372 1.00 0.00 H new ATOM 19 N SER A 3 16.510 -0.721 25.284 1.00 0.00 N ATOM 20 CA SER A 3 15.734 -0.215 26.410 1.00 0.00 C ATOM 21 C SER A 3 14.438 -1.002 26.573 1.00 0.00 C ATOM 22 O SER A 3 14.060 -1.374 27.684 1.00 0.00 O ATOM 23 CB SER A 3 15.421 1.270 26.215 1.00 0.00 C ATOM 24 OG SER A 3 16.540 2.075 26.546 1.00 0.00 O ATOM 0 H SER A 3 16.530 -0.102 24.474 1.00 0.00 H new ATOM 0 HA SER A 3 16.330 -0.338 27.314 1.00 0.00 H new ATOM 0 HB2 SER A 3 15.132 1.451 25.180 1.00 0.00 H new ATOM 0 HB3 SER A 3 14.571 1.550 26.837 1.00 0.00 H new ATOM 0 HG SER A 3 16.315 3.019 26.411 1.00 0.00 H new ATOM 30 N GLY A 4 13.760 -1.253 25.457 1.00 0.00 N ATOM 31 CA GLY A 4 12.513 -1.995 25.497 1.00 0.00 C ATOM 32 C GLY A 4 11.479 -1.442 24.537 1.00 0.00 C ATOM 33 O GLY A 4 11.381 -0.230 24.350 1.00 0.00 O ATOM 0 H GLY A 4 14.052 -0.956 24.526 1.00 0.00 H new ATOM 0 HA2 GLY A 4 12.707 -3.040 25.255 1.00 0.00 H new ATOM 0 HA3 GLY A 4 12.112 -1.972 26.510 1.00 0.00 H new ATOM 37 N SER A 5 10.707 -2.334 23.924 1.00 0.00 N ATOM 38 CA SER A 5 9.679 -1.929 22.972 1.00 0.00 C ATOM 39 C SER A 5 8.428 -2.789 23.125 1.00 0.00 C ATOM 40 O SER A 5 8.506 -3.953 23.521 1.00 0.00 O ATOM 41 CB SER A 5 10.210 -2.031 21.541 1.00 0.00 C ATOM 42 OG SER A 5 11.327 -1.181 21.350 1.00 0.00 O ATOM 0 H SER A 5 10.774 -3.341 24.070 1.00 0.00 H new ATOM 0 HA SER A 5 9.414 -0.892 23.180 1.00 0.00 H new ATOM 0 HB2 SER A 5 10.493 -3.062 21.327 1.00 0.00 H new ATOM 0 HB3 SER A 5 9.422 -1.764 20.837 1.00 0.00 H new ATOM 0 HG SER A 5 11.649 -1.266 20.428 1.00 0.00 H new ATOM 48 N SER A 6 7.275 -2.208 22.809 1.00 0.00 N ATOM 49 CA SER A 6 6.007 -2.919 22.915 1.00 0.00 C ATOM 50 C SER A 6 5.432 -3.213 21.532 1.00 0.00 C ATOM 51 O SER A 6 4.233 -3.060 21.301 1.00 0.00 O ATOM 52 CB SER A 6 5.005 -2.100 23.732 1.00 0.00 C ATOM 53 OG SER A 6 5.170 -2.332 25.120 1.00 0.00 O ATOM 0 H SER A 6 7.193 -1.247 22.478 1.00 0.00 H new ATOM 0 HA SER A 6 6.191 -3.866 23.422 1.00 0.00 H new ATOM 0 HB2 SER A 6 5.138 -1.039 23.519 1.00 0.00 H new ATOM 0 HB3 SER A 6 3.989 -2.360 23.435 1.00 0.00 H new ATOM 0 HG SER A 6 4.520 -1.796 25.621 1.00 0.00 H new ATOM 59 N GLY A 7 6.298 -3.636 20.616 1.00 0.00 N ATOM 60 CA GLY A 7 5.859 -3.945 19.267 1.00 0.00 C ATOM 61 C GLY A 7 7.005 -3.964 18.275 1.00 0.00 C ATOM 62 O GLY A 7 7.901 -3.123 18.336 1.00 0.00 O ATOM 0 H GLY A 7 7.295 -3.770 20.784 1.00 0.00 H new ATOM 0 HA2 GLY A 7 5.363 -4.915 19.263 1.00 0.00 H new ATOM 0 HA3 GLY A 7 5.121 -3.208 18.951 1.00 0.00 H new ATOM 66 N ARG A 8 6.976 -4.927 17.360 1.00 0.00 N ATOM 67 CA ARG A 8 8.022 -5.054 16.352 1.00 0.00 C ATOM 68 C ARG A 8 7.607 -4.378 15.049 1.00 0.00 C ATOM 69 O ARG A 8 6.587 -4.727 14.455 1.00 0.00 O ATOM 70 CB ARG A 8 8.337 -6.529 16.096 1.00 0.00 C ATOM 71 CG ARG A 8 7.121 -7.351 15.699 1.00 0.00 C ATOM 72 CD ARG A 8 7.496 -8.797 15.411 1.00 0.00 C ATOM 73 NE ARG A 8 6.528 -9.449 14.534 1.00 0.00 N ATOM 74 CZ ARG A 8 6.796 -10.541 13.827 1.00 0.00 C ATOM 75 NH1 ARG A 8 7.996 -11.100 13.894 1.00 0.00 N ATOM 76 NH2 ARG A 8 5.862 -11.076 13.050 1.00 0.00 N ATOM 0 H ARG A 8 6.240 -5.630 17.296 1.00 0.00 H new ATOM 0 HA ARG A 8 8.917 -4.559 16.729 1.00 0.00 H new ATOM 0 HB2 ARG A 8 9.086 -6.600 15.308 1.00 0.00 H new ATOM 0 HB3 ARG A 8 8.778 -6.959 16.995 1.00 0.00 H new ATOM 0 HG2 ARG A 8 6.381 -7.318 16.499 1.00 0.00 H new ATOM 0 HG3 ARG A 8 6.656 -6.912 14.816 1.00 0.00 H new ATOM 0 HD2 ARG A 8 8.483 -8.831 14.950 1.00 0.00 H new ATOM 0 HD3 ARG A 8 7.564 -9.348 16.349 1.00 0.00 H new ATOM 0 HE ARG A 8 5.595 -9.044 14.460 1.00 0.00 H new ATOM 0 HH11 ARG A 8 8.716 -10.692 14.490 1.00 0.00 H new ATOM 0 HH12 ARG A 8 8.199 -11.939 13.350 1.00 0.00 H new ATOM 0 HH21 ARG A 8 4.938 -10.648 12.996 1.00 0.00 H new ATOM 0 HH22 ARG A 8 6.069 -11.915 12.507 1.00 0.00 H new ATOM 90 N MET A 9 8.404 -3.409 14.611 1.00 0.00 N ATOM 91 CA MET A 9 8.118 -2.684 13.378 1.00 0.00 C ATOM 92 C MET A 9 8.499 -3.517 12.158 1.00 0.00 C ATOM 93 O MET A 9 9.521 -4.204 12.157 1.00 0.00 O ATOM 94 CB MET A 9 8.872 -1.353 13.357 1.00 0.00 C ATOM 95 CG MET A 9 8.972 -0.690 14.721 1.00 0.00 C ATOM 96 SD MET A 9 7.454 -0.846 15.682 1.00 0.00 S ATOM 97 CE MET A 9 6.337 0.169 14.717 1.00 0.00 C ATOM 0 H MET A 9 9.252 -3.108 15.091 1.00 0.00 H new ATOM 0 HA MET A 9 7.047 -2.487 13.342 1.00 0.00 H new ATOM 0 HB2 MET A 9 9.877 -1.520 12.969 1.00 0.00 H new ATOM 0 HB3 MET A 9 8.373 -0.673 12.667 1.00 0.00 H new ATOM 0 HG2 MET A 9 9.797 -1.135 15.277 1.00 0.00 H new ATOM 0 HG3 MET A 9 9.208 0.366 14.591 1.00 0.00 H new ATOM 0 HE1 MET A 9 5.353 0.173 15.185 1.00 0.00 H new ATOM 0 HE2 MET A 9 6.720 1.188 14.670 1.00 0.00 H new ATOM 0 HE3 MET A 9 6.258 -0.236 13.708 1.00 0.00 H new ATOM 107 N LEU A 10 7.671 -3.452 11.121 1.00 0.00 N ATOM 108 CA LEU A 10 7.921 -4.200 9.894 1.00 0.00 C ATOM 109 C LEU A 10 8.232 -3.258 8.735 1.00 0.00 C ATOM 110 O LEU A 10 7.421 -2.399 8.386 1.00 0.00 O ATOM 111 CB LEU A 10 6.712 -5.070 9.548 1.00 0.00 C ATOM 112 CG LEU A 10 6.170 -5.946 10.679 1.00 0.00 C ATOM 113 CD1 LEU A 10 4.718 -6.315 10.420 1.00 0.00 C ATOM 114 CD2 LEU A 10 7.020 -7.199 10.836 1.00 0.00 C ATOM 0 H LEU A 10 6.821 -2.889 11.106 1.00 0.00 H new ATOM 0 HA LEU A 10 8.787 -4.841 10.059 1.00 0.00 H new ATOM 0 HB2 LEU A 10 5.909 -4.420 9.202 1.00 0.00 H new ATOM 0 HB3 LEU A 10 6.981 -5.716 8.712 1.00 0.00 H new ATOM 0 HG LEU A 10 6.219 -5.378 11.608 1.00 0.00 H new ATOM 0 HD11 LEU A 10 4.350 -6.938 11.235 1.00 0.00 H new ATOM 0 HD12 LEU A 10 4.118 -5.407 10.357 1.00 0.00 H new ATOM 0 HD13 LEU A 10 4.644 -6.864 9.481 1.00 0.00 H new ATOM 0 HD21 LEU A 10 6.620 -7.811 11.645 1.00 0.00 H new ATOM 0 HD22 LEU A 10 7.003 -7.769 9.907 1.00 0.00 H new ATOM 0 HD23 LEU A 10 8.046 -6.916 11.069 1.00 0.00 H new ATOM 126 N ASP A 11 9.408 -3.426 8.142 1.00 0.00 N ATOM 127 CA ASP A 11 9.825 -2.592 7.020 1.00 0.00 C ATOM 128 C ASP A 11 9.204 -3.086 5.717 1.00 0.00 C ATOM 129 O ASP A 11 9.684 -4.046 5.113 1.00 0.00 O ATOM 130 CB ASP A 11 11.350 -2.584 6.902 1.00 0.00 C ATOM 131 CG ASP A 11 11.834 -1.769 5.719 1.00 0.00 C ATOM 132 OD1 ASP A 11 11.411 -2.064 4.582 1.00 0.00 O ATOM 133 OD2 ASP A 11 12.638 -0.836 5.930 1.00 0.00 O ATOM 0 H ASP A 11 10.090 -4.132 8.419 1.00 0.00 H new ATOM 0 HA ASP A 11 9.478 -1.576 7.205 1.00 0.00 H new ATOM 0 HB2 ASP A 11 11.780 -2.180 7.818 1.00 0.00 H new ATOM 0 HB3 ASP A 11 11.710 -3.608 6.805 1.00 0.00 H new ATOM 138 N PHE A 12 8.134 -2.424 5.289 1.00 0.00 N ATOM 139 CA PHE A 12 7.446 -2.797 4.059 1.00 0.00 C ATOM 140 C PHE A 12 7.878 -1.902 2.901 1.00 0.00 C ATOM 141 O PHE A 12 7.533 -0.721 2.853 1.00 0.00 O ATOM 142 CB PHE A 12 5.930 -2.706 4.249 1.00 0.00 C ATOM 143 CG PHE A 12 5.351 -3.866 5.009 1.00 0.00 C ATOM 144 CD1 PHE A 12 5.111 -5.075 4.377 1.00 0.00 C ATOM 145 CD2 PHE A 12 5.047 -3.746 6.356 1.00 0.00 C ATOM 146 CE1 PHE A 12 4.579 -6.144 5.074 1.00 0.00 C ATOM 147 CE2 PHE A 12 4.515 -4.811 7.057 1.00 0.00 C ATOM 148 CZ PHE A 12 4.280 -6.011 6.415 1.00 0.00 C ATOM 0 H PHE A 12 7.725 -1.627 5.776 1.00 0.00 H new ATOM 0 HA PHE A 12 7.715 -3.826 3.821 1.00 0.00 H new ATOM 0 HB2 PHE A 12 5.693 -1.782 4.776 1.00 0.00 H new ATOM 0 HB3 PHE A 12 5.452 -2.647 3.271 1.00 0.00 H new ATOM 0 HD1 PHE A 12 5.342 -5.184 3.328 1.00 0.00 H new ATOM 0 HD2 PHE A 12 5.228 -2.810 6.863 1.00 0.00 H new ATOM 0 HE1 PHE A 12 4.398 -7.082 4.570 1.00 0.00 H new ATOM 0 HE2 PHE A 12 4.283 -4.705 8.106 1.00 0.00 H new ATOM 0 HZ PHE A 12 3.863 -6.844 6.961 1.00 0.00 H new ATOM 158 N ARG A 13 8.636 -2.473 1.971 1.00 0.00 N ATOM 159 CA ARG A 13 9.118 -1.727 0.814 1.00 0.00 C ATOM 160 C ARG A 13 8.173 -1.893 -0.372 1.00 0.00 C ATOM 161 O ARG A 13 8.129 -2.951 -1.001 1.00 0.00 O ATOM 162 CB ARG A 13 10.523 -2.193 0.429 1.00 0.00 C ATOM 163 CG ARG A 13 11.148 -1.381 -0.693 1.00 0.00 C ATOM 164 CD ARG A 13 12.664 -1.505 -0.693 1.00 0.00 C ATOM 165 NE ARG A 13 13.119 -2.655 -1.470 1.00 0.00 N ATOM 166 CZ ARG A 13 13.204 -3.886 -0.979 1.00 0.00 C ATOM 167 NH1 ARG A 13 12.867 -4.125 0.281 1.00 0.00 N ATOM 168 NH2 ARG A 13 13.628 -4.881 -1.748 1.00 0.00 N ATOM 0 H ARG A 13 8.930 -3.449 1.996 1.00 0.00 H new ATOM 0 HA ARG A 13 9.154 -0.671 1.083 1.00 0.00 H new ATOM 0 HB2 ARG A 13 11.167 -2.140 1.307 1.00 0.00 H new ATOM 0 HB3 ARG A 13 10.480 -3.240 0.128 1.00 0.00 H new ATOM 0 HG2 ARG A 13 10.754 -1.719 -1.651 1.00 0.00 H new ATOM 0 HG3 ARG A 13 10.868 -0.333 -0.585 1.00 0.00 H new ATOM 0 HD2 ARG A 13 13.102 -0.595 -1.102 1.00 0.00 H new ATOM 0 HD3 ARG A 13 13.020 -1.597 0.333 1.00 0.00 H new ATOM 0 HE ARG A 13 13.386 -2.504 -2.443 1.00 0.00 H new ATOM 0 HH11 ARG A 13 12.542 -3.363 0.875 1.00 0.00 H new ATOM 0 HH12 ARG A 13 12.933 -5.071 0.656 1.00 0.00 H new ATOM 0 HH21 ARG A 13 13.889 -4.701 -2.717 1.00 0.00 H new ATOM 0 HH22 ARG A 13 13.693 -5.826 -1.370 1.00 0.00 H new ATOM 182 N VAL A 14 7.417 -0.842 -0.672 1.00 0.00 N ATOM 183 CA VAL A 14 6.473 -0.870 -1.783 1.00 0.00 C ATOM 184 C VAL A 14 7.094 -0.289 -3.047 1.00 0.00 C ATOM 185 O VAL A 14 7.486 0.877 -3.078 1.00 0.00 O ATOM 186 CB VAL A 14 5.189 -0.088 -1.448 1.00 0.00 C ATOM 187 CG1 VAL A 14 4.240 -0.085 -2.637 1.00 0.00 C ATOM 188 CG2 VAL A 14 4.513 -0.675 -0.218 1.00 0.00 C ATOM 0 H VAL A 14 7.440 0.040 -0.161 1.00 0.00 H new ATOM 0 HA VAL A 14 6.218 -1.916 -1.955 1.00 0.00 H new ATOM 0 HB VAL A 14 5.461 0.944 -1.227 1.00 0.00 H new ATOM 0 HG11 VAL A 14 3.339 0.472 -2.382 1.00 0.00 H new ATOM 0 HG12 VAL A 14 4.728 0.386 -3.491 1.00 0.00 H new ATOM 0 HG13 VAL A 14 3.973 -1.111 -2.892 1.00 0.00 H new ATOM 0 HG21 VAL A 14 3.608 -0.110 0.004 1.00 0.00 H new ATOM 0 HG22 VAL A 14 4.254 -1.717 -0.408 1.00 0.00 H new ATOM 0 HG23 VAL A 14 5.193 -0.620 0.632 1.00 0.00 H new ATOM 198 N GLU A 15 7.181 -1.110 -4.089 1.00 0.00 N ATOM 199 CA GLU A 15 7.755 -0.676 -5.357 1.00 0.00 C ATOM 200 C GLU A 15 6.661 -0.257 -6.335 1.00 0.00 C ATOM 201 O GLU A 15 5.977 -1.099 -6.916 1.00 0.00 O ATOM 202 CB GLU A 15 8.600 -1.795 -5.969 1.00 0.00 C ATOM 203 CG GLU A 15 9.590 -1.308 -7.015 1.00 0.00 C ATOM 204 CD GLU A 15 10.255 -2.447 -7.764 1.00 0.00 C ATOM 205 OE1 GLU A 15 9.698 -2.886 -8.792 1.00 0.00 O ATOM 206 OE2 GLU A 15 11.332 -2.899 -7.321 1.00 0.00 O ATOM 0 H GLU A 15 6.861 -2.079 -4.080 1.00 0.00 H new ATOM 0 HA GLU A 15 8.393 0.186 -5.161 1.00 0.00 H new ATOM 0 HB2 GLU A 15 9.145 -2.303 -5.174 1.00 0.00 H new ATOM 0 HB3 GLU A 15 7.938 -2.532 -6.423 1.00 0.00 H new ATOM 0 HG2 GLU A 15 9.074 -0.663 -7.726 1.00 0.00 H new ATOM 0 HG3 GLU A 15 10.355 -0.701 -6.531 1.00 0.00 H new ATOM 213 N TYR A 16 6.503 1.050 -6.511 1.00 0.00 N ATOM 214 CA TYR A 16 5.490 1.582 -7.416 1.00 0.00 C ATOM 215 C TYR A 16 6.137 2.323 -8.582 1.00 0.00 C ATOM 216 O TYR A 16 7.167 2.978 -8.422 1.00 0.00 O ATOM 217 CB TYR A 16 4.546 2.520 -6.663 1.00 0.00 C ATOM 218 CG TYR A 16 3.518 3.185 -7.550 1.00 0.00 