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 43:sc= 1.13 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 177:sc= -0.571 (180deg=-0.587) USER MOD Single : A 20 ASN : amide:sc= -0.352 X(o=-0.35,f=-0.3) USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.184 USER MOD Single : A 29 CYS SG : rot -170:sc= 0 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 152:sc= 0 (180deg=-0.975) USER MOD Single : A 36 GLN : amide:sc= -1.07 K(o=-1.1,f=0.68) USER MOD Single : A 40 ASN : amide:sc= -0.231 X(o=-0.23,f=-0.14) USER MOD Single : A 43 GLN : amide:sc= -1.5 K(o=-1.5,f=-0.44) 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 -144:sc= -2.04 (180deg=-6.95!) USER MOD Single : A 52 LYS NZ :NH3+ -150:sc= 0 (180deg=-0.272) USER MOD Single : A 55 LYS NZ :NH3+ 165:sc=-0.00439 (180deg=-0.202) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot -45:sc= 0.312 USER MOD Single : A 63 THR OG1 : rot 180:sc= -0.848 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 : no HD1:sc= -1.22 X(o=-1.2,f=-0.75) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 ASN : amide:sc= -0.352 K(o=-0.35,f=-4.2!) USER MOD Single : A 74 ASN : amide:sc= -4.71! C(o=-4.7!,f=-8.5!) USER MOD Single : A 75 SER OG : rot 34:sc= 0.842 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 24:sc= 0.345 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 91 HIS : no HD1:sc= 0 X(o=0,f=-0.023) USER MOD Single : A 96 GLN : amide:sc= 0.0849 K(o=0.085,f=-3.9!) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 100 ASN : amide:sc= -1.1 K(o=-1.1,f=-1.8!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -6.843 -0.289 27.085 1.00 0.00 N ATOM 2 CA GLY A 1 -5.631 -0.550 27.839 1.00 0.00 C ATOM 3 C GLY A 1 -4.606 -1.327 27.037 1.00 0.00 C ATOM 4 O GLY A 1 -4.804 -2.505 26.740 1.00 0.00 O ATOM 0 H1 GLY A 1 -7.512 0.244 27.677 1.00 0.00 H new ATOM 0 H2 GLY A 1 -6.611 0.267 26.237 1.00 0.00 H new ATOM 0 H3 GLY A 1 -7.276 -1.191 26.800 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -5.195 0.396 28.160 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -5.881 -1.108 28.741 1.00 0.00 H new ATOM 8 N SER A 2 -3.507 -0.667 26.685 1.00 0.00 N ATOM 9 CA SER A 2 -2.449 -1.302 25.908 1.00 0.00 C ATOM 10 C SER A 2 -1.126 -1.273 26.667 1.00 0.00 C ATOM 11 O SER A 2 -0.071 -1.015 26.088 1.00 0.00 O ATOM 12 CB SER A 2 -2.290 -0.603 24.557 1.00 0.00 C ATOM 13 OG SER A 2 -1.790 0.713 24.719 1.00 0.00 O ATOM 0 H SER A 2 -3.326 0.308 26.926 1.00 0.00 H new ATOM 0 HA SER A 2 -2.729 -2.342 25.740 1.00 0.00 H new ATOM 0 HB2 SER A 2 -1.613 -1.177 23.924 1.00 0.00 H new ATOM 0 HB3 SER A 2 -3.252 -0.569 24.046 1.00 0.00 H new ATOM 0 HG SER A 2 -1.696 1.138 23.841 1.00 0.00 H new ATOM 19 N SER A 3 -1.191 -1.540 27.967 1.00 0.00 N ATOM 20 CA SER A 3 0.001 -1.542 28.808 1.00 0.00 C ATOM 21 C SER A 3 1.133 -2.318 28.143 1.00 0.00 C ATOM 22 O SER A 3 0.904 -3.333 27.486 1.00 0.00 O ATOM 23 CB SER A 3 -0.315 -2.149 30.176 1.00 0.00 C ATOM 24 OG SER A 3 -1.196 -1.319 30.912 1.00 0.00 O ATOM 0 H SER A 3 -2.056 -1.758 28.461 1.00 0.00 H new ATOM 0 HA SER A 3 0.322 -0.509 28.943 1.00 0.00 H new ATOM 0 HB2 SER A 3 -0.763 -3.134 30.045 1.00 0.00 H new ATOM 0 HB3 SER A 3 0.609 -2.291 30.736 1.00 0.00 H new ATOM 0 HG SER A 3 -1.383 -1.730 31.781 1.00 0.00 H new ATOM 30 N GLY A 4 2.359 -1.833 28.320 1.00 0.00 N ATOM 31 CA GLY A 4 3.510 -2.493 27.731 1.00 0.00 C ATOM 32 C GLY A 4 3.883 -1.913 26.381 1.00 0.00 C ATOM 33 O GLY A 4 3.167 -2.103 25.398 1.00 0.00 O ATOM 0 H GLY A 4 2.575 -0.995 28.860 1.00 0.00 H new ATOM 0 HA2 GLY A 4 4.360 -2.406 28.408 1.00 0.00 H new ATOM 0 HA3 GLY A 4 3.298 -3.556 27.620 1.00 0.00 H new ATOM 37 N SER A 5 5.006 -1.203 26.334 1.00 0.00 N ATOM 38 CA SER A 5 5.470 -0.589 25.095 1.00 0.00 C ATOM 39 C SER A 5 6.468 -1.495 24.381 1.00 0.00 C ATOM 40 O SER A 5 7.680 -1.312 24.494 1.00 0.00 O ATOM 41 CB SER A 5 6.111 0.769 25.384 1.00 0.00 C ATOM 42 OG SER A 5 6.693 1.317 24.213 1.00 0.00 O ATOM 0 H SER A 5 5.611 -1.039 27.139 1.00 0.00 H new ATOM 0 HA SER A 5 4.608 -0.444 24.444 1.00 0.00 H new ATOM 0 HB2 SER A 5 5.359 1.454 25.775 1.00 0.00 H new ATOM 0 HB3 SER A 5 6.873 0.658 26.155 1.00 0.00 H new ATOM 0 HG SER A 5 7.095 2.186 24.423 1.00 0.00 H new ATOM 48 N SER A 6 5.950 -2.473 23.645 1.00 0.00 N ATOM 49 CA SER A 6 6.795 -3.410 22.915 1.00 0.00 C ATOM 50 C SER A 6 6.129 -3.841 21.611 1.00 0.00 C ATOM 51 O SER A 6 5.116 -4.539 21.620 1.00 0.00 O ATOM 52 CB SER A 6 7.095 -4.638 23.777 1.00 0.00 C ATOM 53 OG SER A 6 8.097 -5.445 23.184 1.00 0.00 O ATOM 0 H SER A 6 4.949 -2.637 23.539 1.00 0.00 H new ATOM 0 HA SER A 6 7.731 -2.905 22.675 1.00 0.00 H new ATOM 0 HB2 SER A 6 7.419 -4.320 24.768 1.00 0.00 H new ATOM 0 HB3 SER A 6 6.185 -5.223 23.911 1.00 0.00 H new ATOM 0 HG SER A 6 8.272 -6.222 23.755 1.00 0.00 H new ATOM 59 N GLY A 7 6.707 -3.418 20.491 1.00 0.00 N ATOM 60 CA GLY A 7 6.156 -3.768 19.195 1.00 0.00 C ATOM 61 C GLY A 7 7.224 -3.887 18.125 1.00 0.00 C ATOM 62 O GLY A 7 8.139 -3.066 18.057 1.00 0.00 O ATOM 0 H GLY A 7 7.546 -2.840 20.458 1.00 0.00 H new ATOM 0 HA2 GLY A 7 5.619 -4.713 19.275 1.00 0.00 H new ATOM 0 HA3 GLY A 7 5.429 -3.013 18.896 1.00 0.00 H new ATOM 66 N ARG A 8 7.108 -4.913 17.287 1.00 0.00 N ATOM 67 CA ARG A 8 8.072 -5.138 16.217 1.00 0.00 C ATOM 68 C ARG A 8 7.684 -4.360 14.963 1.00 0.00 C ATOM 69 O ARG A 8 6.578 -4.511 14.445 1.00 0.00 O ATOM 70 CB ARG A 8 8.169 -6.630 15.895 1.00 0.00 C ATOM 71 CG ARG A 8 6.920 -7.194 15.238 1.00 0.00 C ATOM 72 CD ARG A 8 7.028 -8.697 15.034 1.00 0.00 C ATOM 73 NE ARG A 8 7.013 -9.424 16.301 1.00 0.00 N ATOM 74 CZ ARG A 8 8.102 -9.671 17.019 1.00 0.00 C ATOM 75 NH1 ARG A 8 9.287 -9.252 16.598 1.00 0.00 N ATOM 76 NH2 ARG A 8 8.007 -10.339 18.162 1.00 0.00 N ATOM 0 H ARG A 8 6.356 -5.601 17.329 1.00 0.00 H new ATOM 0 HA ARG A 8 9.045 -4.783 16.557 1.00 0.00 H new ATOM 0 HB2 ARG A 8 9.022 -6.796 