C ATOM 219 CD1 TYR A 16 2.781 2.447 -8.468 1.00 0.00 C ATOM 220 CD2 TYR A 16 3.283 4.552 -7.470 1.00 0.00 C ATOM 221 CE1 TYR A 16 1.842 3.050 -9.282 1.00 0.00 C ATOM 222 CE2 TYR A 16 2.344 5.164 -8.279 1.00 0.00 C ATOM 223 CZ TYR A 16 1.627 4.409 -9.183 1.00 0.00 C ATOM 224 OH TYR A 16 0.691 5.014 -9.991 1.00 0.00 O ATOM 0 H TYR A 16 7.063 1.761 -6.040 1.00 0.00 H new ATOM 0 HA TYR A 16 4.918 0.744 -7.814 1.00 0.00 H new ATOM 0 HB2 TYR A 16 4.032 1.956 -5.885 1.00 0.00 H new ATOM 0 HB3 TYR A 16 5.134 3.289 -6.163 1.00 0.00 H new ATOM 0 HD1 TYR A 16 2.945 1.382 -8.547 1.00 0.00 H new ATOM 0 HD2 TYR A 16 3.843 5.147 -6.764 1.00 0.00 H new ATOM 0 HE1 TYR A 16 1.280 2.461 -9.992 1.00 0.00 H new ATOM 0 HE2 TYR A 16 2.173 6.228 -8.203 1.00 0.00 H new ATOM 0 HH TYR A 16 0.662 5.974 -9.796 1.00 0.00 H new ATOM 234 N ARG A 17 5.525 2.214 -9.757 1.00 0.00 N ATOM 235 CA ARG A 17 6.040 2.872 -10.951 1.00 0.00 C ATOM 236 C ARG A 17 6.669 4.217 -10.602 1.00 0.00 C ATOM 237 O ARG A 17 7.838 4.463 -10.900 1.00 0.00 O ATOM 238 CB ARG A 17 4.919 3.071 -11.973 1.00 0.00 C ATOM 239 CG ARG A 17 4.354 1.770 -12.518 1.00 0.00 C ATOM 240 CD ARG A 17 2.914 1.937 -12.978 1.00 0.00 C ATOM 241 NE ARG A 17 2.814 2.778 -14.168 1.00 0.00 N ATOM 242 CZ ARG A 17 1.676 3.001 -14.817 1.00 0.00 C ATOM 243 NH1 ARG A 17 0.548 2.450 -14.392 1.00 0.00 N ATOM 244 NH2 ARG A 17 1.666 3.778 -15.892 1.00 0.00 N ATOM 0 H ARG A 17 4.672 1.676 -9.907 1.00 0.00 H new ATOM 0 HA ARG A 17 6.809 2.233 -11.385 1.00 0.00 H new ATOM 0 HB2 ARG A 17 4.114 3.641 -11.510 1.00 0.00 H new ATOM 0 HB3 ARG A 17 5.297 3.669 -12.802 1.00 0.00 H new ATOM 0 HG2 ARG A 17 4.966 1.428 -13.352 1.00 0.00 H new ATOM 0 HG3 ARG A 17 4.404 1.000 -11.748 1.00 0.00 H new ATOM 0 HD2 ARG A 17 2.485 0.958 -13.189 1.00 0.00 H new ATOM 0 HD3 ARG A 17 2.325 2.376 -12.173 1.00 0.00 H new ATOM 0 HE ARG A 17 3.664 3.218 -14.520 1.00 0.00 H new ATOM 0 HH11 ARG A 17 0.552 1.853 -13.565 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -0.324 2.623 -14.892 1.00 0.00 H new ATOM 0 HH21 ARG A 17 2.532 4.205 -16.221 1.00 0.00 H new ATOM 0 HH22 ARG A 17 0.792 3.949 -16.390 1.00 0.00 H new ATOM 258 N ASP A 18 5.886 5.084 -9.970 1.00 0.00 N ATOM 259 CA ASP A 18 6.367 6.405 -9.579 1.00 0.00 C ATOM 260 C ASP A 18 7.693 6.302 -8.833 1.00 0.00 C ATOM 261 O ASP A 18 8.702 6.864 -9.259 1.00 0.00 O ATOM 262 CB ASP A 18 5.329 7.111 -8.705 1.00 0.00 C ATOM 263 CG ASP A 18 4.058 7.437 -9.465 1.00 0.00 C ATOM 264 OD1 ASP A 18 3.569 6.560 -10.206 1.00 0.00 O ATOM 265 OD2 ASP A 18 3.554 8.570 -9.319 1.00 0.00 O ATOM 0 H ASP A 18 4.916 4.897 -9.717 1.00 0.00 H new ATOM 0 HA ASP A 18 6.526 6.990 -10.485 1.00 0.00 H new ATOM 0 HB2 ASP A 18 5.086 6.478 -7.851 1.00 0.00 H new ATOM 0 HB3 ASP A 18 5.758 8.031 -8.308 1.00 0.00 H new ATOM 270 N ARG A 19 7.683 5.581 -7.716 1.00 0.00 N ATOM 271 CA ARG A 19 8.885 5.406 -6.909 1.00 0.00 C ATOM 272 C ARG A 19 8.631 4.435 -5.759 1.00 0.00 C ATOM 273 O ARG A 19 7.485 4.167 -5.403 1.00 0.00 O ATOM 274 CB ARG A 19 9.355 6.754 -6.358 1.00 0.00 C ATOM 275 CG ARG A 19 8.382 7.382 -5.373 1.00 0.00 C ATOM 276 CD ARG A 19 9.101 8.271 -4.370 1.00 0.00 C ATOM 277 NE ARG A 19 8.249 9.356 -3.891 1.00 0.00 N ATOM 278 CZ ARG A 19 7.780 10.322 -4.673 1.00 0.00 C ATOM 279 NH1 ARG A 19 8.077 10.337 -5.965 1.00 0.00 N ATOM 280 NH2 ARG A 19 7.010 11.275 -4.164 1.00 0.00 N ATOM 0 H ARG A 19 6.856 5.109 -7.350 1.00 0.00 H new ATOM 0 HA ARG A 19 9.664 4.990 -7.548 1.00 0.00 H new ATOM 0 HB2 ARG A 19 10.319 6.620 -5.868 1.00 0.00 H new ATOM 0 HB3 ARG A 19 9.512 7.442 -7.189 1.00 0.00 H new ATOM 0 HG2 ARG A 19 7.641 7.969 -5.916 1.00 0.00 H new ATOM 0 HG3 ARG A 19 7.841 6.597 -4.844 1.00 0.00 H new ATOM 0 HD2 ARG A 19 9.431 7.669 -3.524 1.00 0.00 H new ATOM 0 HD3 ARG A 19 9.995 8.689 -4.832 1.00 0.00 H new ATOM 0 HE ARG A 19 8.000 9.373 -2.902 1.00 0.00 H new ATOM 0 HH11 ARG A 19 8.667 9.605 -6.361 1.00 0.00 H new ATOM 0 HH12 ARG A 19 7.715 11.080 -6.563 1.00 0.00 H new ATOM 0 HH21 ARG A 19 6.777 11.267 -3.171 1.00 0.00 H new ATOM 0 HH22 ARG A 19 6.651 12.016 -4.766 1.00 0.00 H new ATOM 294 N ASN A 20 9.709 3.912 -5.185 1.00 0.00 N ATOM 295 CA ASN A 20 9.604 2.970 -4.077 1.00 0.00 C ATOM 296 C ASN A 20 9.504 3.706 -2.744 1.00 0.00 C ATOM 297 O ASN A 20 10.314 4.583 -2.445 1.00 0.00 O ATOM 298 CB ASN A 20 10.810 2.029 -4.063 1.00 0.00 C ATOM 299 CG ASN A 20 11.121 1.467 -5.437 1.00 0.00 C ATOM 300 OD1 ASN A 20 10.439 1.776 -6.415 1.00 0.00 O ATOM 301 ND2 ASN A 20 12.154 0.637 -5.517 1.00 0.00 N ATOM 0 H ASN A 20 10.665 4.124 -5.469 1.00 0.00 H new ATOM 0 HA ASN A 20 8.696 2.384 -4.217 1.00 0.00 H new ATOM 0 HB2 ASN A 20 11.681 2.565 -3.687 1.00 0.00 H new ATOM 0 HB3 ASN A 20 10.619 1.208 -3.372 1.00 0.00 H new ATOM 0 HD21 ASN A 20 12.411 0.227 -6.415 1.00 0.00 H new ATOM 0 HD22 ASN A 20 12.691 0.409 -4.680 1.00 0.00 H new ATOM 308 N VAL A 21 8.504 3.342 -1.947 1.00 0.00 N ATOM 309 CA VAL A 21 8.299 3.966 -0.645 1.00 0.00 C ATOM 310 C VAL A 21 8.401 2.941 0.478 1.00 0.00 C ATOM 311 O VAL A 21 8.083 1.766 0.291 1.00 0.00 O ATOM 312 CB VAL A 21 6.928 4.663 -0.567 1.00 0.00 C ATOM 313 CG1 VAL A 21 5.807 3.635 -0.532 1.00 0.00 C ATOM 314 CG2 VAL A 21 6.863 5.576 0.648 1.00 0.00 C ATOM 0 H VAL A 21 7.824 2.619 -2.180 1.00 0.00 H new ATOM 0 HA VAL A 21 9.085 4.712 -0.524 1.00 0.00 H new ATOM 0 HB VAL A 21 6.800 5.275 -1.460 1.00 0.00 H new ATOM 0 HG11 VAL A 21 4.846 4.146 -0.477 1.00 0.00 H new ATOM 0 HG12 VAL A 21 5.843 3.027 -1.436 1.00 0.00 H new ATOM 0 HG13 VAL A 21 5.928 2.995 0.342 1.00 0.00 H new ATOM 0 HG21 VAL A 21 5.887 6.060 0.687 1.00 0.00 H new ATOM 0 HG22 VAL A 21 7.013 4.988 1.553 1.00 0.00 H new ATOM 0 HG23 VAL A 21 7.642 6.335 0.575 1.00 0.00 H new ATOM 324 N ASP A 22 8.845 3.393 1.646 1.00 0.00 N ATOM 325 CA ASP A 22 8.988 2.515 2.801 1.00 0.00 C ATOM 326 C ASP A 22 7.845 2.727 3.789 1.00 0.00 C ATOM 327 O ASP A 22 7.501 3.861 4.123 1.00 0.00 O ATOM 328 CB ASP A 22 10.329 2.762 3.494 1.00 0.00 C ATOM 329 CG ASP A 22 10.342 2.263 4.926 1.00 0.00 C ATOM 330 OD1 ASP A 22 10.317 1.031 5.125 1.00 0.00 O ATOM 331 OD2 ASP A 22 10.377 3.106 5.846 1.00 0.00 O ATOM 0 H ASP A 22 9.112 4.362 1.818 1.00 0.00 H new ATOM 0 HA ASP A 22 8.954 1.484 2.449 1.00 0.00 H new ATOM 0 HB2 ASP A 22 11.121 2.267 2.933 1.00 0.00 H new ATOM 0 HB3 ASP A 22 10.549 3.829 3.482 1.00 0.00 H new ATOM 336 N VAL A 23 7.258 1.628 4.252 1.00 0.00 N ATOM 337 CA VAL A 23 6.153 1.693 5.201 1.00 0.00 C ATOM 338 C VAL A 23 6.484 0.936 6.483 1.00 0.00 C ATOM 339 O VAL A 23 7.074 -0.144 6.444 1.00 0.00 O ATOM 340 CB VAL A 23 4.859 1.116 4.597 1.00 0.00 C ATOM 341 CG1 VAL A 23 3.685 1.338 5.538 1.00 0.00 C ATOM 342 CG2 VAL A 23 4.586 1.735 3.235 1.00 0.00 C ATOM 0 H VAL A 23 7.529 0.682 3.985 1.00 0.00 H new ATOM 0 HA VAL A 23 5.998 2.746 5.434 1.00 0.00 H new ATOM 0 HB VAL A 23 4.988 0.042 4.464 1.00 0.00 H new ATOM 0 HG11 VAL A 23 2.780 0.924 5.094 1.00 0.00 H new ATOM 0 HG12 VAL A 23 3.882 0.843 6.489 1.00 0.00 H new ATOM 0 HG13 VAL A 23 3.550 2.407 5.706 1.00 0.00 H new ATOM 0 HG21 VAL A 23 3.668 1.316 2.822 1.00 0.00 H new ATOM 0 HG22 VAL A 23 4.477 2.814 3.341 1.00 0.00 H new ATOM 0 HG23 VAL A 23 5.417 1.519 2.564 1.00 0.00 H new ATOM 352 N VAL A 24 6.100 1.509 7.619 1.00 0.00 N ATOM 353 CA VAL A 24 6.354 0.888 8.913 1.00 0.00 C ATOM 354 C VAL A 24 5.092 0.864 9.768 1.00 0.00 C ATOM 355 O VAL A 24 4.494 1.905 10.041 1.00 0.00 O ATOM 356 CB VAL A 24 7.467 1.626 9.680 1.00 0.00 C ATOM 357 CG1 VAL A 24 7.433 1.258 11.156 1.00 0.00 C ATOM 358 CG2 VAL A 24 8.828 1.313 9.076 1.00 0.00 C ATOM 0 H VAL A 24 5.611 2.403 7.669 1.00 0.00 H new ATOM 0 HA VAL A 24 6.675 -0.135 8.716 1.00 0.00 H new ATOM 0 HB VAL A 24 7.294 2.699 9.593 1.00 0.00 H new ATOM 0 HG11 VAL A 24 8.227 1.789 11.682 1.00 0.00 H new ATOM 0 HG12 VAL A 24 6.468 1.537 11.578 1.00 0.00 H new ATOM 0 HG13 VAL A 24 7.580 0.184 11.267 1.00 0.00 H new ATOM 0 HG21 VAL A 24 9.603 1.843 9.630 1.00 0.00 H new ATOM 0 HG22 VAL A 24 9.012 0.240 9.131 1.00 0.00 H new ATOM 0 HG23 VAL A 24 8.845 1.632 8.034 1.00 0.00 H new ATOM 368 N LEU A 25 4.693 -0.331 10.189 1.00 0.00 N ATOM 369 CA LEU A 25 3.501 -0.492 11.015 1.00 0.00 C ATOM 370 C LEU A 25 3.600 -1.748 11.875 1.00 0.00 C ATOM 371 O LEU A 25 4.053 -2.794 11.412 1.00 0.00 O ATOM 372 CB LEU A 25 2.252 -0.560 10.135 1.00 0.00 C ATOM 373 CG LEU A 25 1.969 -1.910 9.475 1.00 0.00 C ATOM 374 CD1 LEU A 25 0.675 -1.853 8.678 1.00 0.00 C ATOM 375 CD2 LEU A 25 3.130 -2.321 8.582 1.00 0.00 C ATOM 0 H LEU A 25 5.177 -1.202 9.972 1.00 0.00 H new ATOM 0 HA LEU A 25 3.427 0.373 11.674 1.00 0.00 H new ATOM 0 HB2 LEU A 25 1.389 -0.287 10.742 1.00 0.00 H new ATOM 0 HB3 LEU A 25 2.342 0.193 9.352 1.00 0.00 H new ATOM 0 HG LEU A 25 1.857 -2.660 10.258 1.00 0.00 H new ATOM 0 HD11 LEU A 25 0.490 -2.822 8.215 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -0.152 -1.605 9.344 1.00 0.00 H new ATOM 0 HD13 LEU A 25 0.758 -1.091 7.903 1.00 0.00 H new ATOM 0 HD21 LEU A 25 2.911 -3.284 8.121 1.00 0.00 H new ATOM 0 HD22 LEU A 25 3.274 -1.571 7.805 1.00 0.00 H new ATOM 0 HD23 LEU A 25 4.038 -2.403 9.180 1.00 0.00 H new ATOM 387 N GLU A 26 3.173 -1.636 13.129 1.00 0.00 N ATOM 388 CA GLU A 26 3.212 -2.764 14.052 1.00 0.00 C ATOM 389 C GLU A 26 2.457 -3.961 13.482 1.00 0.00 C ATOM 390 O GLU A 26 1.585 -3.808 12.627 1.00 0.00 O ATOM 391 CB GLU A 26 2.614 -2.367 15.404 1.00 0.00 C ATOM 392 CG GLU A 26 3.139 -3.191 16.567 1.00 0.00 C ATOM 393 CD GLU A 26 2.629 -2.698 17.908 1.00 0.00 C ATOM 394 OE1 GLU A 26 2.641 -1.469 18.131 1.00 0.00 O ATOM 395 OE2 GLU A 26 2.219 -3.540 18.733 1.00 0.00 O ATOM 0 H GLU A 26 2.796 -0.776 13.529 1.00 0.00 H new ATOM 0 HA GLU A 26 4.255 -3.048 14.193 1.00 0.00 H new ATOM 0 HB2 GLU A 26 2.826 -1.314 15.591 1.00 0.00 H new ATOM 0 HB3 GLU A 26 1.530 -2.470 15.357 1.00 0.00 H new ATOM 0 HG2 GLU A 26 2.846 -4.232 16.431 1.00 0.00 H new ATOM 0 HG3 GLU A 26 4.229 -3.164 16.564 1.00 0.00 H new ATOM 402 N ASP A 27 2.800 -5.152 13.961 1.00 0.00 N ATOM 403 CA ASP A 27 2.155 -6.376 13.500 1.00 0.00 C ATOM 404 C ASP A 27 0.698 -6.424 13.948 1.00 0.00 C ATOM 405 O ASP A 27 -0.043 -7.342 13.593 1.00 0.00 O ATOM 406 CB ASP A 27 2.904 -7.601 14.026 1.00 0.00 C ATOM 407 CG ASP A 27 2.900 -7.677 15.540 1.00 0.00 C ATOM 408 OD1 ASP A 27 3.472 -6.771 16.181 1.00 0.00 O ATOM 409 OD2 ASP A 27 2.324 -8.642 16.083 1.00 0.00 O ATOM 0 H ASP A 27 3.521 -5.296 14.668 1.00 0.00 H new ATOM 0 HA ASP A 27 2.182 -6.384 12.410 1.00 0.00 H new ATOM 0 HB2 ASP A 27 2.449 -8.504 13.619 1.00 0.00 H new ATOM 0 HB3 ASP A 27 3.934 -7.574 13.669 1.00 0.00 H new ATOM 414 N THR A 28 0.292 -5.430 14.732 1.00 0.00 N ATOM 415 CA THR A 28 -1.076 -5.360 15.231 1.00 0.00 C ATOM 416 C THR A 28 -1.987 -4.646 14.239 1.00 0.00 C ATOM 417 O THR A 28 -3.205 -4.830 14.257 1.00 0.00 O ATOM 418 CB THR A 28 -1.143 -4.633 16.587 1.00 0.00 C ATOM 419 OG1 THR A 28 -0.522 -3.347 16.485 1.00 0.00 O ATOM 420 CG2 THR A 28 -0.456 -5.449 17.673 1.00 0.00 C ATOM 0 H THR A 28 0.891 -4.662 15.035 1.00 0.00 H new ATOM 0 HA THR A 28 -1.418 -6.387 15.360 1.00 0.00 H new ATOM 0 HB THR A 28 -2.192 -4.509 16.856 1.00 0.00 H new ATOM 0 HG1 THR A 28 -0.570 -2.891 17.351 1.00 0.00 H new ATOM 0 HG21 THR A 28 -0.516 -4.916 18.622 1.00 0.00 H new ATOM 0 HG22 THR A 28 -0.950 -6.416 17.769 1.00 0.00 H new ATOM 0 HG23 THR A 28 0.590 -5.600 17.407 1.00 0.00 H new ATOM 428 N CYS A 29 -1.391 -3.833 13.375 1.00 0.00 N ATOM 429 CA CYS A 29 -2.150 -3.091 12.374 1.00 0.00 C ATOM 430 C CYS A 29 -2.759 -4.035 11.343 1.00 0.00 C ATOM 431 O CYS A 29 -2.240 -5.125 11.099 1.00 0.00 O ATOM 432 CB CYS A 29 -1.251 -2.067 11.678 1.00 0.00 C ATOM 433 SG CYS A 29 -0.728 -0.701 12.740 1.00 0.00 S ATOM 0 H CYS A 29 -0.384 -3.670 13.347 1.00 0.00 H new ATOM 0 HA CYS A 29 -2.959 -2.567 12.882 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -0.366 -2.576 11.297 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -1.781 -1.661 10.816 1.00 0.00 H new ATOM 0 HG CYS A 29 -0.347 0.300 12.003 1.00 0.00 H new ATOM 439 N THR A 30 -3.866 -3.610 10.741 1.00 0.00 N ATOM 440 CA THR A 30 -4.548 -4.419 9.738 1.00 0.00 C ATOM 441 C THR A 30 -3.922 -4.232 8.362 1.00 0.00 C ATOM 442 O THR A 30 -3.508 -3.130 8.001 1.00 0.00 O ATOM 443 CB THR A 30 -6.046 -4.069 9.660 1.00 0.00 C ATOM 444 OG1 THR A 30 -6.556 -3.800 10.971 1.00 0.00 O ATOM 445 CG2 THR A 30 -6.835 -5.206 9.027 1.00 0.00 C ATOM 0 H THR A 30 -4.309 -2.711 10.931 1.00 0.00 H new ATOM 0 HA THR A 30 -4.440 -5.460 10.044 1.00 0.00 H new ATOM 0 HB THR A 30 -6.157 -3.180 9.039 1.00 0.00 H new ATOM 0 HG1 THR A 30 -7.508 -3.577 10.912 1.00 0.00 H new ATOM 0 HG21 THR A 30 -7.890 -4.936 8.983 1.00 0.00 H new ATOM 0 HG22 THR A 30 -6.464 -5.389 8.018 1.00 0.00 H new ATOM 0 HG23 THR A 30 -6.716 -6.109 9.626 1.00 0.00 H new ATOM 453 N VAL A 31 -3.854 -5.315 7.595 1.00 0.00 N ATOM 454 CA VAL A 31 -3.279 -5.270 6.256 1.00 0.00 C ATOM 455 C VAL A 31 -3.863 -4.118 5.446 1.00 0.00 C ATOM 456 O VAL A 31 -3.240 -3.630 4.503 1.00 0.00 O ATOM 457 CB VAL A 31 -3.519 -6.589 5.497 1.00 0.00 C ATOM 458 CG1 VAL A 31 -2.750 -7.728 6.150 1.00 0.00 C ATOM 459 CG2 VAL A 31 -5.005 -6.905 5.435 1.00 0.00 C ATOM 0 H VAL A 31 -4.190 -6.235 7.878 1.00 0.00 H new ATOM 0 HA VAL A 31 -2.206 -5.119 6.377 1.00 0.00 H new ATOM 0 HB VAL A 31 -3.153 -6.473 4.477 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -2.932 -8.652 5.600 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -1.684 -7.502 6.137 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -3.083 -7.848 7.181 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -5.156 -7.840 4.895 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -5.399 -7.002 6.447 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -5.527 -6.100 4.918 1.00 0.00 H new ATOM 469 N GLY A 32 -5.064 -3.687 5.820 1.00 0.00 N ATOM 470 CA GLY A 32 -5.712 -2.594 5.119 1.00 0.00 C ATOM 471 C GLY A 32 -5.007 -1.269 5.332 1.00 0.00 C ATOM 472 O GLY A 32 -5.015 -0.407 4.454 1.00 0.00 O ATOM 0 H GLY A 32 -5.600 -4.075 6.596 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -5.743 -2.818 4.053 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -6.745 -2.511 5.458 1.00 0.00 H new ATOM 476 N GLU A 33 -4.397 -1.106 6.502 1.00 0.00 N ATOM 477 CA GLU A 33 -3.687 0.125 6.827 1.00 0.00 C ATOM 478 C GLU A 33 -2.679 0.476 5.737 1.00 0.00 C ATOM 479 O GLU A 33 -2.794 1.512 5.081 1.00 0.00 O ATOM 480 CB GLU A 33 -2.973 -0.013 8.174 1.00 0.00 C ATOM 481 CG GLU A 33 -3.832 0.385 9.362 1.00 0.00 C ATOM 482 CD GLU A 33 -4.325 1.816 9.272 1.00 0.00 C ATOM 483 OE1 GLU A 33 -5.365 2.046 8.620 1.00 0.00 O ATOM 484 OE2 GLU A 33 -3.671 2.707 9.855 1.00 0.00 O ATOM 0 H GLU A 33 -4.380 -1.810 7.240 1.00 0.00 H new ATOM 0 HA GLU A 33 -4.419 0.930 6.893 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -2.650 -1.046 8.300 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -2.074 0.603 8.164 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -4.688 -0.287 9.428 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -3.257 0.260 10.280 1.00 0.00 H new ATOM 491 N ILE A 34 -1.691 -0.393 5.551 1.00 0.00 N ATOM 492 CA ILE A 34 -0.663 -0.175 4.542 1.00 0.00 C ATOM 493 C ILE A 34 -1.239 0.515 3.310 1.00 0.00 C ATOM 494 O ILE A 34 -0.606 1.393 2.723 1.00 0.00 O ATOM 495 CB ILE A 34 -0.006 -1.501 4.113 1.00 0.00 C ATOM 496 CG1 ILE A 34 0.394 -2.318 5.342 1.00 0.00 C ATOM 497 CG2 ILE A 34 1.205 -1.231 3.232 1.00 0.00 C ATOM 498 CD1 ILE A 34 1.265 -3.511 5.017 1.00 0.00 C ATOM 0 H ILE A 34 -1.581 -1.254 6.086 1.00 0.00 H new ATOM 0 HA ILE A 34 0.093 0.467 4.995 1.00 0.00 H new ATOM 0 HB ILE A 34 -0.729 -2.078 3.536 1.00 0.00 H new ATOM 0 HG12 ILE A 34 0.924 -1.671 6.041 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -0.508 -2.664 5.848 1.00 0.00 H new ATOM 0 HG21 ILE A 34 1.659 -2.177 2.937 1.00 0.00 H new ATOM 0 HG22 ILE A 34 0.893 -0.685 2.342 1.00 0.00 H new ATOM 0 HG23 ILE A 34 1.932 -0.637 3.785 1.00 0.00 H new ATOM 0 HD11 ILE A 34 1.510 -4.044 5.936 1.00 0.00 H new ATOM 0 HD12 ILE A 34 0.730 -4.179 4.342 1.00 0.00 H new ATOM 0 HD13 ILE A 34 2.184 -3.171 4.539 1.00 0.00 H new ATOM 510 N LYS A 35 -2.446 0.115 2.925 1.00 0.00 N ATOM 511 CA LYS A 35 -3.112 0.697 1.765 1.00 0.00 C ATOM 512 C LYS A 35 -3.360 2.188 1.971 1.00 0.00 C ATOM 513 O LYS A 35 -2.816 3.022 1.248 1.00 0.00 O ATOM 514 CB LYS A 35 -4.437 -0.020 1.499 1.00 0.00 C ATOM 515 CG LYS A 35 -4.292 -1.521 1.320 1.00 0.00 C ATOM 516 CD LYS A 35 -5.567 -2.145 0.780 1.00 0.00 C ATOM 517 CE LYS A 35 -5.573 -2.172 -0.741 1.00 0.00 C ATOM 518 NZ LYS A 35 -6.954 -2.092 -1.292 1.00 0.00 N ATOM 0 H LYS A 35 -2.984 -0.610 3.399 1.00 0.00 H new ATOM 0 HA LYS A 35 -2.459 0.572 0.901 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -5.118 0.174 2.327 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -4.895 0.401 0.604 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -3.467 -1.729 0.638 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -4.038 -1.979 2.276 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -5.667 -3.160 1.163 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -6.429 -1.582 1.138 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -4.982 -1.339 -1.121 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -5.095 -3.088 -1.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -6.925 -1.665 -2.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -7.358 -3.048 -1.355 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -7.544 -1.507 -0.666 1.00 0.00 H new ATOM 532 N GLN A 36 -4.183 2.514 2.962 1.00 0.00 N ATOM 533 CA GLN A 36 -4.502 3.905 3.263 1.00 0.00 C ATOM 534 C GLN A 36 -3.234 4.710 3.524 1.00 0.00 C ATOM 535 O GLN A 36 -3.134 5.873 3.133 1.00 0.00 O ATOM 536 CB GLN A 36 -5.431 3.987 4.475 1.00 0.00 C ATOM 537 CG GLN A 36 -5.822 5.408 4.848 1.00 0.00 C ATOM 538 CD GLN A 36 -7.162 5.478 5.553 1.00 0.00 C ATOM 539 OE1 GLN A 36 -7.231 5.739 6.755 1.00 0.00 O ATOM 540 NE2 GLN A 36 -8.237 5.246 4.809 1.00 0.00 N ATOM 0 H GLN A 36 -4.641 1.835 3.570 1.00 0.00 H new ATOM 0 HA GLN A 36 -5.009 4.331 2.397 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -6.334 3.413 4.269 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -4.943 3.518 5.329 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -5.054 5.835 5.493 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -5.858 6.020 3.946 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -8.134 5.033 3.817 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -9.166 5.280 5.230 1.00 0.00 H new ATOM 549 N ILE A 37 -2.268 4.084 4.187 1.00 0.00 N ATOM 550 CA ILE A 37 -1.005 4.742 4.500 1.00 0.00 C ATOM 551 C ILE A 37 -0.302 5.212 3.231 1.00 0.00 C ATOM 552 O ILE A 37 0.178 6.345 3.157 1.00 0.00 O ATOM 553 CB ILE A 37 -0.062 3.809 5.281 1.00 0.00 C ATOM 554 CG1 ILE A 37 -0.587 3.589 6.701 1.00 0.00 C ATOM 555 CG2 ILE A 37 1.346 4.386 5.314 1.00 0.00 C ATOM 556 CD1 ILE A 37 0.149 2.504 7.456 1.00 0.00 C ATOM 0 H ILE A 37 -2.335 3.122 4.518 1.00 0.00 H new ATOM 0 HA ILE A 37 -1.244 5.605 5.121 1.00 0.00 H new ATOM 0 HB ILE A 37 -0.027 2.845 4.774 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -0.510 4.523 7.257 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -1.645 3.333 6.653 1.00 0.00 H new ATOM 0 HG21 ILE A 37 2.001 3.715 5.870 1.00 0.00 H new ATOM 0 HG22 ILE A 37 1.718 4.496 4.295 1.00 0.00 H new ATOM 0 HG23 ILE A 37 1.328 5.361 5.801 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -0.276 2.403 8.454 1.00 0.00 H new ATOM 0 HD12 ILE A 37 0.051 1.559 6.922 1.00 0.00 H new ATOM 0 HD13 ILE A 37 1.204 2.768 7.536 1.00 0.00 H new ATOM 568 N LEU A 38 -0.245 4.337 2.234 1.00 0.00 N ATOM 569 CA LEU A 38 0.399 4.662 0.965 1.00 0.00 C ATOM 570 C LEU A 38 -0.239 5.895 0.332 1.00 0.00 C ATOM 571 O LEU A 38 0.387 6.586 -0.470 1.00 0.00 O ATOM 572 CB LEU A 38 0.307 3.475 0.005 1.00 0.00 C ATOM 573 CG LEU A 38 1.285 2.328 0.260 1.00 0.00 C ATOM 574 CD1 LEU A 38 0.899 1.106 -0.558 1.00 0.00 C ATOM 575 CD2 LEU A 38 2.708 2.760 -0.061 1.00 0.00 C ATOM 0 H LEU A 38 -0.637 3.396 2.279 1.00 0.00 H new ATOM 0 HA LEU A 38 1.449 4.880 1.163 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -0.707 3.077 0.047 1.00 0.00 H new ATOM 0 HB3 LEU A 38 0.464 3.841 -1.010 1.00 0.00 H new ATOM 0 HG LEU A 38 1.237 2.062 1.316 1.00 0.00 H new ATOM 0 HD11 LEU A 38 1.606 0.300 -0.364 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -0.104 0.784 -0.279 1.00 0.00 H new ATOM 0 HD13 LEU A 38 0.918 1.357 -1.618 1.00 0.00 H new ATOM 0 HD21 LEU A 38 3.391 1.931 0.126 1.00 0.00 H new ATOM 0 HD22 LEU A 38 2.772 3.053 -1.109 1.00 0.00 H new ATOM 0 HD23 LEU A 38 2.982 3.606 0.569 1.00 0.00 H new ATOM 587 N GLU A 39 -1.488 6.164 0.700 1.00 0.00 N ATOM 588 CA GLU A 39 -2.209 7.314 0.167 1.00 0.00 C ATOM 589 C GLU A 39 -1.760 8.602 0.851 1.00 0.00 C ATOM 590 O GLU A 39 -2.050 9.701 0.380 1.00 0.00 O ATOM 591 CB GLU A 39 -3.717 7.127 0.349 1.00 0.00 C ATOM 592 CG GLU A 39 -4.539 8.316 -0.119 1.00 0.00 C ATOM 593 CD GLU A 39 -6.022 8.140 0.144 1.00 0.00 C ATOM 594 OE1 GLU A 39 -6.378 7.663 1.241 1.00 0.00 O ATOM 595 OE2 GLU A 39 -6.826 8.481 -0.749 1.00 0.00 O ATOM 0 H GLU A 39 -2.021 5.602 1.364 1.00 0.00 H new ATOM 0 HA GLU A 39 -1.985 7.390 -0.897 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -4.033 6.239 -0.199 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -3.927 6.943 1.403 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -4.189 9.216 0.386 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -4.378 8.466 -1.187 1.00 0.00 H new ATOM 602 N ASN A 40 -1.050 8.457 1.965 1.00 0.00 N ATOM 603 CA ASN A 40 -0.561 9.608 