15.237 1.00 0.00 H new ATOM 0 HB3 ARG A 8 8.365 -7.180 16.816 1.00 0.00 H new ATOM 0 HG2 ARG A 8 6.050 -6.971 15.856 1.00 0.00 H new ATOM 0 HG3 ARG A 8 6.761 -6.706 14.277 1.00 0.00 H new ATOM 0 HD2 ARG A 8 6.202 -9.038 14.410 1.00 0.00 H new ATOM 0 HD3 ARG A 8 7.948 -8.925 14.496 1.00 0.00 H new ATOM 0 HE ARG A 8 6.117 -9.760 16.653 1.00 0.00 H new ATOM 0 HH11 ARG A 8 9.364 -8.738 15.720 1.00 0.00 H new ATOM 0 HH12 ARG A 8 10.122 -9.443 17.152 1.00 0.00 H new ATOM 0 HH21 ARG A 8 7.097 -10.663 18.489 1.00 0.00 H new ATOM 0 HH22 ARG A 8 8.844 -10.528 18.713 1.00 0.00 H new ATOM 90 N MET A 9 8.602 -3.528 14.482 1.00 0.00 N ATOM 91 CA MET A 9 8.356 -2.727 13.288 1.00 0.00 C ATOM 92 C MET A 9 8.674 -3.521 12.025 1.00 0.00 C ATOM 93 O MET A 9 9.680 -4.230 11.963 1.00 0.00 O ATOM 94 CB MET A 9 9.193 -1.447 13.325 1.00 0.00 C ATOM 95 CG MET A 9 9.169 -0.743 14.672 1.00 0.00 C ATOM 96 SD MET A 9 7.541 -0.784 15.447 1.00 0.00 S ATOM 97 CE MET A 9 6.557 0.065 14.215 1.00 0.00 C ATOM 0 H MET A 9 9.522 -3.391 14.900 1.00 0.00 H new ATOM 0 HA MET A 9 7.299 -2.461 13.271 1.00 0.00 H new ATOM 0 HB2 MET A 9 10.224 -1.690 13.070 1.00 0.00 H new ATOM 0 HB3 MET A 9 8.828 -0.762 12.560 1.00 0.00 H new ATOM 0 HG2 MET A 9 9.895 -1.212 15.336 1.00 0.00 H new ATOM 0 HG3 MET A 9 9.479 0.294 14.542 1.00 0.00 H new ATOM 0 HE1 MET A 9 5.512 0.073 14.526 1.00 0.00 H new ATOM 0 HE2 MET A 9 6.912 1.090 14.109 1.00 0.00 H new ATOM 0 HE3 MET A 9 6.647 -0.451 13.259 1.00 0.00 H new ATOM 107 N LEU A 10 7.813 -3.399 11.022 1.00 0.00 N ATOM 108 CA LEU A 10 8.002 -4.106 9.760 1.00 0.00 C ATOM 109 C LEU A 10 8.209 -3.124 8.611 1.00 0.00 C ATOM 110 O LEU A 10 7.335 -2.311 8.312 1.00 0.00 O ATOM 111 CB LEU A 10 6.798 -5.003 9.469 1.00 0.00 C ATOM 112 CG LEU A 10 6.377 -5.948 10.595 1.00 0.00 C ATOM 113 CD1 LEU A 10 5.044 -6.604 10.270 1.00 0.00 C ATOM 114 CD2 LEU A 10 7.448 -7.001 10.836 1.00 0.00 C ATOM 0 H LEU A 10 6.976 -2.817 11.058 1.00 0.00 H new ATOM 0 HA LEU A 10 8.895 -4.725 9.850 1.00 0.00 H new ATOM 0 HB2 LEU A 10 5.949 -4.367 9.219 1.00 0.00 H new ATOM 0 HB3 LEU A 10 7.021 -5.600 8.585 1.00 0.00 H new ATOM 0 HG LEU A 10 6.258 -5.365 11.508 1.00 0.00 H new ATOM 0 HD11 LEU A 10 4.760 -7.273 11.082 1.00 0.00 H new ATOM 0 HD12 LEU A 10 4.280 -5.836 10.149 1.00 0.00 H new ATOM 0 HD13 LEU A 10 5.135 -7.174 9.345 1.00 0.00 H new ATOM 0 HD21 LEU A 10 7.131 -7.665 11.641 1.00 0.00 H new ATOM 0 HD22 LEU A 10 7.599 -7.581 9.926 1.00 0.00 H new ATOM 0 HD23 LEU A 10 8.382 -6.513 11.115 1.00 0.00 H new ATOM 126 N ASP A 11 9.370 -3.207 7.971 1.00 0.00 N ATOM 127 CA ASP A 11 9.690 -2.328 6.852 1.00 0.00 C ATOM 128 C ASP A 11 9.094 -2.861 5.553 1.00 0.00 C ATOM 129 O ASP A 11 9.666 -3.742 4.911 1.00 0.00 O ATOM 130 CB ASP A 11 11.206 -2.181 6.710 1.00 0.00 C ATOM 131 CG ASP A 11 11.597 -0.933 5.942 1.00 0.00 C ATOM 132 OD1 ASP A 11 11.294 -0.861 4.733 1.00 0.00 O ATOM 133 OD2 ASP A 11 12.207 -0.029 6.551 1.00 0.00 O ATOM 0 H ASP A 11 10.105 -3.874 8.208 1.00 0.00 H new ATOM 0 HA ASP A 11 9.255 -1.349 7.055 1.00 0.00 H new ATOM 0 HB2 ASP A 11 11.660 -2.152 7.701 1.00 0.00 H new ATOM 0 HB3 ASP A 11 11.607 -3.058 6.202 1.00 0.00 H new ATOM 138 N PHE A 12 7.940 -2.323 5.173 1.00 0.00 N ATOM 139 CA PHE A 12 7.265 -2.746 3.952 1.00 0.00 C ATOM 140 C PHE A 12 7.642 -1.843 2.781 1.00 0.00 C ATOM 141 O PHE A 12 7.258 -0.674 2.736 1.00 0.00 O ATOM 142 CB PHE A 12 5.748 -2.734 4.152 1.00 0.00 C ATOM 143 CG PHE A 12 5.229 -3.944 4.875 1.00 0.00 C ATOM 144 CD1 PHE A 12 4.985 -5.124 4.191 1.00 0.00 C ATOM 145 CD2 PHE A 12 4.985 -3.901 6.238 1.00 0.00 C ATOM 146 CE1 PHE A 12 4.508 -6.239 4.853 1.00 0.00 C ATOM 147 CE2 PHE A 12 4.508 -5.013 6.905 1.00 0.00 C ATOM 148 CZ PHE A 12 4.268 -6.183 6.212 1.00 0.00 C ATOM 0 H PHE A 12 7.453 -1.593 5.693 1.00 0.00 H new ATOM 0 HA PHE A 12 7.586 -3.762 3.723 1.00 0.00 H new ATOM 0 HB2 PHE A 12 5.470 -1.840 4.710 1.00 0.00 H new ATOM 0 HB3 PHE A 12 5.262 -2.666 3.179 1.00 0.00 H new ATOM 0 HD1 PHE A 12 5.170 -5.173 3.128 1.00 0.00 H new ATOM 0 HD2 PHE A 12 5.170 -2.988 6.785 1.00 0.00 H new ATOM 0 HE1 PHE A 12 4.323 -7.153 4.308 1.00 0.00 H new ATOM 0 HE2 PHE A 12 4.323 -4.967 7.968 1.00 0.00 H new ATOM 0 HZ PHE A 12 3.893 -7.053 6.732 1.00 0.00 H new ATOM 158 N ARG A 13 8.397 -2.394 1.836 1.00 0.00 N ATOM 159 CA ARG A 13 8.828 -1.639 0.665 1.00 0.00 C ATOM 160 C ARG A 13 7.832 -1.797 -0.480 1.00 0.00 C ATOM 161 O ARG A 13 7.773 -2.843 -1.126 1.00 0.00 O ATOM 162 CB ARG A 13 10.215 -2.101 0.216 1.00 0.00 C ATOM 163 CG ARG A 13 11.353 -1.325 0.860 1.00 0.00 C ATOM 164 CD ARG A 13 12.631 -1.429 0.043 1.00 0.00 C ATOM 165 NE ARG A 13 13.416 -2.608 0.401 1.00 0.00 N ATOM 166 CZ ARG A 13 13.206 -3.815 -0.113 1.00 0.00 C ATOM 167 NH1 ARG A 13 12.242 -4.001 -1.004 1.00 0.00 N ATOM 168 NH2 ARG A 13 13.962 -4.838 0.263 1.00 0.00 N ATOM 0 H ARG A 13 8.723 -3.360 1.858 1.00 0.00 H new ATOM 0 HA ARG A 13 8.875 -0.585 0.940 1.00 0.00 H new ATOM 0 HB2 ARG A 13 10.330 -3.159 0.450 1.00 0.00 H new ATOM 0 HB3 ARG A 13 10.288 -2.005 -0.867 1.00 0.00 H new ATOM 0 HG2 ARG A 13 11.069 -0.278 0.961 1.00 0.00 H new ATOM 0 HG3 ARG A 13 11.531 -1.706 1.866 1.00 0.00 H new ATOM 0 HD2 ARG A 13 12.381 -1.468 -1.017 1.00 0.00 H new ATOM 0 HD3 ARG A 13 13.233 -0.533 0.196 1.00 0.00 H new ATOM 0 HE ARG A 13 14.167 -2.498 1.083 1.00 0.00 H new ATOM 0 HH11 ARG A 13 11.659 -3.216 -1.296 1.00 0.00 H new ATOM 0 HH12 ARG A 13 12.083 -4.929 -1.397 1.00 0.00 H new ATOM 0 HH21 ARG A 13 14.705 -4.698 0.947 1.00 0.00 H new ATOM 0 HH22 ARG A 13 13.800 -5.764 -0.132 1.00 0.00 H new ATOM 182 N VAL A 14 7.051 -0.750 -0.727 1.00 0.00 N ATOM 183 CA VAL A 14 6.059 -0.771 -1.795 1.00 0.00 C ATOM 184 C VAL A 14 6.641 -0.235 -3.098 1.00 0.00 C ATOM 185 O VAL A 14 6.770 0.975 -3.280 1.00 0.00 O ATOM 186 CB VAL A 14 4.815 0.058 -1.422 1.00 0.00 C ATOM 187 CG1 VAL A 14 3.838 0.108 -2.587 