2.715 1.00 0.00 C ATOM 604 C ASN A 40 0.863 9.964 2.298 1.00 0.00 C ATOM 605 O ASN A 40 1.409 10.980 2.726 1.00 0.00 O ATOM 606 CB ASN A 40 -0.608 9.321 4.218 1.00 0.00 C ATOM 607 CG ASN A 40 -2.024 9.144 4.729 1.00 0.00 C ATOM 608 OD1 ASN A 40 -2.967 9.021 3.947 1.00 0.00 O ATOM 609 ND2 ASN A 40 -2.180 9.131 6.048 1.00 0.00 N ATOM 0 H ASN A 40 -0.800 7.554 2.368 1.00 0.00 H new ATOM 0 HA ASN A 40 -1.208 10.457 2.493 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -0.033 8.420 4.431 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -0.130 10.139 4.756 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -3.110 9.016 6.450 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -1.370 9.236 6.658 1.00 0.00 H new ATOM 616 N GLU A 41 1.457 9.120 1.460 1.00 0.00 N ATOM 617 CA GLU A 41 2.817 9.347 0.986 1.00 0.00 C ATOM 618 C GLU A 41 2.843 9.509 -0.531 1.00 0.00 C ATOM 619 O GLU A 41 3.646 10.273 -1.071 1.00 0.00 O ATOM 620 CB GLU A 41 3.725 8.188 1.401 1.00 0.00 C ATOM 621 CG GLU A 41 3.872 8.039 2.906 1.00 0.00 C ATOM 622 CD GLU A 41 4.724 9.132 3.520 1.00 0.00 C ATOM 623 OE1 GLU A 41 5.885 9.293 3.086 1.00 0.00 O ATOM 624 OE2 GLU A 41 4.232 9.827 4.434 1.00 0.00 O ATOM 0 H GLU A 41 1.018 8.274 1.096 1.00 0.00 H new ATOM 0 HA GLU A 41 3.184 10.268 1.440 1.00 0.00 H new ATOM 0 HB2 GLU A 41 3.327 7.260 0.990 1.00 0.00 H new ATOM 0 HB3 GLU A 41 4.711 8.335 0.961 1.00 0.00 H new ATOM 0 HG2 GLU A 41 2.884 8.052 3.367 1.00 0.00 H new ATOM 0 HG3 GLU A 41 4.316 7.069 3.130 1.00 0.00 H new ATOM 631 N LEU A 42 1.962 8.787 -1.214 1.00 0.00 N ATOM 632 CA LEU A 42 1.884 8.849 -2.669 1.00 0.00 C ATOM 633 C LEU A 42 0.631 9.597 -3.115 1.00 0.00 C ATOM 634 O LEU A 42 0.422 9.820 -4.307 1.00 0.00 O ATOM 635 CB LEU A 42 1.888 7.439 -3.261 1.00 0.00 C ATOM 636 CG LEU A 42 3.045 6.535 -2.833 1.00 0.00 C ATOM 637 CD1 LEU A 42 2.756 5.088 -3.202 1.00 0.00 C ATOM 638 CD2 LEU A 42 4.348 7.000 -3.468 1.00 0.00 C ATOM 0 H LEU A 42 1.291 8.151 -0.783 1.00 0.00 H new ATOM 0 HA LEU A 42 2.757 9.391 -3.032 1.00 0.00 H new ATOM 0 HB2 LEU A 42 0.952 6.950 -2.990 1.00 0.00 H new ATOM 0 HB3 LEU A 42 1.901 7.523 -4.348 1.00 0.00 H new ATOM 0 HG LEU A 42 3.149 6.598 -1.750 1.00 0.00 H new ATOM 0 HD11 LEU A 42 3.590 4.459 -2.890 1.00 0.00 H new ATOM 0 HD12 LEU A 42 1.846 4.759 -2.700 1.00 0.00 H new ATOM 0 HD13 LEU A 42 2.625 5.007 -4.281 1.00 0.00 H new ATOM 0 HD21 LEU A 42 5.160 6.345 -3.152 1.00 0.00 H new ATOM 0 HD22 LEU A 42 4.256 6.967 -4.554 1.00 0.00 H new ATOM 0 HD23 LEU A 42 4.562 8.021 -3.153 1.00 0.00 H new ATOM 650 N GLN A 43 -0.197 9.982 -2.150 1.00 0.00 N ATOM 651 CA GLN A 43 -1.429 10.705 -2.444 1.00 0.00 C ATOM 652 C GLN A 43 -2.306 9.917 -3.411 1.00 0.00 C ATOM 653 O GLN A 43 -3.086 10.494 -4.169 1.00 0.00 O ATOM 654 CB GLN A 43 -1.109 12.080 -3.033 1.00 0.00 C ATOM 655 CG GLN A 43 -0.515 13.051 -2.025 1.00 0.00 C ATOM 656 CD GLN A 43 0.995 12.945 -1.932 1.00 0.00 C ATOM 657 OE1 GLN A 43 1.474 12.058 -1.069 1.00 0.00 O flip ATOM 658 NE2 GLN A 43 1.722 13.653 -2.629 1.00 0.00 N flip ATOM 0 H GLN A 43 -0.038 9.806 -1.158 1.00 0.00 H new ATOM 0 HA GLN A 43 -1.976 10.835 -1.510 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -0.411 11.958 -3.862 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -2.021 12.511 -3.445 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -0.787 14.069 -2.303 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -0.950 12.861 -1.044 1.00 0.00 H new ATOM 0 HE21 GLN A 43 1.310 14.322 -3.280 1.00 0.00 H new ATOM 0 HE22 GLN A 43 2.736 13.571 -2.556 1.00 0.00 H new ATOM 667 N ILE A 44 -2.173 8.595 -3.378 1.00 0.00 N ATOM 668 CA ILE A 44 -2.954 7.728 -4.251 1.00 0.00 C ATOM 669 C ILE A 44 -4.131 7.111 -3.503 1.00 0.00 C ATOM 670 O ILE A 44 -4.002 6.639 -2.373 1.00 0.00 O ATOM 671 CB ILE A 44 -2.090 6.600 -4.845 1.00 0.00 C ATOM 672 CG1 ILE A 44 -0.881 7.186 -5.577 1.00 0.00 C ATOM 673 CG2 ILE A 44 -2.918 5.736 -5.784 1.00 0.00 C ATOM 674 CD1 ILE A 44 -0.017 6.142 -6.250 1.00 0.00 C ATOM 0 H ILE A 44 -1.532 8.102 -2.756 1.00 0.00 H new ATOM 0 HA ILE A 44 -3.329 8.353 -5.062 1.00 0.00 H new ATOM 0 HB ILE A 44 -1.729 5.972 -4.031 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -1.230 7.896 -6.327 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -0.273 7.746 -4.867 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -2.293 4.944 -6.195 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -3.749 5.294 -5.234 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -3.306 6.350 -6.596 1.00 0.00 H new ATOM 0 HD11 ILE A 44 0.821 6.629 -6.749 1.00 0.00 H new ATOM 0 HD12 ILE A 44 0.362 5.446 -5.502 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -0.610 5.598 -6.985 1.00 0.00 H new ATOM 686 N PRO A 45 -5.308 7.111 -4.147 1.00 0.00 N ATOM 687 CA PRO A 45 -6.530 6.553 -3.562 1.00 0.00 C ATOM 688 C PRO A 45 -6.479 5.033 -3.453 1.00 0.00 C ATOM 689 O PRO A 45 -6.113 4.344 -4.406 1.00 0.00 O ATOM 690 CB PRO A 45 -7.622 6.982 -4.545 1.00 0.00 C ATOM 691 CG PRO A 45 -6.913 7.164 -5.842 1.00 0.00 C ATOM 692 CD PRO A 45 -5.535 7.656 -5.496 1.00 0.00 C ATOM 0 HA PRO A 45 -6.692 6.906 -2.543 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -8.403 6.226 -4.624 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -8.103 7.906 -4.224 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -6.865 6.226 -6.395 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -7.436 7.881 -6.475 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -4.790 7.296 -6.206 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -5.483 8.745 -5.504 1.00 0.00 H new ATOM 700 N VAL A 46 -6.848 4.515 -2.286 1.00 0.00 N ATOM 701 CA VAL A 46 -6.846 3.075 -2.053 1.00 0.00 C ATOM 702 C VAL A 46 -7.757 2.357 -3.043 1.00 0.00 C ATOM 703 O VAL A 46 -7.632 1.151 -3.254 1.00 0.00 O ATOM 704 CB VAL A 46 -7.297 2.738 -0.620 1.00 0.00 C ATOM 705 CG1 VAL A 46 -7.288 1.233 -0.397 1.00 0.00 C ATOM 706 CG2 VAL A 46 -6.410 3.440 0.397 1.00 0.00 C ATOM 0 H VAL A 46 -7.152 5.071 -1.487 1.00 0.00 H new ATOM 0 HA VAL A 46 -5.821 2.733 -2.193 1.00 0.00 H new ATOM 0 HB VAL A 46 -8.318 3.095 -0.486 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -7.610 1.014 0.621 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -7.968 0.757 -1.103 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -6.279 0.849 -0.550 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -6.743 3.190 1.404 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -5.378 3.115 0.265 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -6.472 4.518 0.251 1.00 0.00 H new ATOM 716 N SER A 47 -8.672 3.107 -3.648 1.00 0.00 N ATOM 717 CA SER A 47 -9.607 2.542 -4.614 1.00 0.00 C ATOM 718 C SER A 47 -8.913 2.265 -5.944 1.00 0.00 C ATOM 719 O SER A 47 -9.375 1.448 -6.741 1.00 0.00 O ATOM 720 CB SER A 47 -10.787 3.491 -4.829 1.00 0.00 C ATOM 721 OG SER A 47 -11.733 3.375 -3.781 1.00 0.00 O ATOM 0 H SER A 47 -8.786 4.108 -3.486 1.00 0.00 H new ATOM 0 HA SER A 47 -9.978 1.598 -4.214 1.00 0.00 H new ATOM 0 HB2 SER A 47 -10.426 4.518 -4.885 1.00 0.00 H new ATOM 0 HB3 SER A 47 -11.267 3.269 -5.782 1.00 0.00 H new ATOM 0 HG SER A 47 -12.476 3.993 -3.941 1.00 0.00 H new ATOM 727 N LYS A 48 -7.799 2.951 -6.177 1.00 0.00 N ATOM 728 CA LYS A 48 -7.038 2.781 -7.409 1.00 0.00 C ATOM 729 C LYS A 48 -5.748 2.010 -7.148 1.00 0.00 C ATOM 730 O LYS A 48 -4.944 1.803 -8.057 1.00 0.00 O ATOM 731 CB LYS A 48 -6.715 4.143 -8.026 1.00 0.00 C ATOM 732 CG LYS A 48 -7.943 4.997 -8.292 1.00 0.00 C ATOM 733 CD LYS A 48 -8.471 4.789 -9.702 1.00 0.00 C ATOM 734 CE LYS A 48 -9.876 5.351 -9.859 1.00 0.00 C ATOM 735 NZ LYS A 48 -10.225 5.581 -11.288 1.00 0.00 N ATOM 0 H LYS A 48 -7.403 3.631 -5.528 1.00 0.00 H new ATOM 0 HA LYS A 48 -7.648 2.209 -8.108 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -6.044 4.684 -7.359 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -6.179 3.990 -8.963 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -8.722 4.751 -7.571 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -7.695 6.048 -8.147 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -7.803 5.270 -10.417 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -8.475 3.725 -9.937 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -10.595 4.661 -9.416 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -9.955 6.289 -9.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -11.190 5.964 -11.352 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -9.555 6.259 -11.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -10.175 4.681 -11.807 1.00 0.00 H new ATOM 749 N MET A 49 -5.557 1.586 -5.903 1.00 0.00 N ATOM 750 CA MET A 49 -4.365 0.836 -5.525 1.00 0.00 C ATOM 751 C MET A 49 -4.721 -0.602 -5.160 1.00 0.00 C ATOM 752 O MET A 49 -5.703 -0.850 -4.459 1.00 0.00 O ATOM 753 CB MET A 49 -3.661 1.514 -4.348 1.00 0.00 C ATOM 754 CG MET A 49 -3.473 3.011 -4.534 1.00 0.00 C ATOM 755 SD MET A 49 -3.687 3.933 -2.999 1.00 0.00 S ATOM 756 CE MET A 49 -2.234 3.418 -2.089 1.00 0.00 C ATOM 0 H MET A 49 -6.213 1.749 -5.139 1.00 0.00 H new ATOM 0 HA MET A 49 -3.690 0.819 -6.381 1.00 0.00 H new ATOM 0 HB2 MET A 49 -4.238 1.338 -3.440 1.00 0.00 H new ATOM 0 HB3 MET A 49 -2.686 1.049 -4.201 1.00 0.00 H new ATOM 0 HG2 MET A 49 -2.476 3.202 -4.932 1.00 0.00 H new ATOM 0 HG3 MET A 49 -4.186 3.374 -5.274 1.00 0.00 H new ATOM 0 HE1 MET A 49 -1.757 4.290 -1.642 1.00 0.00 H new ATOM 0 HE2 MET A 49 -2.525 2.721 -1.303 1.00 0.00 H new ATOM 0 HE3 MET A 49 -1.534 2.929 -2.767 1.00 0.00 H new ATOM 766 N LEU A 50 -3.918 -1.545 -5.639 1.00 0.00 N ATOM 767 CA LEU A 50 -4.149 -2.959 -5.363 1.00 0.00 C ATOM 768 C LEU A 50 -2.964 -3.570 -4.622 1.00 0.00 C ATOM 769 O LEU A 50 -1.919 -3.840 -5.216 1.00 0.00 O ATOM 770 CB LEU A 50 -4.397 -3.720 -6.667 1.00 0.00 C ATOM 771 CG LEU A 50 -5.386 -3.078 -7.641 1.00 0.00 C ATOM 772 CD1 LEU A 50 -5.163 -3.602 -9.051 1.00 0.00 C ATOM 773 CD2 LEU A 50 -6.818 -3.337 -7.194 1.00 0.00 C ATOM 0 H LEU A 50 -3.101 -1.357 -6.220 1.00 0.00 H new ATOM 0 HA LEU A 50 -5.032 -3.040 -4.729 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -3.443 -3.844 -7.179 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -4.758 -4.718 -6.419 1.00 0.00 H new ATOM 0 HG LEU A 50 -5.216 -2.001 -7.645 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -5.876 -3.134 -9.730 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -4.148 -3.366 -9.371 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -5.305 -4.683 -9.064 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -7.509 -2.873 -7.898 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -7.000 -4.411 -7.161 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -6.972 -2.912 -6.202 1.00 0.00 H new ATOM 785 N LEU A 51 -3.133 -3.786 -3.323 1.00 0.00 N ATOM 786 CA LEU A 51 -2.078 -4.368 -2.500 1.00 0.00 C ATOM 787 C LEU A 51 -1.797 -5.809 -2.913 1.00 0.00 C ATOM 788 O LEU A 51 -2.688 -6.658 -2.889 1.00 0.00 O ATOM 789 CB LEU A 51 -2.469 -4.316 -1.022 1.00 0.00 C ATOM 790 CG LEU A 51 -1.312 -4.282 -0.023 1.00 0.00 C ATOM 791 CD1 LEU A 51 -0.243 -5.291 -0.409 1.00 0.00 C ATOM 792 CD2 LEU A 51 -0.722 -2.882 0.062 1.00 0.00 C ATOM 0 H LEU A 51 -3.991 -3.567 -2.816 1.00 0.00 H new ATOM 0 HA LEU A 51 -1.171 -3.783 -2.650 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -3.088 -3.433 -0.861 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -3.089 -5.184 -0.800 1.00 0.00 H new ATOM 0 HG LEU A 51 -1.698 -4.552 0.960 1.00 0.00 H new ATOM 0 HD11 LEU A 51 0.572 -5.252 0.314 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -0.674 -6.292 -0.417 1.00 0.00 H new ATOM 0 HD13 LEU A 51 0.140 -5.053 -1.401 1.00 0.00 H new ATOM 0 HD21 LEU A 51 0.100 -2.876 0.778 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -0.352 -2.583 -0.919 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -1.491 -2.182 0.388 1.00 0.00 H new ATOM 804 N LYS A 52 -0.552 -6.079 -3.291 1.00 0.00 N ATOM 805 CA LYS A 52 -0.151 -7.418 -3.706 1.00 0.00 C ATOM 806 C LYS A 52 1.203 -7.790 -3.111 1.00 0.00 C ATOM 807 O LYS A 52 1.862 -6.965 -2.478 1.00 0.00 O ATOM 808 CB LYS A 52 -0.090 -7.504 -5.232 1.00 0.00 C ATOM 809 CG LYS A 52 -1.453 -7.642 -5.889 1.00 0.00 C ATOM 810 CD LYS A 52 -1.350 -7.591 -7.404 1.00 0.00 C ATOM 811 CE LYS A 52 -2.724 -7.563 -8.055 1.00 0.00 C ATOM 812 NZ LYS A 52 -2.702 -8.154 -9.422 1.00 0.00 N ATOM 0 H LYS A 52 0.197 -5.387 -3.318 1.00 0.00 H new ATOM 0 HA LYS A 52 -0.896 -8.123 -3.338 1.00 0.00 H new ATOM 0 HB2 LYS A 52 0.401 -6.611 -5.618 1.00 0.00 H new ATOM 0 HB3 LYS A 52 0.528 -8.356 -5.515 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -1.910 -8.584 -5.586 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -2.108 -6.843 -5.541 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -0.787 -6.707 -7.702 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -0.794 -8.458 -7.761 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -3.432 -8.112 -7.433 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -3.079 -6.534 -8.110 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -3.657 -8.116 -9.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -2.046 -7.615 -10.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -2.388 -9.144 -9.367 1.00 0.00 H new ATOM 826 N GLY A 53 1.615 -9.037 -3.319 1.00 0.00 N ATOM 827 CA GLY A 53 2.889 -9.495 -2.798 1.00 0.00 C ATOM 828 C GLY A 53 2.729 -10.507 -1.682 1.00 0.00 C ATOM 829 O GLY A 53 3.593 -11.361 -1.481 1.00 0.00 O ATOM 0 H GLY A 53 1.088 -9.738 -3.840 1.00 0.00 H new ATOM 0 HA2 GLY A 53 3.470 -9.939 -3.606 1.00 0.00 H new ATOM 0 HA3 GLY A 53 3.456 -8.640 -2.430 1.00 0.00 H new ATOM 833 N TRP A 54 1.623 -10.412 -0.953 1.00 0.00 N ATOM 834 CA TRP A 54 1.354 -11.326 0.151 1.00 0.00 C ATOM 835 C TRP A 54 1.873 -12.725 -0.162 1.00 0.00 C ATOM 836 O TRP A 54 1.459 -13.347 -1.141 1.00 0.00 O ATOM 837 CB TRP A 54 -0.147 -11.379 0.442 1.00 0.00 C ATOM 838 CG TRP A 54 -0.715 -10.060 0.871 1.00 0.00 C ATOM 839 CD1 TRP A 54 -1.649 -9.316 0.208 1.00 0.00 C ATOM 840 CD2 TRP A 54 -0.385 -9.330 2.057 1.00 0.00 C ATOM 841 NE1 TRP A 54 -1.919 -8.166 0.911 1.00 0.00 N ATOM 842 CE2 TRP A 54 -1.158 -8.152 2.050 1.00 0.00 C ATOM 843 CE3 TRP A 54 0.485 -9.557 3.126 1.00 0.00 C ATOM 844 CZ2 TRP A 54 -1.082 -7.206 3.069 1.00 0.00 C ATOM 845 CZ3 TRP A 54 0.559 -8.618 4.137 1.00 0.00 C ATOM 846 CH2 TRP A 54 -0.221 -7.455 4.103 1.00 0.00 C ATOM 0 H TRP A 54 0.898 -9.711 -1.106 1.00 0.00 H new ATOM 0 HA TRP A 54 1.875 -10.954 1.033 1.00 0.00 H new ATOM 0 HB2 TRP A 54 -0.671 -11.719 -0.451 1.00 0.00 H new ATOM 0 HB3 TRP A 54 -0.333 -12.118 1.222 1.00 0.00 H new ATOM 0 HD1 TRP A 54 -2.108 -9.591 -0.730 1.00 0.00 H new ATOM 0 HE1 TRP A 54 -2.579 -7.441 0.630 1.00 0.00 H new ATOM 0 HE3 TRP A 54 1.090 -10.451 3.162 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 -1.681 -6.308 3.044 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 1.229 -8.784 4.967 1.00 0.00 H new ATOM 0 HH2 TRP A 54 -0.141 -6.741 4.909 1.00 0.00 H new ATOM 857 N LYS A 55 2.781 -13.216 0.674 1.00 0.00 N ATOM 858 CA LYS A 55 3.356 -14.543 0.488 1.00 0.00 C ATOM 859 C LYS A 55 2.280 -15.553 0.102 1.00 0.00 C ATOM 860 O LYS A 55 2.428 -16.292 -0.872 1.00 0.00 O ATOM 861 CB LYS A 55 4.063 -14.998 1.766 1.00 0.00 C ATOM 862 CG LYS A 55 5.108 -16.075 1.532 1.00 0.00 C ATOM 863 CD LYS A 55 4.467 -17.423 1.249 1.00 0.00 C ATOM 864 CE LYS A 55 5.471 -18.558 1.383 1.00 0.00 C ATOM 865 NZ LYS A 55 4.890 -19.864 0.967 1.00 0.00 N ATOM 0 H LYS A 55 3.135 -12.714 1.488 1.00 0.00 H new ATOM 0 HA LYS A 55 4.083 -14.487 -0.322 1.00 0.00 H new ATOM 0 HB2 LYS A 55 4.540 -14.137 2.234 1.00 0.00 H new ATOM 0 HB3 LYS A 55 3.319 -15.372 2.469 1.00 0.00 H new ATOM 0 HG2 LYS A 55 5.743 -15.790 0.693 1.00 0.00 H new ATOM 0 HG3 LYS A 55 5.752 -16.154 2.408 1.00 0.00 H new ATOM 0 HD2 LYS A 55 3.639 -17.585 1.939 1.00 0.00 H new ATOM 0 HD3 LYS A 55 4.048 -17.424 0.243 1.00 0.00 H new ATOM 0 HE2 LYS A 55 6.349 -18.340 0.774 1.00 0.00 H new ATOM 0 HE3 LYS A 55 5.809 -18.624 2.417 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 5.605 -20.612 1.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 4.068 -20.084 1.564 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 4.591 -19.810 -0.028 1.00 0.00 H new ATOM 879 N THR A 56 1.196 -15.578 0.870 1.00 0.00 N ATOM 880 CA THR A 56 0.095 -16.497 0.608 1.00 0.00 C ATOM 881 C THR A 56 -0.994 -15.827 -0.222 1.00 0.00 C ATOM 882 O THR A 56 -1.689 -14.931 0.254 1.00 0.00 O ATOM 883 CB THR A 56 -0.523 -17.021 1.918 1.00 0.00 C ATOM 884 OG1 THR A 56 -1.565 -17.960 1.627 1.00 0.00 O ATOM 885 CG2 THR A 56 -1.084 -15.876 2.748 1.00 0.00 C ATOM 0 H THR A 56 1.057 -14.972 1.679 1.00 0.00 H new ATOM 0 HA THR A 56 0.509 -17.336 0.049 1.00 0.00 H new ATOM 0 HB THR A 56 0.261 -17.515 2.492 1.00 0.00 H new ATOM 0 HG1 THR A 56 -1.952 -18.290 2.465 1.00 0.00 H new ATOM 0 HG21 THR A 56 -1.515 -16.271 3.668 1.00 0.00 H new ATOM 0 HG22 THR A 56 -0.284 -15.178 2.993 1.00 0.00 H new ATOM 0 HG23 THR A 56 -1.856 -15.358 2.179 1.00 0.00 H new ATOM 893 N GLY A 57 -1.138 -16.270 -1.468 1.00 0.00 N ATOM 894 CA GLY A 57 -2.146 -15.702 -2.345 1.00 0.00 C ATOM 895 C GLY A 57 -2.364 -14.223 -2.096 1.00 0.00 C ATOM 896 O GLY A 57 -1.408 -13.472 -1.899 1.00 0.00 O ATOM 0 H GLY A 57 -0.575 -17.011 -1.885 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -1.847 -15.852 -3.382 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -3.087 -16.234 -2.204 1.00 0.00 H new ATOM 900 N ASP A 58 -3.624 -13.802 -2.107 1.00 0.00 N ATOM 901 CA ASP A 58 -3.964 -12.402 -1.881 1.00 0.00 C ATOM 902 C ASP A 58 -4.652 -12.221 -0.532 1.00 0.00 C ATOM 903 O ASP A 58 -5.689 -12.829 -0.265 1.00 0.00 O ATOM 904 CB ASP A 58 -4.869 -11.888 -3.002 1.00 0.00 C ATOM 905 CG ASP A 58 -4.697 -10.403 -3.251 1.00 0.00 C ATOM 906 OD1 ASP A 58 -5.069 -9.606 -2.364 1.00 0.00 O ATOM 907 OD2 ASP A 58 -4.190 -10.037 -4.332 1.00 0.00 O ATOM 0 H ASP A 58 -4.427 -14.410 -2.270 1.00 0.00 H new ATOM 0 HA ASP A 58 -3.039 -11.825 -1.877 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -4.652 -12.435 -3.920 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -5.909 -12.093 -2.748 1.00 0.00 H new ATOM 912 N VAL A 59 -4.068 -11.380 0.317 1.00 0.00 N ATOM 913 CA VAL A 59 -4.624 -11.119 1.639 1.00 0.00 C ATOM 914 C VAL A 59 -5.689 -10.029 1.581 1.00 0.00 C ATOM 915 O VAL A 59 -5.564 -9.066 0.825 1.00 0.00 O ATOM 916 CB VAL A 59 -3.528 -10.698 2.636 1.00 0.00 C ATOM 917 CG1 VAL A 59 -4.135 -10.378 3.993 1.00 0.00 C ATOM 918 CG2 VAL A 59 -2.473 -11.787 2.758 1.00 0.00 C ATOM 0 H VAL A 59 -3.210 -10.868 0.112 1.00 0.00 H new ATOM 0 HA VAL A 59 -5.078 -12.049 1.981 1.00 0.00 H new ATOM 0 HB VAL A 59 -3.045 -9.796 2.259 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -3.346 -10.083 4.684 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -4.850 -9.562 3.888 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -4.645 -11.260 4.380 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -1.706 -11.473 3.466 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -2.939 -12.707 3.111 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -2.017 -11.962 1.784 1.00 0.00 H new ATOM 928 N GLU A 60 -6.735 -10.188 2.386 1.00 0.00 N ATOM 929 CA GLU A 60 -7.822 -9.217 2.425 1.00 0.00 C ATOM 930 C GLU A 60 -7.596 -8.193 3.534 1.00 0.00 C ATOM 931 O GLU A 60 -6.870 -8.452 4.494 1.00 0.00 O ATOM 932 CB GLU A 60 -9.162 -9.926 2.636 1.00 0.00 C ATOM 933 CG GLU A 60 -9.224 -10.742 3.916 1.00 0.00 C ATOM 934 CD GLU A 60 -10.449 -11.633 3.980 1.00 0.00 C ATOM 935 OE1 GLU A 60 -10.859 -12.155 2.922 1.00 0.00 O ATOM 936 OE2 GLU A 60 -10.998 -11.808 5.088 1.00 0.00 O ATOM 0 H GLU A 60 -6.852 -10.979 3.019 1.00 0.00 H new ATOM 0 HA GLU A 60 -7.843 -8.694 1.469 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -9.959 -9.182 2.650 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -9.354 -10.582 1.787 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -8.327 -11.357 3.994 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -9.224 -10.068 4.773 1.00 0.00 H new ATOM 943 N ASP A 61 -8.223 -7.030 3.393 1.00 0.00 N ATOM 944 CA ASP A 61 -8.091 -5.966 4.382 1.00 0.00 C ATOM 945 C ASP A 61 -8.658 -6.403 5.729 1.00 0.00 C ATOM 946 O ASP A 61 -8.480 -5.723 6.740 1.00 0.00 O ATOM 947 CB ASP A 61 -8.805 -4.702 3.901 1.00 0.00 C ATOM 948 CG ASP A 61 -10.136 -5.004 3.241 1.00 0.00 C ATOM 949 OD1 ASP A 61 -10.133 -5.440 2.070 1.00 0.00 O ATOM 950 OD2 ASP A 61 -11.181 -4.806 3.895 1.00 0.00 O ATOM 0 H ASP A 61 -8.827 -6.800 2.604 1.00 0.00 H new ATOM 0 HA ASP A 61 -7.030 -5.750 4.507 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -8.966 -4.035 4.748 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -8.165 -4.173 3.195 1.00 0.00 H new ATOM 955 N SER A 62 -9.343 -7.543 5.736 1.00 0.00 N ATOM 956 CA SER A 62 -9.941 -8.069 6.957 1.00 0.00 C ATOM 957 C SER A 62 -8.952 -8.955 7.708 1.00 0.00 C ATOM 958 O SER A 62 -9.314 -9.639 8.666 1.00 0.00 O ATOM 959 CB SER A 62 -11.207 -8.862 6.630 1.00 0.00 C ATOM 960 OG SER A 62 -12.177 -8.039 6.005 1.00 0.00 O ATOM 0 H SER A 62 -9.497 -8.120 4.909 1.00 0.00 H new ATOM 0 HA SER A 62 -10.204 -7.226 7.595 1.00 0.00 H new ATOM 0 HB2 SER A 62 -10.958 -9.697 5.975 1.00 0.00 H new ATOM 0 HB3 SER A 62 -11.621 -9.286 7.545 1.00 0.00 H new ATOM 0 HG SER A 62 -12.976 -8.570 5.805 1.00 0.00 H new ATOM 966 N THR A 63 -7.698 -8.940 7.265 1.00 0.00 N ATOM 967 CA THR A 63 -6.656 -9.742 7.893 1.00 0.00 C ATOM 968 C THR A 63 -5.637 -8.860 8.605 1.00 0.00 C ATOM 969 O THR A 63 -5.312 -7.768 8.139 1.00 0.00 O ATOM 970 CB THR A 63 -5.925 -10.620 6.860 1.00 0.00 C ATOM 971 OG1 THR