1.00 0.00 C ATOM 188 CG2 VAL A 14 4.148 -0.513 -0.180 1.00 0.00 C ATOM 0 H VAL A 14 7.086 0.124 -0.202 1.00 0.00 H new ATOM 0 HA VAL A 14 5.766 -1.812 -1.933 1.00 0.00 H new ATOM 0 HB VAL A 14 5.131 1.077 -1.201 1.00 0.00 H new ATOM 0 HG11 VAL A 14 2.966 0.698 -2.305 1.00 0.00 H new ATOM 0 HG12 VAL A 14 4.323 0.566 -3.449 1.00 0.00 H new ATOM 0 HG13 VAL A 14 3.525 -0.904 -2.843 1.00 0.00 H new ATOM 0 HG21 VAL A 14 3.271 0.085 0.069 1.00 0.00 H new ATOM 0 HG22 VAL A 14 3.844 -1.542 -0.371 1.00 0.00 H new ATOM 0 HG23 VAL A 14 4.851 -0.491 0.653 1.00 0.00 H new ATOM 198 N GLU A 15 6.991 -1.145 -4.002 1.00 0.00 N ATOM 199 CA GLU A 15 7.561 -0.763 -5.288 1.00 0.00 C ATOM 200 C GLU A 15 6.472 -0.281 -6.243 1.00 0.00 C ATOM 201 O GLU A 15 5.708 -1.079 -6.786 1.00 0.00 O ATOM 202 CB GLU A 15 8.313 -1.942 -5.909 1.00 0.00 C ATOM 203 CG GLU A 15 9.172 -1.557 -7.102 1.00 0.00 C ATOM 204 CD GLU A 15 9.498 -2.740 -7.992 1.00 0.00 C ATOM 205 OE1 GLU A 15 8.709 -3.708 -8.006 1.00 0.00 O ATOM 206 OE2 GLU A 15 10.542 -2.696 -8.676 1.00 0.00 O ATOM 0 H GLU A 15 6.890 -2.151 -3.867 1.00 0.00 H new ATOM 0 HA GLU A 15 8.261 0.055 -5.118 1.00 0.00 H new ATOM 0 HB2 GLU A 15 8.946 -2.399 -5.149 1.00 0.00 H new ATOM 0 HB3 GLU A 15 7.592 -2.698 -6.220 1.00 0.00 H new ATOM 0 HG2 GLU A 15 8.654 -0.798 -7.688 1.00 0.00 H new ATOM 0 HG3 GLU A 15 10.099 -1.108 -6.747 1.00 0.00 H new ATOM 213 N TYR A 16 6.408 1.031 -6.443 1.00 0.00 N ATOM 214 CA TYR A 16 5.412 1.621 -7.329 1.00 0.00 C ATOM 215 C TYR A 16 6.078 2.298 -8.523 1.00 0.00 C ATOM 216 O TYR A 16 7.215 2.763 -8.433 1.00 0.00 O ATOM 217 CB TYR A 16 4.556 2.634 -6.567 1.00 0.00 C ATOM 218 CG TYR A 16 3.519 3.319 -7.427 1.00 0.00 C ATOM 219 CD1 TYR A 16 2.666 2.584 -8.240 1.00 0.00 C ATOM 220 CD2 TYR A 16 3.391 4.703 -7.425 1.00 0.00 C ATOM 221 CE1 TYR A 16 1.717 3.206 -9.028 1.00 0.00 C ATOM 222 CE2 TYR A 16 2.444 5.334 -8.209 1.00 0.00 C ATOM 223 CZ TYR A 16 1.610 4.581 -9.009 1.00 0.00 C ATOM 224 OH TYR A 16 0.665 5.205 -9.791 1.00 0.00 O ATOM 0 H TYR A 16 7.034 1.706 -6.003 1.00 0.00 H new ATOM 0 HA TYR A 16 4.772 0.820 -7.698 1.00 0.00 H new ATOM 0 HB2 TYR A 16 4.055 2.126 -5.743 1.00 0.00 H new ATOM 0 HB3 TYR A 16 5.207 3.389 -6.127 1.00 0.00 H new ATOM 0 HD1 TYR A 16 2.746 1.507 -8.256 1.00 0.00 H new ATOM 0 HD2 TYR A 16 4.043 5.295 -6.800 1.00 0.00 H new ATOM 0 HE1 TYR A 16 1.063 2.619 -9.655 1.00 0.00 H new ATOM 0 HE2 TYR A 16 2.357 6.410 -8.195 1.00 0.00 H new ATOM 0 HH TYR A 16 0.721 6.175 -9.660 1.00 0.00 H new ATOM 234 N ARG A 17 5.362 2.350 -9.641 1.00 0.00 N ATOM 235 CA ARG A 17 5.882 2.970 -10.854 1.00 0.00 C ATOM 236 C ARG A 17 6.778 4.158 -10.517 1.00 0.00 C ATOM 237 O ARG A 17 7.922 4.233 -10.964 1.00 0.00 O ATOM 238 CB ARG A 17 4.732 3.424 -11.755 1.00 0.00 C ATOM 239 CG ARG A 17 3.842 2.286 -12.227 1.00 0.00 C ATOM 240 CD ARG A 17 2.644 2.802 -13.007 1.00 0.00 C ATOM 241 NE ARG A 17 2.970 3.056 -14.408 1.00 0.00 N ATOM 242 CZ ARG A 17 3.241 2.095 -15.285 1.00 0.00 C ATOM 243 NH1 ARG A 17 3.224 0.824 -14.907 1.00 0.00 N ATOM 244 NH2 ARG A 17 3.529 2.405 -16.542 1.00 0.00 N ATOM 0 H ARG A 17 4.420 1.970 -9.732 1.00 0.00 H new ATOM 0 HA ARG A 17 6.478 2.227 -11.384 1.00 0.00 H new ATOM 0 HB2 ARG A 17 4.124 4.150 -11.215 1.00 0.00 H new ATOM 0 HB3 ARG A 17 5.144 3.937 -12.624 1.00 0.00 H new ATOM 0 HG2 ARG A 17 4.420 1.607 -12.853 1.00 0.00 H new ATOM 0 HG3 ARG A 17 3.498 1.712 -11.367 1.00 0.00 H new ATOM 0 HD2 ARG A 17 1.834 2.075 -12.950 1.00 0.00 H new ATOM 0 HD3 ARG A 17 2.281 3.721 -12.547 1.00 0.00 H new ATOM 0 HE ARG A 17 2.991 4.023 -14.731 1.00 0.00 H new ATOM 0 HH11 ARG A 17 3.003 0.582 -13.941 1.00 0.00 H new ATOM 0 HH12 ARG A 17 3.432 0.088 -15.582 1.00 0.00 H new ATOM 0 HH21 ARG A 17 3.543 3.382 -16.836 1.00 0.00 H new ATOM 0 HH22 ARG A 17 3.737 1.667 -17.215 1.00 0.00 H new ATOM 258 N ASP A 18 6.248 5.085 -9.726 1.00 0.00 N ATOM 259 CA ASP A 18 6.999 6.270 -9.327 1.00 0.00 C ATOM 260 C ASP A 18 8.293 5.881 -8.618 1.00 0.00 C ATOM 261 O ASP A 18 9.386 6.230 -9.064 1.00 0.00 O ATOM 262 CB ASP A 18 6.149 7.156 -8.415 1.00 0.00 C ATOM 263 CG ASP A 18 5.247 8.093 -9.194 1.00 0.00 C ATOM 264 OD1 ASP A 18 5.738 9.147 -9.650 1.00 0.00 O ATOM 265 OD2 ASP A 18 4.051 7.771 -9.349 1.00 0.00 O ATOM 0 H ASP A 18 5.302 5.039 -9.349 1.00 0.00 H new ATOM 0 HA ASP A 18 7.254 6.828 -10.228 1.00 0.00 H new ATOM 0 HB2 ASP A 18 5.540 6.526 -7.766 1.00 0.00 H new ATOM 0 HB3 ASP A 18 6.804 7.741 -7.769 1.00 0.00 H new ATOM 270 N ARG A 19 8.160 5.157 -7.511 1.00 0.00 N ATOM 271 CA ARG A 19 9.317 4.723 -6.739 1.00 0.00 C ATOM 272 C ARG A 19 8.894 3.809 -5.593 1.00 0.00 C ATOM 273 O ARG A 19 7.708 3.550 -5.398 1.00 0.00 O ATOM 274 CB ARG A 19 10.073 5.933 -6.188 1.00 0.00 C ATOM 275 CG ARG A 19 9.261 6.764 -5.208 1.00 0.00 C ATOM 276 CD ARG A 19 10.065 7.938 -4.673 1.00 0.00 C ATOM 277 NE ARG A 19 10.549 8.804 -5.745 1.00 0.00 N ATOM 278 CZ ARG A 19 10.916 10.067 -5.561 1.00 0.00 C ATOM 279 NH1 ARG A 19 10.856 10.609 -4.352 1.00 0.00 N ATOM 280 NH2 ARG A 19 11.346 10.791 -6.586 1.00 0.00 N ATOM 0 H ARG A 19 7.262 4.859 -7.129 1.00 0.00 H new ATOM 0 HA ARG A 19 9.976 4.164 -7.403 1.00 0.00 H new ATOM 0 HB2 ARG A 19 10.982 5.589 -5.694 1.00 0.00 H new ATOM 0 HB3 ARG A 19 10.383 6.567 -7.019 1.00 0.00 H new ATOM 0 HG2 ARG A 19 8.361 7.132 -5.700 1.00 0.00 H new ATOM 0 HG3 ARG A 19 8.936 6.136 -4.378 1.00 0.00 H new ATOM 0 HD2 ARG A 19 9.447 8.519 -3.989 1.00 0.00 H new ATOM 0 HD3 ARG A 19 10.912 7.565 -4.098 1.00 0.00 H new ATOM 0 HE ARG A 19 10.608 8.417 -6.687 1.00 0.00 H new ATOM 0 HH11 ARG A 19 10.527 10.056 -3.561 1.00 0.00 H new ATOM 0 HH12 ARG A 19 11.139 11.579 -4.213 1.00 0.00 H new ATOM 0 HH21 ARG A 19 11.395 10.378 -7.517 1.00 0.00 H new ATOM 0 HH22 ARG A 19 11.627 11.761 -6.443 1.00 0.00 H new ATOM 294 N ASN A 20 9.874 3.323 -4.837 1.00 0.00 N ATOM 295 CA ASN A 20 9.604 2.437 -3.711 1.00 0.00 C ATOM 296 C ASN A 20 9.598 3.213 -2.397 1.00 0.00 C ATOM 297 O ASN A 20 10.631 3.719 -1.959 1.00 0.00 O ATOM 298 CB ASN A 20 10.647 1.320 -3.652 1.00 0.00 C ATOM 299 CG ASN A 20 12.020 1.787 -4.094 1.00 0.00 C ATOM 300 OD1 ASN A 20 12.779 2.353 -3.306 1.00 0.00 O ATOM 301 ND2 ASN A 20 12.347 1.553 -5.359 1.00 0.00 N ATOM 0 H ASN A 20 10.862 3.528 -4.984 1.00 0.00 H new ATOM 0 HA ASN A 20 8.618 1.996 -3.856 1.00 0.00 H new ATOM 0 HB2 ASN A 20 10.707 0.936 -2.634 1.00 0.00 H new ATOM 0 HB3 ASN A 20 10.326 0.493 -4.286 1.00 0.00 H new ATOM 0 HD21 ASN A 20 13.258 1.845 -5.713 1.00 0.00 H new ATOM 0 HD22 ASN A 20 11.687 1.081 -5.977 1.00 0.00 H new ATOM 308 N VAL A 21 8.428 3.303 -1.774 1.00 0.00 N ATOM 309 CA VAL A 21 8.288 4.015 -0.509 1.00 0.00 C ATOM 310 C VAL A 21 8.387 3.059 0.674 1.00 0.00 C ATOM 311 O VAL A 21 7.838 1.958 0.643 1.00 0.00 O ATOM 312 CB VAL A 21 6.946 4.769 -0.436 1.00 0.00 C ATOM 313 CG1 VAL A 21 5.781 3.794 -0.519 1.00 0.00 C ATOM 314 CG2 VAL A 21 6.870 5.596 0.839 1.00 0.00 C ATOM 0 H VAL A 21 7.563 2.892 -2.124 1.00 0.00 H new ATOM 0 HA VAL A 21 9.105 4.735 -0.458 1.00 0.00 H new ATOM 0 HB VAL A 21 6.882 5.447 -1.287 1.00 0.00 H new ATOM 0 HG11 VAL A 21 4.842 4.344 -0.466 1.00 0.00 H new ATOM 0 HG12 VAL A 21 5.829 3.249 -1.462 1.00 0.00 H new ATOM 0 HG13 VAL A 21 5.836 3.090 0.311 1.00 0.00 H new ATOM 0 HG21 VAL A 21 5.916 6.122 0.875 1.00 0.00 H new ATOM 0 HG22 VAL A 21 6.955 4.939 1.705 1.00 0.00 H new ATOM 0 HG23 VAL A 21 7.685 6.320 0.852 1.00 0.00 H new ATOM 324 N ASP A 22 9.090 3.488 1.716 1.00 0.00 N ATOM 325 CA ASP A 22 9.261 2.671 2.912 1.00 0.00 C ATOM 326 C ASP A 22 8.121 2.906 3.898 1.00 0.00 C ATOM 327 O ASP A 22 7.760 4.048 4.185 1.00 0.00 O ATOM 328 CB ASP A 22 10.601 2.980 3.580 1.00 0.00 C ATOM 329 CG ASP A 22 11.038 1.887 4.536 1.00 0.00 C ATOM 330 OD1 ASP A 22 10.180 1.381 5.289 1.00 0.00 O ATOM 331 OD2 ASP A 22 12.237 1.538 4.531 1.00 0.00 O ATOM 0 H ASP A 22 9.551 4.397 1.757 1.00 0.00 H new ATOM 0 HA ASP A 22 9.247 1.623 2.611 1.00 0.00 H new ATOM 0 HB2 ASP A 22 11.364 3.114 2.813 1.00 0.00 H new ATOM 0 HB3 ASP A 22 10.525 3.923 4.121 1.00 0.00 H new ATOM 336 N VAL A 23 7.556 1.818 4.413 1.00 0.00 N ATOM 337 CA VAL A 23 6.457 1.906 5.367 1.00 0.00 C ATOM 338 C VAL A 23 6.804 1.198 6.672 1.00 0.00 C ATOM 339 O VAL A 23 7.506 0.186 6.674 1.00 0.00 O ATOM 340 CB VAL A 23 5.165 1.295 4.792 1.00 0.00 C ATOM 341 CG1 VAL A 23 4.047 1.343 5.822 1.00 0.00 C ATOM 342 CG2 VAL A 23 4.757 2.017 3.517 1.00 0.00 C ATOM 0 H VAL A 23 7.841 0.866 4.185 1.00 0.00 H new ATOM 0 HA VAL A 23 6.293 2.965 5.564 1.00 0.00 H new ATOM 0 HB VAL A 23 5.356 0.250 4.546 1.00 0.00 H new ATOM 0 HG11 VAL A 23 3.142 0.907 5.398 1.00 0.00 H new ATOM 0 HG12 VAL A 23 4.342 0.778 6.706 1.00 0.00 H new ATOM 0 HG13 VAL A 23 3.854 2.379 6.101 1.00 0.00 H new ATOM 0 HG21 VAL A 23 3.842 1.573 3.124 1.00 0.00 H new ATOM 0 HG22 VAL A 23 4.584 3.071 3.735 1.00 0.00 H new ATOM 0 HG23 VAL A 23 5.552 1.926 2.777 1.00 0.00 H new ATOM 352 N VAL A 24 6.307 1.736 7.781 1.00 0.00 N ATOM 353 CA VAL A 24 6.563 1.156 9.093 1.00 0.00 C ATOM 354 C VAL A 24 5.281 1.062 9.912 1.00 0.00 C ATOM 355 O VAL A 24 4.644 2.074 10.207 1.00 0.00 O ATOM 356 CB VAL A 24 7.602 1.978 9.879 1.00 0.00 C ATOM 357 CG1 VAL A 24 7.560 1.620 11.356 1.00 0.00 C ATOM 358 CG2 VAL A 24 8.995 1.761 9.308 1.00 0.00 C ATOM 0 H VAL A 24 5.724 2.573 7.797 1.00 0.00 H new ATOM 0 HA VAL A 24 6.957 0.154 8.923 1.00 0.00 H new ATOM 0 HB VAL A 24 7.354 3.035 9.779 1.00 0.00 H new ATOM 0 HG11 VAL A 24 8.301 2.211 11.895 1.00 0.00 H new ATOM 0 HG12 VAL A 24 6.568 1.832 11.754 1.00 0.00 H new ATOM 0 HG13 VAL A 24 7.781 0.560 11.480 1.00 0.00 H new ATOM 0 HG21 VAL A 24 9.716 2.349 9.875 1.00 0.00 H new ATOM 0 HG22 VAL A 24 9.255 0.705 9.375 1.00 0.00 H new ATOM 0 HG23 VAL A 24 9.013 2.073 8.264 1.00 0.00 H new ATOM 368 N LEU A 25 4.907 -0.159 10.278 1.00 0.00 N ATOM 369 CA LEU A 25 3.699 -0.386 11.065 1.00 0.00 C ATOM 370 C LEU A 25 3.803 -1.684 11.859 1.00 0.00 C ATOM 371 O LEU A 25 4.190 -2.722 11.322 1.00 0.00 O ATOM 372 CB LEU A 25 2.473 -0.430 10.152 1.00 0.00 C ATOM 373 CG LEU A 25 2.147 -1.788 9.530 1.00 0.00 C ATOM 374 CD1 LEU A 25 0.784 -1.754 8.857 1.00 0.00 C ATOM 375 CD2 LEU A 25 3.225 -2.191 8.535 1.00 0.00 C ATOM 0 H LEU A 25 5.422 -1.007 10.043 1.00 0.00 H new ATOM 0 HA LEU A 25 3.592 0.440 11.767 1.00 0.00 H new ATOM 0 HB2 LEU A 25 1.607 -0.098 10.724 1.00 0.00 H new ATOM 0 HB3 LEU A 25 2.619 0.290 9.347 1.00 0.00 H new ATOM 0 HG LEU A 25 2.118 -2.533 10.325 1.00 0.00 H new ATOM 0 HD11 LEU A 25 0.570 -2.729 8.420 1.00 0.00 H new ATOM 0 HD12 LEU A 25 0.020 -1.511 9.595 1.00 0.00 H new ATOM 0 HD13 LEU A 25 0.784 -0.997 8.073 1.00 0.00 H new ATOM 0 HD21 LEU A 25 2.977 -3.160 8.102 1.00 0.00 H new ATOM 0 HD22 LEU A 25 3.286 -1.445 7.743 1.00 0.00 H new ATOM 0 HD23 LEU A 25 4.185 -2.257 9.046 1.00 0.00 H new ATOM 387 N GLU A 26 3.452 -1.618 13.140 1.00 0.00 N ATOM 388 CA GLU A 26 3.504 -2.789 14.007 1.00 0.00 C ATOM 389 C GLU A 26 2.671 -3.931 13.430 1.00 0.00 C ATOM 390 O GLU A 26 1.772 -3.709 12.619 1.00 0.00 O ATOM 391 CB GLU A 26 3.004 -2.436 15.409 1.00 0.00 C ATOM 392 CG GLU A 26 3.633 -3.275 16.509 1.00 0.00 C ATOM 393 CD GLU A 26 3.180 -2.856 17.894 1.00 0.00 C ATOM 394 OE1 GLU A 26 3.000 -1.640 18.115 1.00 0.00 O ATOM 395 OE2 GLU A 26 3.006 -3.743 18.755 1.00 0.00 O ATOM 0 H GLU A 26 3.129 -0.767 13.600 1.00 0.00 H new ATOM 0 HA GLU A 26 4.542 -3.116 14.071 1.00 0.00 H new ATOM 0 HB2 GLU A 26 3.209 -1.383 15.604 1.00 0.00 H new ATOM 0 HB3 GLU A 26 1.922 -2.561 15.442 1.00 0.00 H new ATOM 0 HG2 GLU A 26 3.381 -4.323 16.350 1.00 0.00 H new ATOM 0 HG3 GLU A 26 4.718 -3.195 16.446 1.00 0.00 H new ATOM 402 N ASP A 27 2.978 -5.152 13.855 1.00 0.00 N ATOM 403 CA ASP A 27 2.258 -6.329 13.382 1.00 0.00 C ATOM 404 C ASP A 27 0.808 -6.306 13.856 