A 63 -6.854 -11.504 6.223 1.00 0.00 O ATOM 972 CG2 THR A 63 -4.820 -11.430 7.523 1.00 0.00 C ATOM 0 H THR A 63 -7.380 -8.381 6.473 1.00 0.00 H new ATOM 0 HA THR A 63 -7.148 -10.385 8.623 1.00 0.00 H new ATOM 0 HB THR A 63 -5.476 -9.965 6.113 1.00 0.00 H new ATOM 0 HG1 THR A 63 -6.382 -12.057 5.567 1.00 0.00 H new ATOM 0 HG21 THR A 63 -4.318 -12.042 6.774 1.00 0.00 H new ATOM 0 HG22 THR A 63 -4.099 -10.754 7.982 1.00 0.00 H new ATOM 0 HG23 THR A 63 -5.251 -12.075 8.289 1.00 0.00 H new ATOM 980 N VAL A 64 -5.133 -9.341 9.737 1.00 0.00 N ATOM 981 CA VAL A 64 -4.149 -8.596 10.513 1.00 0.00 C ATOM 982 C VAL A 64 -2.736 -9.097 10.233 1.00 0.00 C ATOM 983 O VAL A 64 -2.524 -10.283 9.980 1.00 0.00 O ATOM 984 CB VAL A 64 -4.429 -8.702 12.024 1.00 0.00 C ATOM 985 CG1 VAL A 64 -3.504 -7.780 12.805 1.00 0.00 C ATOM 986 CG2 VAL A 64 -5.886 -8.382 12.319 1.00 0.00 C ATOM 0 H VAL A 64 -5.390 -10.243 10.137 1.00 0.00 H new ATOM 0 HA VAL A 64 -4.229 -7.552 10.208 1.00 0.00 H new ATOM 0 HB VAL A 64 -4.234 -9.727 12.341 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -3.717 -7.869 13.870 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -2.468 -8.060 12.617 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -3.664 -6.750 12.488 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -6.066 -8.462 13.391 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -6.110 -7.368 11.988 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -6.528 -9.087 11.790 1.00 0.00 H new ATOM 996 N LEU A 65 -1.771 -8.184 10.280 1.00 0.00 N ATOM 997 CA LEU A 65 -0.377 -8.532 10.032 1.00 0.00 C ATOM 998 C LEU A 65 0.052 -9.714 10.896 1.00 0.00 C ATOM 999 O LEU A 65 0.523 -10.731 10.387 1.00 0.00 O ATOM 1000 CB LEU A 65 0.527 -7.329 10.309 1.00 0.00 C ATOM 1001 CG LEU A 65 0.208 -6.056 9.524 1.00 0.00 C ATOM 1002 CD1 LEU A 65 0.594 -4.824 10.327 1.00 0.00 C ATOM 1003 CD2 LEU A 65 0.923 -6.065 8.181 1.00 0.00 C ATOM 0 H LEU A 65 -1.929 -7.198 10.488 1.00 0.00 H new ATOM 0 HA LEU A 65 -0.281 -8.818 8.984 1.00 0.00 H new ATOM 0 HB2 LEU A 65 0.476 -7.098 11.373 1.00 0.00 H new ATOM 0 HB3 LEU A 65 1.556 -7.616 10.094 1.00 0.00 H new ATOM 0 HG LEU A 65 -0.866 -6.024 9.341 1.00 0.00 H new ATOM 0 HD11 LEU A 65 0.360 -3.927 9.753 1.00 0.00 H new ATOM 0 HD12 LEU A 65 0.037 -4.811 11.264 1.00 0.00 H new ATOM 0 HD13 LEU A 65 1.663 -4.849 10.541 1.00 0.00 H new ATOM 0 HD21 LEU A 65 0.685 -5.152 7.636 1.00 0.00 H new ATOM 0 HD22 LEU A 65 2.000 -6.121 8.342 1.00 0.00 H new ATOM 0 HD23 LEU A 65 0.598 -6.929 7.601 1.00 0.00 H new ATOM 1015 N LYS A 66 -0.117 -9.574 12.207 1.00 0.00 N ATOM 1016 CA LYS A 66 0.249 -10.630 13.143 1.00 0.00 C ATOM 1017 C LYS A 66 -0.147 -11.999 12.600 1.00 0.00 C ATOM 1018 O LYS A 66 0.609 -12.964 12.712 1.00 0.00 O ATOM 1019 CB LYS A 66 -0.422 -10.393 14.498 1.00 0.00 C ATOM 1020 CG LYS A 66 -1.798 -11.026 14.615 1.00 0.00 C ATOM 1021 CD LYS A 66 -2.397 -10.808 15.994 1.00 0.00 C ATOM 1022 CE LYS A 66 -2.866 -9.373 16.177 1.00 0.00 C ATOM 1023 NZ LYS A 66 -4.276 -9.188 15.735 1.00 0.00 N ATOM 0 H LYS A 66 -0.505 -8.739 12.645 1.00 0.00 H new ATOM 0 HA LYS A 66 1.331 -10.609 13.272 1.00 0.00 H new ATOM 0 HB2 LYS A 66 0.219 -10.789 15.286 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -0.509 -9.320 14.668 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -2.460 -10.603 13.859 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -1.726 -12.095 14.413 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -3.237 -11.488 16.139 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -1.656 -11.050 16.756 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -2.775 -9.093 17.226 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -2.218 -8.704 15.611 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -4.519 -8.177 15.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -4.385 -9.542 14.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -4.910 -9.715 16.368 1.00 0.00 H new ATOM 1037 N SER A 67 -1.336 -12.076 12.011 1.00 0.00 N ATOM 1038 CA SER A 67 -1.833 -13.328 11.453 1.00 0.00 C ATOM 1039 C SER A 67 -0.833 -13.917 10.463 1.00 0.00 C ATOM 1040 O SER A 67 -0.568 -15.120 10.471 1.00 0.00 O ATOM 1041 CB SER A 67 -3.180 -13.104 10.762 1.00 0.00 C ATOM 1042 OG SER A 67 -3.964 -14.284 10.778 1.00 0.00 O ATOM 0 H SER A 67 -1.973 -11.286 11.908 1.00 0.00 H new ATOM 0 HA SER A 67 -1.966 -14.035 12.272 1.00 0.00 H new ATOM 0 HB2 SER A 67 -3.719 -12.299 11.261 1.00 0.00 H new ATOM 0 HB3 SER A 67 -3.016 -12.787 9.732 1.00 0.00 H new ATOM 0 HG SER A 67 -4.820 -14.114 10.332 1.00 0.00 H new ATOM 1048 N LEU A 68 -0.280 -13.060 9.611 1.00 0.00 N ATOM 1049 CA LEU A 68 0.693 -13.494 8.614 1.00 0.00 C ATOM 1050 C LEU A 68 2.101 -13.518 9.200 1.00 0.00 C ATOM 1051 O LEU A 68 3.003 -14.151 8.651 1.00 0.00 O ATOM 1052 CB LEU A 68 0.651 -12.569 7.396 1.00 0.00 C ATOM 1053 CG LEU A 68 -0.630 -12.615 6.562 1.00 0.00 C ATOM 1054 CD1 LEU A 68 -0.606 -11.539 5.487 1.00 0.00 C ATOM 1055 CD2 LEU A 68 -0.810 -13.991 5.937 1.00 0.00 C ATOM 0 H LEU A 68 -0.488 -12.062 9.591 1.00 0.00 H new ATOM 0 HA LEU A 68 0.432 -14.506 8.304 1.00 0.00 H new ATOM 0 HB2 LEU A 68 0.802 -11.545 7.737 1.00 0.00 H new ATOM 0 HB3 LEU A 68 1.492 -12.816 6.748 1.00 0.00 H new ATOM 0 HG LEU A 68 -1.477 -12.423 7.221 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -1.525 -11.587 4.904 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -0.524 -10.558 5.956 1.00 0.00 H new ATOM 0 HD13 LEU A 68 0.249 -11.700 4.830 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -1.726 -14.006 5.347 1.00 0.00 H new ATOM 0 HD22 LEU A 68 0.040 -14.212 5.292 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -0.873 -14.743 6.724 1.00 0.00 H new ATOM 1067 N HIS A 69 2.282 -12.825 10.320 1.00 0.00 N ATOM 1068 CA HIS A 69 3.580 -12.768 10.983 1.00 0.00 C ATOM 1069 C HIS A 69 4.700 -12.560 9.968 1.00 0.00 C ATOM 1070 O HIS A 69 5.658 -13.333 9.919 1.00 0.00 O ATOM 1071 CB HIS A 69 3.826 -14.052 11.777 1.00 0.00 C ATOM 1072 CG HIS A 69 3.304 -15.283 11.102 1.00 0.00 C ATOM 1073 ND1 HIS A 69 2.086 -15.872 11.155 1.00 0.00 N flip ATOM 1074 CD2 HIS A 69 4.067 -16.058 10.255 1.00 0.00 C flip ATOM 1075 CE1 HIS A 69 2.135 -16.981 10.347 1.00 0.00 C flip ATOM 1076 NE2 HIS A 69 3.341 -17.071 9.815 1.00 0.00 N flip ATOM 0 H HIS A 69 1.546 -12.295 10.787 1.00 0.00 H new ATOM 0 HA HIS A 69 3.574 -11.921 11.669 1.00 0.00 H new ATOM 0 HB2 HIS A 69 4.897 -14.166 11.945 1.00 0.00 H new ATOM 0 HB3 HIS A 69 3.358 -13.959 12.757 1.00 0.00 H new ATOM 0 HD1 HIS A 69 1.282 -15.552 11.695 1.00 0.00 H new ATOM 0 HD2 HIS A 69 5.097 -15.867 9.992 1.00 0.00 H new ATOM 0 HE1 HIS A 69 1.320 -17.668 10.174 1.00 0.00 H new ATOM 1085 N LEU A 70 4.572 -11.513 9.161 1.00 0.00 N ATOM 1086 CA LEU A 70 5.574 -11.204 8.146 1.00 0.00 C ATOM 1087 C LEU A 70 6.963 -11.101 8.766 1.00 0.00 C ATOM 1088 O LEU A 70 7.123 -10.765 9.939 1.00 0.00 O ATOM 1089 CB LEU A 70 5.221 -9.896 7.436 1.00 0.00 C ATOM 1090 CG LEU A 70 4.066 -9.964 6.437 1.00 0.00 C ATOM 1091 CD1 LEU A 70 4.371 -10.970 5.337 1.00 0.00 C ATOM 1092 CD2 LEU A 70 2.768 -10.323 7.145 1.00 0.00 C ATOM 0 H LEU A 70 3.786 -10.864 9.189 1.00 0.00 H new ATOM 0 HA LEU A 70 5.581 -12.015 7.418 1.00 0.00 H new ATOM 0 HB2 LEU A 70 4.977 -9.150 8.192 1.00 0.00 H new ATOM 0 HB3 LEU A 70 6.108 -9.540 6.912 1.00 0.00 H new ATOM 0 HG LEU A 70 3.947 -8.981 5.981 1.00 0.00 H new ATOM 0 HD11 LEU A 70 3.538 -11.005 4.635 1.00 0.00 H new ATOM 0 HD12 LEU A 70 5.277 -10.670 4.810 1.00 0.00 H new ATOM 0 HD13 LEU A 70 4.517 -11.957 5.777 1.00 0.00 H new ATOM 0 HD21 LEU A 70 1.957 -10.367 6.418 1.00 0.00 H new ATOM 0 HD22 LEU A 70 2.874 -11.294 7.629 1.00 0.00 H new ATOM 0 HD23 LEU A 70 2.542 -9.566 7.896 1.00 0.00 H new ATOM 1104 N PRO A 71 7.995 -11.395 7.959 1.00 0.00 N ATOM 1105 CA PRO A 71 9.390 -11.340 8.406 1.00 0.00 C ATOM 1106 C PRO A 71 9.863 -9.911 8.655 1.00 0.00 C ATOM 1107 O PRO A 71 9.183 -8.950 8.296 1.00 0.00 O ATOM 1108 CB PRO A 71 10.160 -11.964 7.241 1.00 0.00 C ATOM 1109 CG PRO A 71 9.294 -11.737 6.049 1.00 0.00 C ATOM 1110 CD PRO A 71 7.878 -11.802 6.549 1.00 0.00 C ATOM 0 HA PRO A 71 9.535 -11.856 9.355 1.00 0.00 H new ATOM 0 HB2 PRO A 71 11.136 -11.496 7.116 1.00 0.00 H new ATOM 0 HB3 PRO A 71 10.335 -13.027 7.406 1.00 0.00 H new ATOM 0 HG2 PRO A 71 9.503 -10.769 5.593 1.00 0.00 H new ATOM 0 HG3 PRO A 71 9.474 -12.494 5.286 1.00 0.00 H new ATOM 0 HD2 PRO A 71 7.224 -11.133 5.991 1.00 0.00 H new ATOM 0 HD3 PRO A 71 7.464 -12.806 6.454 1.00 0.00 H new ATOM 1118 N LYS A 72 11.033 -9.779 9.269 1.00 0.00 N ATOM 1119 CA LYS A 72 11.600 -8.469 9.564 1.00 0.00 C ATOM 1120 C LYS A 72 11.484 -7.542 8.358 1.00 0.00 C ATOM 1121 O LYS A 72 11.050 -6.398 8.482 1.00 0.00 O ATOM 1122 CB LYS A 72 13.067 -8.605 9.976 1.00 0.00 C ATOM 1123 CG LYS A 72 13.679 -7.312 10.487 1.00 0.00 C ATOM 1124 CD LYS A 72 13.423 -7.122 11.972 1.00 0.00 C ATOM 1125 CE LYS A 72 14.457 -6.202 12.603 1.00 0.00 C ATOM 1126 NZ LYS A 72 14.219 -4.775 12.249 1.00 0.00 N ATOM 0 H LYS A 72 11.608 -10.565 9.573 1.00 0.00 H new ATOM 0 HA LYS A 72 11.036 -8.035 10.390 1.00 0.00 H new ATOM 0 HB2 LYS A 72 13.149 -9.367 10.751 1.00 0.00 H new ATOM 0 HB3 LYS A 72 13.644 -8.957 9.121 1.00 0.00 H new ATOM 0 HG2 LYS A 72 14.753 -7.318 10.300 1.00 0.00 H new ATOM 0 HG3 LYS A 72 13.264 -6.469 9.935 1.00 0.00 H new ATOM 0 HD2 LYS A 72 12.426 -6.707 12.120 1.00 0.00 H new ATOM 0 HD3 LYS A 72 13.442 -8.090 12.472 1.00 0.00 H new ATOM 0 HE2 LYS A 72 14.432 -6.316 13.687 1.00 0.00 H new ATOM 0 HE3 LYS A 72 15.454 -6.496 12.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 14.944 -4.180 12.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 14.268 -4.661 11.216 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 13.278 -4.486 12.585 1.00 0.00 H new ATOM 1140 N ASN A 73 11.873 -8.045 7.191 1.00 0.00 N ATOM 1141 CA ASN A 73 11.812 -7.262 5.962 1.00 0.00 C ATOM 1142 C ASN A 73 10.741 -7.808 5.023 1.00 0.00 C ATOM 1143 O ASN A 73 10.650 -9.015 4.804 1.00 0.00 O ATOM 1144 CB ASN A 73 13.172 -7.267 5.261 1.00 0.00 C ATOM 1145 CG ASN A 73 13.400 -6.017 4.434 1.00 0.00 C ATOM 1146 OD1 ASN A 73 12.917 -5.909 3.307 1.00 0.00 O ATOM 1147 ND2 ASN A 73 14.141 -5.066 4.991 1.00 0.00 N ATOM 0 H ASN A 73 12.234 -8.991 7.070 1.00 0.00 H new ATOM 0 HA ASN A 73 11.551 -6.237 6.226 1.00 0.00 H new ATOM 0 HB2 ASN A 73 13.962 -7.355 6.007 1.00 0.00 H new ATOM 0 HB3 ASN A 73 13.243 -8.144 4.617 1.00 0.00 H new ATOM 0 HD21 ASN A 73 14.330 -4.203 4.482 1.00 0.00 H new ATOM 0 HD22 ASN A 73 14.521 -5.199 5.928 1.00 0.00 H new ATOM 1154 N ASN A 74 9.933 -6.909 4.470 1.00 0.00 N ATOM 1155 CA ASN A 74 8.868 -7.300 3.553 1.00 0.00 C ATOM 1156 C ASN A 74 9.016 -6.588 2.212 1.00 0.00 C ATOM 1157 O ASN A 74 9.547 -5.479 2.141 1.00 0.00 O ATOM 1158 CB ASN A 74 7.501 -6.984 4.163 1.00 0.00 C ATOM 1159 CG ASN A 74 7.479 -7.182 5.666 1.00 0.00 C ATOM 1160 OD1 ASN A 74 7.137 -6.269 6.419 1.00 0.00 O ATOM 1161 ND2 ASN A 74 7.844 -8.378 6.111 1.00 0.00 N ATOM 0 H ASN A 74 9.995 -5.905 4.641 1.00 0.00 H new ATOM 0 HA ASN A 74 8.944 -8.374 3.384 1.00 0.00 H new ATOM 0 HB2 ASN A 74 7.232 -5.953 3.931 1.00 0.00 H new ATOM 0 HB3 ASN A 74 6.745 -7.622 3.704 1.00 0.00 H new ATOM 0 HD21 ASN A 74 7.849 -8.570 7.113 1.00 0.00 H new ATOM 0 HD22 ASN A 74 8.120 -9.105 5.451 1.00 0.00 H new ATOM 1168 N SER A 75 8.542 -7.232 1.151 1.00 0.00 N ATOM 1169 CA SER A 75 8.624 -6.663 -0.189 1.00 0.00 C ATOM 1170 C SER A 75 7.254 -6.651 -0.859 1.00 0.00 C ATOM 1171 O SER A 75 6.716 -7.699 -1.218 1.00 0.00 O ATOM 1172 CB SER A 75 9.616 -7.455 -1.044 1.00 0.00 C ATOM 1173 OG SER A 75 9.216 -8.810 -1.164 1.00 0.00 O ATOM 0 H SER A 75 8.097 -8.149 1.193 1.00 0.00 H new ATOM 0 HA SER A 75 8.974 -5.635 -0.099 1.00 0.00 H new ATOM 0 HB2 SER A 75 9.689 -7.005 -2.034 1.00 0.00 H new ATOM 0 HB3 SER A 75 10.609 -7.404 -0.597 1.00 0.00 H new ATOM 0 HG SER A 75 8.240 -8.858 -1.235 1.00 0.00 H new ATOM 1179 N LEU A 76 6.694 -5.458 -1.025 1.00 0.00 N ATOM 1180 CA LEU A 76 5.385 -5.307 -1.652 1.00 0.00 C ATOM 1181 C LEU A 76 5.464 -4.381 -2.861 1.00 0.00 C ATOM 1182 O LEU A 76 6.496 -3.757 -3.111 1.00 0.00 O ATOM 1183 CB LEU A 76 4.374 -4.762 -0.642 1.00 0.00 C ATOM 1184 CG LEU A 76 4.007 -5.696 0.512 1.00 0.00 C ATOM 1185 CD1 LEU A 76 3.242 -4.940 1.587 1.00 0.00 C ATOM 1186 CD2 LEU A 76 3.192 -6.876 0.004 1.00 0.00 C ATOM 0 H LEU A 76 7.126 -4.581 -0.734 1.00 0.00 H new ATOM 0 HA LEU A 76 5.056 -6.289 -1.991 1.00 0.00 H new ATOM 0 HB2 LEU A 76 4.772 -3.838 -0.222 1.00 0.00 H new ATOM 0 HB3 LEU A 76 3.461 -4.502 -1.177 1.00 0.00 H new ATOM 0 HG LEU A 76 4.928 -6.079 0.952 1.00 0.00 H new ATOM 0 HD11 LEU A 76 2.989 -5.620 2.400 1.00 0.00 H new ATOM 0 HD12 LEU A 76 3.860 -4.129 1.971 1.00 0.00 H new ATOM 0 HD13 LEU A 76 2.327 -4.528 1.161 1.00 0.00 H new ATOM 0 HD21 LEU A 76 2.940 -7.530 0.839 1.00 0.00 H new ATOM 0 HD22 LEU A 76 2.276 -6.512 -0.462 1.00 0.00 H new ATOM 0 HD23 LEU A 76 3.776 -7.432 -0.730 1.00 0.00 H new ATOM 1198 N TYR A 77 4.368 -4.294 -3.606 1.00 0.00 N ATOM 1199 CA TYR A 77 4.313 -3.444 -4.789 1.00 0.00 C ATOM 1200 C TYR A 77 2.876 -3.038 -5.102 1.00 0.00 C ATOM 1201 O TYR A 77 1.940 -3.808 -4.886 1.00 0.00 O ATOM 1202 CB TYR A 77 4.925 -4.166 -5.991 1.00 0.00 C ATOM 1203 CG TYR A 77 4.347 -5.543 -6.228 1.00 0.00 C ATOM 1204 CD1 TYR A 77 4.706 -6.616 -5.422 1.00 0.00 C ATOM 1205 CD2 TYR A 77 3.444 -5.771 -7.258 1.00 0.00 C ATOM 1206 CE1 TYR A 77 4.182 -7.877 -5.635 1.00 0.00 C ATOM 1207 CE2 TYR A 77 2.913 -7.028 -7.478 1.00 0.00 C ATOM 1208 CZ TYR A 77 3.286 -8.077 -6.664 1.00 0.00 C ATOM 1209 OH TYR A 77 2.760 -9.330 -6.880 1.00 0.00 O ATOM 0 H TYR A 77 3.505 -4.802 -3.411 1.00 0.00 H new ATOM 0 HA TYR A 77 4.889 -2.542 -4.584 1.00 0.00 H new ATOM 0 HB2 TYR A 77 4.775 -3.559 -6.884 1.00 0.00 H new ATOM 0 HB3 TYR A 77 6.001 -4.253 -5.843 1.00 0.00 H new ATOM 0 HD1 TYR A 77 5.407 -6.462 -4.615 1.00 0.00 H new ATOM 0 HD2 TYR A 77 3.152 -4.952 -7.898 1.00 0.00 H new ATOM 0 HE1 TYR A 77 4.472 -8.701 -5.000 1.00 0.00 H new ATOM 0 HE2 TYR A 77 2.210 -7.188 -8.282 1.00 0.00 H new ATOM 0 HH TYR A 77 2.145 -9.300 -7.642 1.00 0.00 H new ATOM 1219 N VAL A 78 2.709 -1.823 -5.615 1.00 0.00 N ATOM 1220 CA VAL A 78 1.387 -1.314 -5.960 1.00 0.00 C ATOM 1221 C VAL A 78 1.158 -1.359 -7.467 1.00 0.00 C ATOM 1222 O VAL A 78 2.017 -0.951 -8.249 1.00 0.00 O ATOM 1223 CB VAL A 78 1.196 0.132 -5.466 1.00 0.00 C ATOM 1224 CG1 VAL A 78 0.020 0.787 -6.174 1.00 0.00 C ATOM 1225 CG2 VAL A 78 1.002 0.158 -3.957 1.00 0.00 C ATOM 0 H VAL A 78 3.473 -1.173 -5.801 1.00 0.00 H new ATOM 0 HA VAL A 78 0.660 -1.958 -5.465 1.00 0.00 H new ATOM 0 HB VAL A 78 2.095 0.701 -5.704 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -0.100 1.808 -5.812 1.00 0.00 H new ATOM 0 HG12 VAL A 78 0.204 0.802 -7.248 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -0.889 0.221 -5.970 1.00 0.00 H new ATOM 0 HG21 VAL A 78 0.869 1.188 -3.625 1.00 0.00 H new ATOM 0 HG22 VAL A 78 0.120 -0.425 -3.693 1.00 0.00 H new ATOM 0 HG23 VAL A 78 1.879 -0.269 -3.470 1.00 0.00 H new ATOM 1235 N LEU A 79 -0.007 -1.857 -7.867 1.00 0.00 N ATOM 1236 CA LEU A 79 -0.351 -1.955 -9.282 1.00 0.00 C ATOM 1237 C LEU A 79 -1.657 -1.223 -9.576 1.00 0.00 C ATOM 1238 O LEU A 79 -2.732 -1.658 -9.164 1.00 0.00 O ATOM 1239 CB LEU A 79 -0.471 -3.422 -9.697 1.00 0.00 C ATOM 1240 CG LEU A 79 0.646 -4.349 -9.217 1.00 0.00 C ATOM 1241 CD1 LEU A 79 0.484 -4.657 -7.736 1.00 0.00 C ATOM 1242 CD2 LEU A 79 0.661 -5.634 -10.032 1.00 0.00 C ATOM 0 H LEU A 79 -0.729 -2.199 -7.233 1.00 0.00 H new ATOM 0 HA LEU A 79 0.446 -1.485 -9.858 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -1.420 -3.807 -9.325 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -0.512 -3.469 -10.785 1.00 0.00 H new ATOM 0 HG LEU A 79 1.600 -3.841 -9.360 1.00 0.00 H new ATOM 0 HD11 LEU A 79 1.288 -5.318 -7.412 1.00 0.00 H new ATOM 0 HD12 LEU A 79 0.524 -3.729 -7.165 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -0.476 -5.145 -7.569 1.00 0.00 H new ATOM 0 HD21 LEU A 79 1.463 -6.281 -9.676 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -0.295 -6.146 -9.922 1.00 0.00 H new ATOM 0 HD23 LEU A 79 0.826 -5.396 -11.083 1.00 0.00 H new ATOM 1254 N THR A 80 -1.555 -0.109 -10.295 1.00 0.00 N ATOM 1255 CA THR A 80 -2.727 0.683 -10.646 1.00 0.00 C ATOM 1256 C THR A 80 -3.094 0.501 -12.115 1.00 0.00 C ATOM 1257 O THR A 80 -2.577 1.185 -12.998 1.00 0.00 O ATOM 1258 CB THR A 80 -2.496 2.181 -10.369 1.00 0.00 C ATOM 1259 OG1 THR A 80 -1.616 2.732 -11.355 1.00 0.00 O ATOM 1260 CG2 THR A 80 -1.907 2.390 -8.982 1.00 0.00 C ATOM 0 H THR A 80 -0.673 0.265 -10.645 1.00 0.00 H new ATOM 0 HA THR A 80 -3.547 0.327 -10.022 1.00 0.00 H new ATOM 0 HB THR A 80 -3.459 2.690 -10.418 1.00 0.00 H new ATOM 0 HG1 THR A 80 -2.050 2.703 -12.233 1.00 0.00 H new ATOM 0 HG21 THR A 80 -1.753 3.455 -8.809 1.00 0.00 H new ATOM 0 HG22 THR A 80 -2.593 1.996 -8.232 1.00 0.00 H new ATOM 0 HG23 THR A 80 -0.953 1.869 -8.910 1.00 0.00 H new ATOM 1268 N PRO A 81 -4.008 -0.443 -12.384 1.00 0.00 N ATOM 1269 CA PRO A 81 -4.466 -0.736 -13.745 1.00 0.00 C ATOM 1270 C PRO A 81 -5.313 0.390 -14.327 1.00 0.00 C ATOM 1271 O PRO A 81 -5.143 0.774 -15.485 1.00 0.00 O ATOM 1272 CB PRO A 81 -5.307 -2.003 -13.572 1.00 0.00 C ATOM 1273 CG PRO A 81 -5.770 -1.960 -12.156 1.00 0.00 C ATOM 1274 CD PRO A 81 -4.666 -1.296 -11.380 1.00 0.00 C ATOM 0 HA PRO A 81 -3.633 -0.852 -14.438 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -6.149 -2.017 -14.264 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -4.718 -2.899 -13.769 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -6.701 -1.400 -12.067 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -5.964 -2.964 -11.778 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -5.056 -0.710 -10.548 1.00 0.00 H new ATOM 0 HD3 PRO A 81 -3.975 -2.027 -10.959 1.00 0.00 H new ATOM 1282 N ASP A 82 -6.226 0.916 -13.518 1.00 0.00 N ATOM 1283 CA ASP A 82 -7.100 2.000 -13.953 1.00 0.00 C ATOM 1284 C ASP A 82 -6.356 3.332 -13.948 1.00 0.00 C ATOM 1285 O ASP A 82 -6.236 3.991 -14.982 1.00 0.00 O ATOM 1286 CB ASP A 82 -8.330 2.085 -13.048 1.00 0.00 C ATOM 1287 CG ASP A 82 -9.319 0.966 -13.309 1.00 0.00 C ATOM 1288 OD1 ASP A 82 -8.881 -0.197 -13.427 1.00 0.00 O ATOM 1289 OD2 ASP A 82 -10.531 1.254 -13.394 1.00 0.00 O ATOM 0 H ASP A 82 -6.380 0.610 -12.557 1.00 0.00 H new ATOM 0 HA ASP A 82 -7.422 1.788 -14.972 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -8.014 2.051 -12.006 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -8.824 3.045 -13.200 1.00 0.00 H new ATOM 1294 N LEU A 83 -5.859 3.722 -12.780 1.00 0.00 N ATOM 1295 CA LEU A 83 -5.128 4.977 -12.640 1.00 0.00 C ATOM 1296 C LEU A 83 -4.040 5.094 -13.704 1.00 0.00 C ATOM 1297 O LEU A 83 -3.135 4.265 -13.794 1.00 0.00 O ATOM 1298 CB LEU A 83 -4.507 5.075 -11.246 1.00 0.00 C ATOM 1299 CG LEU A 83 -4.346 6.487 -10.681 1.00 0.00 C ATOM 1300 CD1 LEU A 83 -5.699 7.062 -10.290 1.00 0.00 C ATOM 1301 CD2 LEU A 83 -3.402 6.480 -9.487 1.00 0.00 C ATOM 0 H LEU A 83 -5.949 3.188 -11.916 1.00 0.00 H new ATOM 0 HA LEU A 83 -5.833 5.797 -12.775 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -5.121 4.497 -10.555 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -3.525 4.602 -11.273 1.00 0.00 H new ATOM 0 HG LEU A 83 -3.914 7.121 -11.456 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -5.565 8.067 -9.890 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -6.344 7.104 -11.168 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -6.158 6.428 -9.532 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -3.300 7.493 -9.098 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -3.805 5.832 -8.709 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -2.425 6.110 -9.798 1.00 0.00 H new ATOM 1313 N PRO A 84 -4.129 6.149 -14.527 1.00 0.00 N ATOM 1314 CA PRO A 84 -3.159 6.402 -15.597 1.00 0.00 C ATOM 1315 C PRO A 84 -1.794 6.814 -15.057 1.00 0.00 C ATOM 1316 O PRO A 84 -1.630 7.099 -13.871 1.00 0.00 O ATOM 1317 CB PRO A 84 -3.792 7.552 -16.385 1.00 0.00 C ATOM 1318 CG PRO A 84 -4.671 8.246 -15.402 1.00 0.00 C ATOM 1319 CD PRO A 84 -5.182 7.177 -14.477 1.00 0.00 C ATOM 0 HA PRO A 84 -2.970 5.510 -16.195 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -3.032 8.226 -16.781 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -4.364 7.181 -17.235 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -4.117 9.006 -14.851 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -5.494 8.753 -15.905 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -5.325 7.556 -13.465 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -6.143 6.784 -14.809 1.00 0.00 H new ATOM 1327 N PRO A 85 -0.791 6.847 -15.946 1.00 0.00 N ATOM 1328 CA PRO A 85 0.578 7.225 -15.581 1.00 0.00 C ATOM 1329 C PRO A 85 0.700 8.706 -15.241 1.00 0.00 C ATOM 1330 O PRO A 85 -0.178 9.513 -15.549 1.00 0.00 O ATOM 1331 CB PRO A 85 1.384 6.897 -16.841 1.00 0.00 C ATOM 1332 CG PRO A 85 0.397 6.976 -17.953 1.00 0.00 C ATOM 1333 CD PRO A 85 -0.915 6.520 -17.376 1.00 0.00 C ATOM 0 HA PRO A 85 0.922 6.700 -14.690 1.00 0.00 H new ATOM 0 HB2 PRO A 85 2.200 7.605 -16.985 1.00 0.00 H new ATOM 0 HB3 PRO A 85 1.831 5.905 -16.778 1.00 0.00 H new ATOM 0 HG2 PRO A 85 0.322 7.994 -18.337 1.00 0.00 H new ATOM 0 HG3 PRO A 85 0.698 6.342 -18.787 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -1.757 7.038 -17.835 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -1.073 5.453 -17.532 1.00 0.00 H new ATOM 1341 N PRO A 86 1.813 9.075 -14.591 1.00 0.00 N ATOM 1342 CA PRO A 86 2.076 10.462 -14.196 1.00 0.00 C ATOM 1343 C PRO A 