1.00 0.00 C ATOM 405 O ASP A 27 0.008 -7.167 13.487 1.00 0.00 O ATOM 406 CB ASP A 27 2.947 -7.604 13.870 1.00 0.00 C ATOM 407 CG ASP A 27 2.899 -7.747 15.379 1.00 0.00 C ATOM 408 OD1 ASP A 27 3.549 -6.936 16.072 1.00 0.00 O ATOM 409 OD2 ASP A 27 2.212 -8.669 15.866 1.00 0.00 O ATOM 0 H ASP A 27 3.720 -5.352 14.526 1.00 0.00 H new ATOM 0 HA ASP A 27 2.265 -6.316 12.292 1.00 0.00 H new ATOM 0 HB2 ASP A 27 2.470 -8.470 13.411 1.00 0.00 H new ATOM 0 HB3 ASP A 27 3.986 -7.601 13.541 1.00 0.00 H new ATOM 414 N THR A 28 0.475 -5.315 14.678 1.00 0.00 N ATOM 415 CA THR A 28 -0.878 -5.180 15.204 1.00 0.00 C ATOM 416 C THR A 28 -1.801 -4.519 14.187 1.00 0.00 C ATOM 417 O THR A 28 -2.999 -4.799 14.148 1.00 0.00 O ATOM 418 CB THR A 28 -0.894 -4.358 16.507 1.00 0.00 C ATOM 419 OG1 THR A 28 -0.298 -3.075 16.284 1.00 0.00 O ATOM 420 CG2 THR A 28 -0.147 -5.085 17.615 1.00 0.00 C ATOM 0 H THR A 28 1.124 -4.594 14.994 1.00 0.00 H new ATOM 0 HA THR A 28 -1.237 -6.187 15.414 1.00 0.00 H new ATOM 0 HB THR A 28 -1.931 -4.227 16.816 1.00 0.00 H new ATOM 0 HG1 THR A 28 -0.314 -2.558 17.116 1.00 0.00 H new ATOM 0 HG21 THR A 28 -0.172 -4.485 18.525 1.00 0.00 H new ATOM 0 HG22 THR A 28 -0.621 -6.048 17.802 1.00 0.00 H new ATOM 0 HG23 THR A 28 0.888 -5.243 17.313 1.00 0.00 H new ATOM 428 N CYS A 29 -1.235 -3.641 13.366 1.00 0.00 N ATOM 429 CA CYS A 29 -2.009 -2.939 12.348 1.00 0.00 C ATOM 430 C CYS A 29 -2.617 -3.922 11.353 1.00 0.00 C ATOM 431 O CYS A 29 -2.080 -5.007 11.127 1.00 0.00 O ATOM 432 CB CYS A 29 -1.125 -1.931 11.611 1.00 0.00 C ATOM 433 SG CYS A 29 -0.860 -0.386 12.511 1.00 0.00 S ATOM 0 H CYS A 29 -0.244 -3.399 13.385 1.00 0.00 H new ATOM 0 HA CYS A 29 -2.819 -2.406 12.846 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -0.158 -2.392 11.409 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -1.578 -1.704 10.646 1.00 0.00 H new ATOM 0 HG CYS A 29 -0.282 0.478 11.730 1.00 0.00 H new ATOM 439 N THR A 30 -3.744 -3.536 10.762 1.00 0.00 N ATOM 440 CA THR A 30 -4.428 -4.384 9.794 1.00 0.00 C ATOM 441 C THR A 30 -3.828 -4.224 8.402 1.00 0.00 C ATOM 442 O THR A 30 -3.354 -3.147 8.039 1.00 0.00 O ATOM 443 CB THR A 30 -5.934 -4.065 9.732 1.00 0.00 C ATOM 444 OG1 THR A 30 -6.452 -3.889 11.055 1.00 0.00 O ATOM 445 CG2 THR A 30 -6.695 -5.177 9.027 1.00 0.00 C ATOM 0 H THR A 30 -4.202 -2.642 10.937 1.00 0.00 H new ATOM 0 HA THR A 30 -4.296 -5.413 10.127 1.00 0.00 H new ATOM 0 HB THR A 30 -6.064 -3.143 9.166 1.00 0.00 H new ATOM 0 HG1 THR A 30 -7.409 -3.685 11.007 1.00 0.00 H new ATOM 0 HG21 THR A 30 -7.756 -4.929 8.996 1.00 0.00 H new ATOM 0 HG22 THR A 30 -6.318 -5.288 8.010 1.00 0.00 H new ATOM 0 HG23 THR A 30 -6.557 -6.113 9.569 1.00 0.00 H new ATOM 453 N VAL A 31 -3.853 -5.302 7.624 1.00 0.00 N ATOM 454 CA VAL A 31 -3.314 -5.280 6.269 1.00 0.00 C ATOM 455 C VAL A 31 -3.891 -4.119 5.467 1.00 0.00 C ATOM 456 O VAL A 31 -3.256 -3.614 4.542 1.00 0.00 O ATOM 457 CB VAL A 31 -3.605 -6.598 5.528 1.00 0.00 C ATOM 458 CG1 VAL A 31 -2.803 -7.740 6.133 1.00 0.00 C ATOM 459 CG2 VAL A 31 -5.094 -6.907 5.556 1.00 0.00 C ATOM 0 H VAL A 31 -4.241 -6.201 7.909 1.00 0.00 H new ATOM 0 HA VAL A 31 -2.235 -5.154 6.359 1.00 0.00 H new ATOM 0 HB VAL A 31 -3.300 -6.484 4.488 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -3.022 -8.663 5.596 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -1.739 -7.519 6.055 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -3.073 -7.858 7.182 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -5.282 -7.842 5.028 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -5.427 -7.001 6.590 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -5.642 -6.100 5.071 1.00 0.00 H new ATOM 469 N GLY A 32 -5.100 -3.700 5.827 1.00 0.00 N ATOM 470 CA GLY A 32 -5.743 -2.602 5.131 1.00 0.00 C ATOM 471 C GLY A 32 -4.979 -1.300 5.271 1.00 0.00 C ATOM 472 O GLY A 32 -4.937 -0.495 4.342 1.00 0.00 O ATOM 0 H GLY A 32 -5.646 -4.102 6.589 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -5.838 -2.852 4.074 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -6.753 -2.471 5.520 1.00 0.00 H new ATOM 476 N GLU A 33 -4.376 -1.092 6.437 1.00 0.00 N ATOM 477 CA GLU A 33 -3.612 0.123 6.696 1.00 0.00 C ATOM 478 C GLU A 33 -2.608 0.383 5.577 1.00 0.00 C ATOM 479 O GLU A 33 -2.672 1.409 4.898 1.00 0.00 O ATOM 480 CB GLU A 33 -2.882 0.017 8.037 1.00 0.00 C ATOM 481 CG GLU A 33 -3.695 0.530 9.214 1.00 0.00 C ATOM 482 CD GLU A 33 -5.073 -0.099 9.290 1.00 0.00 C ATOM 483 OE1 GLU A 33 -5.908 0.196 8.409 1.00 0.00 O ATOM 484 OE2 GLU A 33 -5.316 -0.885 10.229 1.00 0.00 O ATOM 0 H GLU A 33 -4.402 -1.749 7.217 1.00 0.00 H new ATOM 0 HA GLU A 33 -4.310 0.959 6.736 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -2.617 -1.025 8.216 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -1.949 0.578 7.979 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -3.156 0.327 10.139 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -3.798 1.612 9.136 1.00 0.00 H new ATOM 491 N ILE A 34 -1.683 -0.552 5.392 1.00 0.00 N ATOM 492 CA ILE A 34 -0.666 -0.424 4.355 1.00 0.00 C ATOM 493 C ILE A 34 -1.222 0.282 3.123 1.00 0.00 C ATOM 494 O ILE A 34 -0.528 1.070 2.479 1.00 0.00 O ATOM 495 CB ILE A 34 -0.111 -1.799 3.938 1.00 0.00 C ATOM 496 CG1 ILE A 34 0.389 -2.565 5.165 1.00 0.00 C ATOM 497 CG2 ILE A 34 1.006 -1.632 2.919 1.00 0.00 C ATOM 498 CD1 ILE A 34 1.052 -3.882 4.826 1.00 0.00 C ATOM 0 H ILE A 34 -1.616 -1.406 5.946 1.00 0.00 H new ATOM 0 HA ILE A 34 0.142 0.172 4.778 1.00 0.00 H new ATOM 0 HB ILE A 34 -0.914 -2.374 3.477 1.00 0.00 H new ATOM 0 HG12 ILE A 34 1.097 -1.940 5.710 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -0.451 -2.752 5.834 1.00 0.00 H new ATOM 0 HG21 ILE A 34 1.388 -2.612 2.634 1.00 0.00 H new ATOM 0 HG22 ILE A 34 0.620 -1.122 2.036 1.00 0.00 H new ATOM 0 HG23 ILE A 34 1.812 -1.042 3.356 1.00 0.00 H new ATOM 0 HD11 ILE A 34 1.382 -4.370 5.743 1.00 0.00 H new ATOM 0 HD12 ILE A 34 0.340 -4.525 4.308 1.00 0.00 H new ATOM 0 HD13 ILE A 34 1.913 -3.701 4.182 1.00 0.00 H new ATOM 510 N LYS A 35 -2.479 -0.004 2.801 1.00 0.00 N ATOM 511 CA LYS A 35 -3.131 0.606 1.649 1.00 0.00 C ATOM 512 C LYS A 35 -3.321 2.105 1.860 1.00 0.00 C ATOM 513 O LYS A 35 -2.710 2.919 1.169 1.00 0.00 O ATOM 514 CB LYS A 35 -4.485 -0.059 1.393 1.00 0.00 C ATOM 515 CG LYS A 35 -4.407 -1.571 1.267 1.00 0.00 C ATOM 516 CD LYS A 35 -5.696 -2.152 0.712 1.00 0.00 C ATOM 517 CE LYS A 35 -5.663 -2.232 -0.807 1.00 0.00 C ATOM 518 NZ LYS A 35 -7.023 -2.104 -1.399 1.00 0.00 N ATOM 0 H LYS A 35 -3.067 -0.655 3.322 1.00 0.00 H new ATOM 0 HA LYS A 35 -2.490 0.458 0.780 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -5.164 0.195 2.207 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -4.915 0.351 0.479 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -3.576 -1.840 0.616 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -4.201 -2.008 2.244 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -5.856 -3.147 1.126 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -6.539 -1.537 1.027 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -5.021 -1.443 -1.198 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -5.222 -3.182 -1.111 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -6.949 -1.696 -2.353 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -7.466 -3.043 -1.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -7.605 -1.483 -0.801 1.00 0.00 H new ATOM 532 N GLN A 36 -4.169 2.460 2.819 1.00 0.00 N ATOM 533 CA GLN A 36 -4.437 3.861 3.121 1.00 0.00 C ATOM 534 C GLN A 36 -3.139 4.623 3.364 1.00 0.00 C ATOM 535 O GLN A 36 -2.963 5.740 2.876 1.00 0.00 O ATOM 536 CB GLN A 36 -5.347 3.976 4.345 1.00 0.00 C ATOM 537 CG GLN A 36 -6.186 5.243 4.362 1.00 0.00 C ATOM 538 CD GLN A 36 -7.441 5.124 3.520 1.00 0.00 C ATOM 539 OE1 GLN A 36 -7.694 5.950 2.642 1.00 0.00 O ATOM 540 NE2 GLN A 36 -8.235 4.092 3.782 1.00 0.00 N ATOM 0 H GLN A 36 -4.682 1.797 3.400 1.00 0.00 H new ATOM 0 HA GLN A 36 -4.940 4.302 2.261 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -6.009 3.111 4.377 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -4.735 3.943 5.247 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -6.464 5.476 5.390 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -5.586 6.076 3.997 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -7.987 3.432 4.519 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -9.093 3.960 3.247 1.00 0.00 H new ATOM 549 N ILE A 37 -2.234 4.014 4.122 1.00 0.00 N ATOM 550 CA ILE A 37 -0.952 4.635 4.429 1.00 0.00 C ATOM 551 C ILE A 37 -0.277 5.157 3.165 1.00 0.00 C ATOM 552 O ILE A 37 0.221 6.284 3.133 1.00 0.00 O ATOM 553 CB ILE A 37 -0.002 3.649 5.134 1.00 0.00 C ATOM 554 CG1 ILE A 37 -0.499 3.354 6.551 1.00 0.00 C ATOM 555 CG2 ILE A 37 1.412 4.208 5.169 1.00 0.00 C ATOM 556 CD1 ILE A 37 0.347 2.340 7.289 1.00 0.00 C ATOM 0 H ILE A 37 -2.365 3.091 4.535 1.00 0.00 H new ATOM 0 HA ILE A 37 -1.159 5.469 5.099 1.00 0.00 H new ATOM 0 HB ILE A 37 0.012 2.715 4.571 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -0.519 4.283 7.121 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -1.525 2.990 6.499 1.00 0.00 H new ATOM 0 HG21 ILE A 37 2.071 3.499 5.670 1.00 0.00 H new ATOM 0 HG22 ILE A 37 1.764 4.372 4.150 1.00 0.00 H new ATOM 0 HG23 ILE A 37 1.416 5.154 5.711 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -0.064 2.180 8.286 1.00 0.00 H new ATOM 0 HD12 ILE A 37 0.347 1.398 6.741 1.00 0.00 H new ATOM 0 HD13 ILE A 37 1.369 2.711 7.373 1.00 0.00 H new ATOM 568 N LEU A 38 -0.264 4.332 2.124 1.00 0.00 N ATOM 569 CA LEU A 38 0.348 4.710 0.855 1.00 0.00 C ATOM 570 C LEU A 38 -0.297 5.974 0.295 1.00 0.00 C ATOM 571 O LEU A 38 0.317 6.702 -0.485 1.00 0.00 O ATOM 572 CB LEU A 38 0.221 3.569 -0.155 1.00 0.00 C ATOM 573 CG LEU A 38 1.195 2.404 0.022 1.00 0.00 C ATOM 574 CD1 LEU A 38 0.762 1.212 -0.818 1.00 0.00 C ATOM 575 CD2 LEU A 38 2.609 2.831 -0.345 1.00 0.00 C ATOM 0 H LEU A 38 -0.670 3.397 2.134 1.00 0.00 H new ATOM 0 HA LEU A 38 1.404 4.912 1.035 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -0.795 3.178 -0.105 1.00 0.00 H new ATOM 0 HB3 LEU A 38 0.355 3.980 -1.156 1.00 0.00 H new ATOM 0 HG LEU A 38 1.187 2.105 1.070 1.00 0.00 H new ATOM 0 HD11 LEU A 38 1.468 0.393 -0.679 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -0.232 0.891 -0.508 1.00 0.00 H new ATOM 0 HD13 LEU A 38 0.740 1.497 -1.870 1.00 0.00 H new ATOM 0 HD21 LEU A 38 3.289 1.989 -0.213 1.00 0.00 H new ATOM 0 HD22 LEU A 38 2.632 3.157 -1.385 1.00 0.00 H new ATOM 0 HD23 LEU A 38 2.920 3.653 0.300 1.00 0.00 H new ATOM 587 N GLU A 39 -1.537 6.230 0.700 1.00 0.00 N ATOM 588 CA GLU A 39 -2.263 7.407 0.239 1.00 0.00 C ATOM 589 C GLU A 39 -1.797 8.658 0.979 1.00 0.00 C ATOM 590 O GLU A 39 -2.109 9.779 0.581 1.00 0.00 O ATOM 591 CB GLU A 39 -3.768 7.215 0.438 1.00 0.00 C ATOM 592 CG GLU A 39 -4.605 8.356 -0.115 1.00 0.00 C ATOM 593 CD GLU A 39 -6.091 8.152 0.109 1.00 0.00 C ATOM 594 OE1 GLU A 39 -6.460 7.565 1.147 1.00 0.00 O ATOM 595 OE2 GLU A 39 -6.885 8.580 -0.755 1.00 0.00 O ATOM 0 H GLU A 39 -2.059 5.638 1.346 1.00 0.00 H new ATOM 0 HA GLU A 39 -2.057 7.536 -0.824 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -4.074 6.285 -0.042 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -3.974 7.107 1.503 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -4.295 9.290 0.355 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -4.413 8.458 -1.183 1.00 0.00 H new ATOM 602 N ASN A 40 -1.049 8.456 2.059 1.00 0.00 N ATOM 603 CA ASN A 40 -0.541 9.566 2.855 1.00 0.00 C ATOM 604 C ASN A 40 0.881 9.929 2.438 1.00 0.00 C ATOM 605 O ASN A 40 1.431 10.936 2.883 1.00 0.00 O ATOM 606 CB ASN A 40 -0.572 9.211 4.343 1.00 0.00 C ATOM 607 CG ASN A 40 -1.985 9.142 4.891 1.00 0.00 C ATOM 608 OD1 ASN A 40 -2.784 10.058 4.696 1.00 0.00 O ATOM 609 ND2 ASN A 40 -2.299 8.052 5.582 1.00 0.00 N ATOM 0 H ASN A 40 -0.782 7.534 2.403 1.00 0.00 H new ATOM 0 HA ASN A 40 -1.184 10.429 2.680 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -0.079 8.251 4.495 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -0.004 9.954 4.903 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -3.234 7.950 5.976 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -1.605 7.317 5.719 1.00 0.00 H new ATOM 616 N GLU A 41 1.470 9.102 1.580 1.00 0.00 N ATOM 617 CA GLU A 41 2.827 9.336 1.103 1.00 0.00 C ATOM 618 C GLU A 41 2.846 9.535 -0.410 1.00 0.00 C ATOM 619 O GLU A 41 3.616 10.343 -0.932 1.00 0.00 O ATOM 620 CB GLU A 41 3.735 8.164 1.485 1.00 0.00 C ATOM 621 CG GLU A 41 3.887 7.976 2.985 1.00 0.00 C ATOM 622 CD GLU A 41 4.924 8.903 3.588 1.00 0.00 C ATOM 623 OE1 GLU A 41 4.896 10.111 3.271 1.00 0.00 O ATOM 624 OE2 GLU A 41 5.763 8.421 4.377 1.00 0.00 O ATOM 0 H GLU A 41 1.028 8.264 1.201 1.00 0.00 H new ATOM 0 HA GLU A 41 3.199 10.245 1.576 1.00 0.00 H new ATOM 0 HB2 GLU A 41 3.334 7.248 1.051 1.00 0.00 H new ATOM 0 HB3 GLU A 41 4.720 8.320 1.045 1.00 0.00 H new ATOM 0 HG2 GLU A 41 2.925 8.150 3.468 1.00 0.00 H new ATOM 0 HG3 GLU A 41 4.165 6.943 3.191 1.00 0.00 H new ATOM 631 N LEU A 42 1.993 8.794 -1.109 1.00 0.00 N ATOM 632 CA LEU A 42 1.911 8.888 -2.562 1.00 0.00 C ATOM 633 C LEU A 42 0.665 9.658 -2.988 1.00 0.00 C ATOM 634 O LEU A 42 0.497 9.984 -4.163 1.00 0.00 O ATOM 635 CB LEU A 42 1.898 7.490 -3.184 1.00 0.00 C ATOM 636 CG LEU A 42 3.067 6.578 -2.809 1.00 0.00 C ATOM 637 CD1 LEU A 42 2.730 5.127 -3.114 1.00 0.00 C ATOM 638 CD2 LEU A 42 4.330 7.001 -3.544 1.00 0.00 C ATOM 0 H LEU A 42 1.349 8.122 -0.693 1.00 0.00 H new ATOM 0 HA LEU A 42 2.789 9.428 -2.916 1.00 0.00 H new ATOM 0 HB2 LEU A 42 0.970 6.995 -2.897 1.00 0.00 H new ATOM 0 HB3 LEU A 42 1.880 7.597 -4.269 1.00 0.00 H new ATOM 0 HG LEU A 42 3.247 6.670 -1.738 1.00 0.00 H new ATOM 0 HD11 LEU A 42 3.573 4.492 -2.841 1.00 0.00 H new ATOM 0 HD12 LEU A 42 1.851 4.829 -2.541 1.00 0.00 H new ATOM 0 HD13 LEU A 42 2.523 5.017 -4.179 1.00 0.00 H new ATOM 0 HD21 LEU A 42 5.152 6.341 -3.265 1.00 0.00 H new ATOM 0 HD22 LEU A 42 4.163 6.938 -4.619 1.00 0.00 H new ATOM 0 HD23 LEU A 42 4.581 8.027 -3.275 1.00 0.00 H new ATOM 650 N GLN A 43 -0.204 9.947 -2.025 1.00 0.00 N ATOM 651 CA GLN A 43 -1.434 10.680 -2.301 1.00 0.00 C ATOM 652 C GLN A 43 -2.305 9.925 -3.299 1.00 0.00 C ATOM 653 O GLN A 43 -3.044 10.532 -4.076 1.00 0.00 O ATOM 654 CB GLN A 43 -1.111 12.075 -2.840 1.00 0.00 C ATOM 655 CG GLN A 43 -0.584 13.030 -1.781 1.00 0.00 C ATOM 656 CD GLN A 43 0.926 12.983 -1.652 1.00 0.00 C ATOM 657 OE1 GLN A 43 1.636 13.788 -2.255 1.00 0.00 O ATOM 658 NE2 GLN A 43 1.424 12.038 -0.863 1.00 0.00 N ATOM 0 H GLN A 43 -0.079 9.685 -1.047 1.00 0.00 H new ATOM 0 HA GLN A 43 -1.986 10.778 -1.367 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -0.372 11.985 -3.636 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -2.010 12.500 -3.286 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -0.892 14.046 -2.028 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -1.035 12.785 -0.819 1.00 0.00 H new ATOM 0 HE21 GLN A 43 0.797 11.392 -0.383 1.00 0.00 H new ATOM 0 HE22 GLN A 43 2.433 11.958 -0.737 1.00 0.00 H new ATOM 667 N ILE A 44 -2.214 8.600 -3.273 1.00 0.00 N ATOM 668 CA ILE A 44 -2.994 7.763 -4.176 1.00 0.00 C ATOM 669 C ILE A 44 -4.163 7.109 -3.447 1.00 0.00 C ATOM 670 O ILE A 44 -4.028 6.607 -2.331 1.00 0.00 O ATOM 671 CB ILE A 44 -2.126 6.665 -4.818 1.00 0.00 C ATOM 672 CG1 ILE A 44 -0.873 7.279 -5.448 1.00 0.00 C ATOM 673 CG2 ILE A 44 -2.927 5.898 -5.860 1.00 0.00 C ATOM 674 CD1 ILE A 44 0.091 6.251 -5.998 1.00 0.00 C ATOM 0 H ILE A 44 -1.608 8.083 -2.636 1.00 0.00 H new ATOM 0 HA ILE A 44 -3.377 8.417 -4.960 1.00 0.00 H new ATOM 0 HB ILE A 44 -1.815 5.967 -4.041 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -1.172 7.952 -6.252 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -0.359 7.884 -4.701 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -2.300 5.125 -6.305 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -3.792 5.435 -5.385 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -3.264 6.584 -6.637 1.00 0.00 H new ATOM 0 HD11 ILE A 44 0.955 6.757 -6.429 1.00 0.00 H new ATOM 0 HD12 ILE A 44 0.419 5.593 -5.193 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -0.406 5.662 -6.769 1.00 0.00 H new ATOM 686 N PRO A 45 -5.339 7.113 -4.091 1.00 0.00 N ATOM 687 CA PRO A 45 -6.555 6.522 -3.523 1.00 0.00 C ATOM 688 C PRO A 45 -6.484 5.000 -3.459 1.00 0.00 C ATOM 689 O PRO A 45 -6.329 4.332 -4.481 1.00 0.00 O ATOM 690 CB PRO A 45 -7.652 6.965 -4.495 1.00 0.00 C ATOM 691 CG PRO A 45 -6.945 7.194 -5.786 1.00 0.00 C ATOM 692 CD PRO A 45 -5.573 7.694 -5.424 1.00 0.00 C ATOM 0 HA PRO A 45 -6.722 6.843 -2.495 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -8.423 6.201 -4.596 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -8.146 7.873 -4.148 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -6.884 6.273 -6.366 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -7.477 7.922 -6.398 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -4.823 7.365 -6.143 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -5.536 8.783 -5.400 1.00 0.00 H new ATOM 700 N VAL A 46 -6.598 4.458 -2.251 1.00 0.00 N ATOM 701 CA VAL A 46 -6.549 3.014 -2.053 1.00 0.00 C ATOM 702 C VAL A 46 -7.449 2.292 -3.048 1.00 0.00 C ATOM 703 O VAL A 46 -7.267 1.105 -3.318 1.00 0.00 O ATOM 704 CB VAL A 46 -6.970 2.628 -0.622 1.00 0.00 C ATOM 705 CG1 VAL A 46 -6.996 1.116 -0.462 1.00 0.00 C ATOM 706 CG2 VAL A 46 -6.037 3.265 0.397 1.00 0.00 C ATOM 0 H VAL A 46 -6.725 4.997 -1.394 1.00 0.00 H new ATOM 0 HA VAL A 46 -5.515 2.708 -2.214 1.00 0.00 H new ATOM 0 HB VAL A 46 -7.977 3.005 -0.444 