86 2.360 11.362 -15.393 1.00 0.00 C ATOM 1344 O PRO A 86 3.369 11.198 -16.080 1.00 0.00 O ATOM 1345 CB PRO A 86 3.317 10.348 -13.306 1.00 0.00 C ATOM 1346 CG PRO A 86 3.997 9.103 -13.762 1.00 0.00 C ATOM 1347 CD PRO A 86 2.901 8.167 -14.191 1.00 0.00 C ATOM 0 HA PRO A 86 1.218 10.914 -13.699 1.00 0.00 H new ATOM 0 HB2 PRO A 86 3.965 11.217 -13.418 1.00 0.00 H new ATOM 0 HB3 PRO A 86 3.044 10.287 -12.252 1.00 0.00 H new ATOM 0 HG2 PRO A 86 4.679 9.310 -14.587 1.00 0.00 H new ATOM 0 HG3 PRO A 86 4.591 8.666 -12.959 1.00 0.00 H new ATOM 0 HD2 PRO A 86 3.217 7.530 -15.017 1.00 0.00 H new ATOM 0 HD3 PRO A 86 2.595 7.507 -13.379 1.00 0.00 H new ATOM 1355 N SER A 87 1.465 12.313 -15.639 1.00 0.00 N ATOM 1356 CA SER A 87 1.617 13.237 -16.756 1.00 0.00 C ATOM 1357 C SER A 87 1.748 14.674 -16.259 1.00 0.00 C ATOM 1358 O SER A 87 2.157 15.565 -17.003 1.00 0.00 O ATOM 1359 CB SER A 87 0.426 13.121 -17.708 1.00 0.00 C ATOM 1360 OG SER A 87 -0.781 13.488 -17.062 1.00 0.00 O ATOM 0 H SER A 87 0.626 12.464 -15.079 1.00 0.00 H new ATOM 0 HA SER A 87 2.528 12.972 -17.292 1.00 0.00 H new ATOM 0 HB2 SER A 87 0.587 13.761 -18.576 1.00 0.00 H new ATOM 0 HB3 SER A 87 0.349 12.098 -18.076 1.00 0.00 H new ATOM 0 HG SER A 87 -1.527 13.407 -17.692 1.00 0.00 H new ATOM 1366 N SER A 88 1.397 14.890 -14.995 1.00 0.00 N ATOM 1367 CA SER A 88 1.470 16.219 -14.398 1.00 0.00 C ATOM 1368 C SER A 88 2.490 16.249 -13.264 1.00 0.00 C ATOM 1369 O SER A 88 2.248 15.712 -12.183 1.00 0.00 O ATOM 1370 CB SER A 88 0.096 16.643 -13.876 1.00 0.00 C ATOM 1371 OG SER A 88 0.117 17.983 -13.416 1.00 0.00 O ATOM 0 H SER A 88 1.059 14.162 -14.365 1.00 0.00 H new ATOM 0 HA SER A 88 1.789 16.920 -15.169 1.00 0.00 H new ATOM 0 HB2 SER A 88 -0.646 16.539 -14.668 1.00 0.00 H new ATOM 0 HB3 SER A 88 -0.209 15.981 -13.065 1.00 0.00 H new ATOM 0 HG SER A 88 -0.773 18.231 -13.089 1.00 0.00 H new ATOM 1377 N SER A 89 3.632 16.880 -13.519 1.00 0.00 N ATOM 1378 CA SER A 89 4.691 16.977 -12.521 1.00 0.00 C ATOM 1379 C SER A 89 4.185 17.667 -11.258 1.00 0.00 C ATOM 1380 O SER A 89 4.126 18.894 -11.188 1.00 0.00 O ATOM 1381 CB SER A 89 5.887 17.743 -13.090 1.00 0.00 C ATOM 1382 OG SER A 89 5.557 19.101 -13.325 1.00 0.00 O ATOM 0 H SER A 89 3.847 17.332 -14.408 1.00 0.00 H new ATOM 0 HA SER A 89 5.006 15.966 -12.261 1.00 0.00 H new ATOM 0 HB2 SER A 89 6.725 17.684 -12.395 1.00 0.00 H new ATOM 0 HB3 SER A 89 6.211 17.278 -14.021 1.00 0.00 H new ATOM 0 HG SER A 89 5.025 19.443 -12.576 1.00 0.00 H new ATOM 1388 N SER A 90 3.821 16.867 -10.260 1.00 0.00 N ATOM 1389 CA SER A 90 3.316 17.398 -9.000 1.00 0.00 C ATOM 1390 C SER A 90 4.464 17.850 -8.102 1.00 0.00 C ATOM 1391 O SER A 90 5.112 17.034 -7.446 1.00 0.00 O ATOM 1392 CB SER A 90 2.474 16.345 -8.278 1.00 0.00 C ATOM 1393 OG SER A 90 1.685 16.933 -7.258 1.00 0.00 O ATOM 0 H SER A 90 3.867 15.849 -10.300 1.00 0.00 H new ATOM 0 HA SER A 90 2.690 18.262 -9.224 1.00 0.00 H new ATOM 0 HB2 SER A 90 1.828 15.838 -8.995 1.00 0.00 H new ATOM 0 HB3 SER A 90 3.127 15.587 -7.845 1.00 0.00 H new ATOM 0 HG SER A 90 1.155 16.239 -6.813 1.00 0.00 H new ATOM 1399 N HIS A 91 4.711 19.156 -8.079 1.00 0.00 N ATOM 1400 CA HIS A 91 5.780 19.718 -7.262 1.00 0.00 C ATOM 1401 C HIS A 91 5.212 20.429 -6.037 1.00 0.00 C ATOM 1402 O HIS A 91 4.475 21.407 -6.162 1.00 0.00 O ATOM 1403 CB HIS A 91 6.623 20.691 -8.086 1.00 0.00 C ATOM 1404 CG HIS A 91 6.032 22.065 -8.179 1.00 0.00 C ATOM 1405 ND1 HIS A 91 5.041 22.398 -9.078 1.00 0.00 N ATOM 1406 CD2 HIS A 91 6.297 23.192 -7.478 1.00 0.00 C ATOM 1407 CE1 HIS A 91 4.723 23.672 -8.927 1.00 0.00 C ATOM 1408 NE2 HIS A 91 5.470 24.176 -7.962 1.00 0.00 N ATOM 0 H HIS A 91 4.185 19.845 -8.617 1.00 0.00 H new ATOM 0 HA HIS A 91 6.413 18.898 -6.923 1.00 0.00 H new ATOM 0 HB2 HIS A 91 7.617 20.761 -7.645 1.00 0.00 H new ATOM 0 HB3 HIS A 91 6.748 20.289 -9.092 1.00 0.00 H new ATOM 0 HD2 HIS A 91 7.023 23.298 -6.686 1.00 0.00 H new ATOM 0 HE1 HIS A 91 3.979 24.209 -9.496 1.00 0.00 H new ATOM 0 HE2 HIS A 91 5.438 25.140 -7.630 1.00 0.00 H new ATOM 1417 N ALA A 92 5.559 19.931 -4.855 1.00 0.00 N ATOM 1418 CA ALA A 92 5.084 20.519 -3.609 1.00 0.00 C ATOM 1419 C ALA A 92 5.542 21.968 -3.477 1.00 0.00 C ATOM 1420 O ALA A 92 4.798 22.823 -2.999 1.00 0.00 O ATOM 1421 CB ALA A 92 5.567 19.700 -2.421 1.00 0.00 C ATOM 0 H ALA A 92 6.168 19.121 -4.734 1.00 0.00 H new ATOM 0 HA ALA A 92 3.994 20.510 -3.623 1.00 0.00 H new ATOM 0 HB1 ALA A 92 5.205 20.151 -1.497 1.00 0.00 H new ATOM 0 HB2 ALA A 92 5.186 18.682 -2.502 1.00 0.00 H new ATOM 0 HB3 ALA A 92 6.657 19.680 -2.412 1.00 0.00 H new ATOM 1427 N GLY A 93 6.773 22.236 -3.902 1.00 0.00 N ATOM 1428 CA GLY A 93 7.309 23.582 -3.822 1.00 0.00 C ATOM 1429 C GLY A 93 8.176 23.788 -2.596 1.00 0.00 C ATOM 1430 O GLY A 93 8.905 22.886 -2.184 1.00 0.00 O ATOM 0 H GLY A 93 7.409 21.545 -4.300 1.00 0.00 H new ATOM 0 HA2 GLY A 93 7.895 23.790 -4.717 1.00 0.00 H new ATOM 0 HA3 GLY A 93 6.487 24.297 -3.806 1.00 0.00 H new ATOM 1434 N ALA A 94 8.100 24.980 -2.013 1.00 0.00 N ATOM 1435 CA ALA A 94 8.885 25.302 -0.827 1.00 0.00 C ATOM 1436 C ALA A 94 8.846 24.160 0.183 1.00 0.00 C ATOM 1437 O ALA A 94 7.854 23.436 0.280 1.00 0.00 O ATOM 1438 CB ALA A 94 8.378 26.588 -0.192 1.00 0.00 C ATOM 0 H ALA A 94 7.503 25.739 -2.342 1.00 0.00 H new ATOM 0 HA ALA A 94 9.921 25.445 -1.135 1.00 0.00 H new ATOM 0 HB1 ALA A 94 8.973 26.816 0.692 1.00 0.00 H new ATOM 0 HB2 ALA A 94 8.463 27.406 -0.908 1.00 0.00 H new ATOM 0 HB3 ALA A 94 7.334 26.465 0.095 1.00 0.00 H new ATOM 1444 N LEU A 95 9.930 24.004 0.934 1.00 0.00 N ATOM 1445 CA LEU A 95 10.021 22.949 1.937 1.00 0.00 C ATOM 1446 C LEU A 95 10.332 23.530 3.313 1.00 0.00 C ATOM 1447 O LEU A 95 10.398 24.748 3.481 1.00 0.00 O ATOM 1448 CB LEU A 95 11.096 21.934 1.545 1.00 0.00 C ATOM 1449 CG LEU A 95 12.527 22.279 1.959 1.00 0.00 C ATOM 1450 CD1 LEU A 95 13.379 21.022 2.032 1.00 0.00 C ATOM 1451 CD2 LEU A 95 13.136 23.282 0.989 1.00 0.00 C ATOM 0 H LEU A 95 10.759 24.595 0.868 1.00 0.00 H new ATOM 0 HA LEU A 95 9.056 22.445 1.985 1.00 0.00 H new ATOM 0 HB2 LEU A 95 10.835 20.971 1.983 1.00 0.00 H new ATOM 0 HB3 LEU A 95 11.072 21.809 0.462 1.00 0.00 H new ATOM 0 HG LEU A 95 12.499 22.733 2.950 1.00 0.00 H new ATOM 0 HD11 LEU A 95 14.394 21.287 2.328 1.00 0.00 H new ATOM 0 HD12 LEU A 95 12.954 20.337 2.766 1.00 0.00 H new ATOM 0 HD13 LEU A 95 13.400 20.540 1.055 1.00 0.00 H new ATOM 0 HD21 LEU A 95 14.154 23.516 1.299 1.00 0.00 H new ATOM 0 HD22 LEU A 95 13.151 22.855 -0.014 1.00 0.00 H new ATOM 0 HD23 LEU A 95 12.539 24.194 0.986 1.00 0.00 H new ATOM 1463 N GLN A 96 10.524 22.652 4.291 1.00 0.00 N ATOM 1464 CA GLN A 96 10.831 23.079 5.651 1.00 0.00 C ATOM 1465 C GLN A 96 12.336 23.084 5.894 1.00 0.00 C ATOM 1466 O GLN A 96 13.034 22.135 5.540 1.00 0.00 O ATOM 1467 CB GLN A 96 10.142 22.163 6.664 1.00 0.00 C ATOM 1468 CG GLN A 96 8.626 22.273 6.651 1.00 0.00 C ATOM 1469 CD GLN A 96 8.130 23.570 7.259 1.00 0.00 C ATOM 1470 OE1 GLN A 96 7.488 24.378 6.587 1.00 0.00 O ATOM 1471 NE2 GLN A 96 8.425 23.776 8.537 1.00 0.00 N ATOM 0 H GLN A 96 10.473 21.641 4.168 1.00 0.00 H new ATOM 0 HA GLN A 96 10.458 24.095 5.778 1.00 0.00 H new ATOM 0 HB2 GLN A 96 10.425 21.131 6.459 1.00 0.00 H new ATOM 0 HB3 GLN A 96 10.507 22.401 7.663 1.00 0.00 H new ATOM 0 HG2 GLN A 96 8.269 22.198 5.624 1.00 0.00 H new ATOM 0 HG3 GLN A 96 8.200 21.433 7.199 1.00 0.00 H new ATOM 0 HE21 GLN A 96 8.959 23.079 9.056 1.00 0.00 H new ATOM 0 HE22 GLN A 96 8.117 24.631 9.000 1.00 0.00 H new ATOM 1480 N GLU A 97 12.830 24.160 6.500 1.00 0.00 N ATOM 1481 CA GLU A 97 14.253 24.288 6.789 1.00 0.00 C ATOM 1482 C GLU A 97 14.730 23.153 7.691 1.00 0.00 C ATOM 1483 O GLU A 97 14.712 23.270 8.916 1.00 0.00 O ATOM 1484 CB GLU A 97 14.543 25.637 7.452 1.00 0.00 C ATOM 1485 CG GLU A 97 15.988 25.802 7.889 1.00 0.00 C ATOM 1486 CD GLU A 97 16.220 27.085 8.663 1.00 0.00 C ATOM 1487 OE1 GLU A 97 15.694 28.136 8.242 1.00 0.00 O ATOM 1488 OE2 GLU A 97 16.929 27.037 9.690 1.00 0.00 O ATOM 0 H GLU A 97 12.265 24.955 6.800 1.00 0.00 H new ATOM 0 HA GLU A 97 14.795 24.231 5.845 1.00 0.00 H new ATOM 0 HB2 GLU A 97 14.289 26.436 6.756 1.00 0.00 H new ATOM 0 HB3 GLU A 97 13.894 25.753 8.320 1.00 0.00 H new ATOM 0 HG2 GLU A 97 16.276 24.952 8.507 1.00 0.00 H new ATOM 0 HG3 GLU A 97 16.633 25.790 7.010 1.00 0.00 H new ATOM 1495 N SER A 98 15.154 22.054 7.075 1.00 0.00 N ATOM 1496 CA SER A 98 15.632 20.896 7.822 1.00 0.00 C ATOM 1497 C SER A 98 16.247 19.862 6.884 1.00 0.00 C ATOM 1498 O SER A 98 15.607 19.409 5.934 1.00 0.00 O ATOM 1499 CB SER A 98 14.485 20.265 8.613 1.00 0.00 C ATOM 1500 OG SER A 98 14.944 19.178 9.397 1.00 0.00 O ATOM 0 H SER A 98 15.176 21.941 6.062 1.00 0.00 H new ATOM 0 HA SER A 98 16.401 21.234 8.517 1.00 0.00 H new ATOM 0 HB2 SER A 98 14.028 21.015 9.258 1.00 0.00 H new ATOM 0 HB3 SER A 98 13.711 19.921 7.926 1.00 0.00 H new ATOM 0 HG SER A 98 14.192 18.793 9.894 1.00 0.00 H new ATOM 1506 N LEU A 99 17.493 19.491 7.158 1.00 0.00 N ATOM 1507 CA LEU A 99 18.197 18.510 6.340 1.00 0.00 C ATOM 1508 C LEU A 99 19.131 17.659 7.194 1.00 0.00 C ATOM 1509 O LEU A 99 19.234 17.856 8.404 1.00 0.00 O ATOM 1510 CB LEU A 99 18.993 19.212 5.238 1.00 0.00 C ATOM 1511 CG LEU A 99 19.698 20.508 5.642 1.00 0.00 C ATOM 1512 CD1 LEU A 99 18.681 21.599 5.936 1.00 0.00 C ATOM 1513 CD2 LEU A 99 20.596 20.273 6.847 1.00 0.00 C ATOM 0 H LEU A 99 18.037 19.855 7.941 1.00 0.00 H new ATOM 0 HA LEU A 99 17.455 17.855 5.883 1.00 0.00 H new ATOM 0 HB2 LEU A 99 19.742 18.517 4.859 1.00 0.00 H new ATOM 0 HB3 LEU A 99 18.316 19.432 4.412 1.00 0.00 H new ATOM 0 HG LEU A 99 20.321 20.836 4.809 1.00 0.00 H new ATOM 0 HD11 LEU A 99 19.201 22.513 6.222 1.00 0.00 H new ATOM 0 HD12 LEU A 99 18.080 21.786 5.046 1.00 0.00 H new ATOM 0 HD13 LEU A 99 18.032 21.281 6.752 1.00 0.00 H new ATOM 0 HD21 LEU A 99 21.089 21.206 7.120 1.00 0.00 H new ATOM 0 HD22 LEU A 99 19.995 19.921 7.685 1.00 0.00 H new ATOM 0 HD23 LEU A 99 21.348 19.524 6.600 1.00 0.00 H new ATOM 1525 N ASN A 100 19.812 16.713 6.555 1.00 0.00 N ATOM 1526 CA ASN A 100 20.739 15.832 7.256 1.00 0.00 C ATOM 1527 C ASN A 100 22.075 16.529 7.496 1.00 0.00 C ATOM 1528 O ASN A 100 22.605 17.198 6.610 1.00 0.00 O ATOM 1529 CB ASN A 100 20.958 14.547 6.455 1.00 0.00 C ATOM 1530 CG ASN A 100 19.961 13.464 6.816 1.00 0.00 C ATOM 1531 OD1 ASN A 100 19.282 13.545 7.840 1.00 0.00 O ATOM 1532 ND2 ASN A 100 19.867 12.441 5.974 1.00 0.00 N ATOM 0 H ASN A 100 19.739 16.537 5.553 1.00 0.00 H new ATOM 0 HA ASN A 100 20.302 15.580 8.222 1.00 0.00 H new ATOM 0 HB2 ASN A 100 20.881 14.768 5.390 1.00 0.00 H new ATOM 0 HB3 ASN A 100 21.969 14.180 6.632 1.00 0.00 H new ATOM 0 HD21 ASN A 100 19.213 11.682 6.165 1.00 0.00 H new ATOM 0 HD22 ASN A 100 20.449 12.414 5.137 1.00 0.00 H new TER 1539 ASN A 100