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -7.295 0.863 0.555 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -7.708 0.688 -1.167 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -6.003 0.712 -0.659 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -6.349 2.982 1.402 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -5.018 2.920 0.223 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -6.075 4.350 0.297 1.00 0.00 H new ATOM 716 N SER A 47 -8.422 3.016 -3.592 1.00 0.00 N ATOM 717 CA SER A 47 -9.355 2.444 -4.556 1.00 0.00 C ATOM 718 C SER A 47 -8.628 2.022 -5.830 1.00 0.00 C ATOM 719 O SER A 47 -8.851 0.930 -6.353 1.00 0.00 O ATOM 720 CB SER A 47 -10.455 3.451 -4.893 1.00 0.00 C ATOM 721 OG SER A 47 -11.547 3.332 -3.998 1.00 0.00 O ATOM 0 H SER A 47 -8.585 4.001 -3.381 1.00 0.00 H new ATOM 0 HA SER A 47 -9.808 1.560 -4.106 1.00 0.00 H new ATOM 0 HB2 SER A 47 -10.052 4.463 -4.848 1.00 0.00 H new ATOM 0 HB3 SER A 47 -10.799 3.290 -5.915 1.00 0.00 H new ATOM 0 HG SER A 47 -12.236 3.988 -4.234 1.00 0.00 H new ATOM 727 N LYS A 48 -7.758 2.896 -6.324 1.00 0.00 N ATOM 728 CA LYS A 48 -6.997 2.617 -7.536 1.00 0.00 C ATOM 729 C LYS A 48 -5.840 1.666 -7.244 1.00 0.00 C ATOM 730 O LYS A 48 -5.383 0.941 -8.126 1.00 0.00 O ATOM 731 CB LYS A 48 -6.463 3.918 -8.139 1.00 0.00 C ATOM 732 CG LYS A 48 -7.539 4.962 -8.382 1.00 0.00 C ATOM 733 CD LYS A 48 -8.154 4.817 -9.764 1.00 0.00 C ATOM 734 CE LYS A 48 -9.516 5.490 -9.841 1.00 0.00 C ATOM 735 NZ LYS A 48 -10.168 5.271 -11.162 1.00 0.00 N ATOM 0 H LYS A 48 -7.562 3.804 -5.903 1.00 0.00 H new ATOM 0 HA LYS A 48 -7.665 2.140 -8.253 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -5.708 4.335 -7.472 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -5.966 3.694 -9.083 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -8.317 4.867 -7.625 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -7.111 5.959 -8.276 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -7.488 5.255 -10.508 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -8.255 3.760 -10.010 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -10.158 5.102 -9.050 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -9.403 6.560 -9.664 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -11.094 5.745 -11.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -9.567 5.663 -11.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -10.299 4.251 -11.320 1.00 0.00 H new ATOM 749 N MET A 49 -5.371 1.676 -6.000 1.00 0.00 N ATOM 750 CA MET A 49 -4.269 0.813 -5.592 1.00 0.00 C ATOM 751 C MET A 49 -4.777 -0.575 -5.215 1.00 0.00 C ATOM 752 O MET A 49 -5.859 -0.718 -4.645 1.00 0.00 O ATOM 753 CB MET A 49 -3.518 1.432 -4.412 1.00 0.00 C ATOM 754 CG MET A 49 -2.989 2.829 -4.694 1.00 0.00 C ATOM 755 SD MET A 49 -1.486 3.202 -3.770 1.00 0.00 S ATOM 756 CE MET A 49 -2.173 3.958 -2.298 1.00 0.00 C ATOM 0 H MET A 49 -5.737 2.272 -5.258 1.00 0.00 H new ATOM 0 HA MET A 49 -3.586 0.714 -6.436 1.00 0.00 H new ATOM 0 HB2 MET A 49 -4.183 1.471 -3.549 1.00 0.00 H new ATOM 0 HB3 MET A 49 -2.684 0.784 -4.142 1.00 0.00 H new ATOM 0 HG2 MET A 49 -2.789 2.929 -5.761 1.00 0.00 H new ATOM 0 HG3 MET A 49 -3.756 3.561 -4.443 1.00 0.00 H new ATOM 0 HE1 MET A 49 -1.517 4.761 -1.962 1.00 0.00 H new ATOM 0 HE2 MET A 49 -3.159 4.365 -2.524 1.00 0.00 H new ATOM 0 HE3 MET A 49 -2.261 3.209 -1.512 1.00 0.00 H new ATOM 766 N LEU A 50 -3.989 -1.596 -5.536 1.00 0.00 N ATOM 767 CA LEU A 50 -4.359 -2.974 -5.231 1.00 0.00 C ATOM 768 C LEU A 50 -3.215 -3.703 -4.534 1.00 0.00 C ATOM 769 O LEU A 50 -2.270 -4.158 -5.180 1.00 0.00 O ATOM 770 CB LEU A 50 -4.746 -3.714 -6.512 1.00 0.00 C ATOM 771 CG LEU A 50 -5.804 -3.038 -7.385 1.00 0.00 C ATOM 772 CD1 LEU A 50 -5.986 -3.799 -8.689 1.00 0.00 C ATOM 773 CD2 LEU A 50 -7.125 -2.934 -6.637 1.00 0.00 C ATOM 0 H LEU A 50 -3.090 -1.495 -6.007 1.00 0.00 H new ATOM 0 HA LEU A 50 -5.216 -2.954 -4.558 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -3.847 -3.857 -7.111 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -5.108 -4.705 -6.240 1.00 0.00 H new ATOM 0 HG LEU A 50 -5.463 -2.030 -7.621 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -6.743 -3.303 -9.297 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -5.041 -3.821 -9.232 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -6.305 -4.819 -8.474 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -7.866 -2.450 -7.273 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -7.472 -3.932 -6.370 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -6.985 -2.345 -5.731 1.00 0.00 H new ATOM 785 N LEU A 51 -3.307 -3.813 -3.214 1.00 0.00 N ATOM 786 CA LEU A 51 -2.281 -4.489 -2.428 1.00 0.00 C ATOM 787 C LEU A 51 -2.048 -5.906 -2.943 1.00 0.00 C ATOM 788 O LEU A 51 -2.911 -6.775 -2.815 1.00 0.00 O ATOM 789 CB LEU A 51 -2.684 -4.530 -0.953 1.00 0.00 C ATOM 790 CG LEU A 51 -1.536 -4.523 0.057 1.00 0.00 C ATOM 791 CD1 LEU A 51 -0.516 -5.598 -0.287 1.00 0.00 C ATOM 792 CD2 LEU A 51 -0.874 -3.153 0.102 1.00 0.00 C ATOM 0 H LEU A 51 -4.082 -3.442 -2.665 1.00 0.00 H new ATOM 0 HA LEU A 51 -1.352 -3.928 -2.528 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -3.326 -3.673 -0.749 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -3.283 -5.425 -0.786 1.00 0.00 H new ATOM 0 HG LEU A 51 -1.944 -4.740 1.044 1.00 0.00 H new ATOM 0 HD11 LEU A 51 0.294 -5.578 0.442 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -0.997 -6.576 -0.268 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -0.112 -5.411 -1.282 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -0.059 -3.166 0.826 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -0.479 -2.907 -0.884 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -1.609 -2.403 0.396 1.00 0.00 H new ATOM 804 N LYS A 52 -0.875 -6.134 -3.524 1.00 0.00 N ATOM 805 CA LYS A 52 -0.525 -7.446 -4.055 1.00 0.00 C ATOM 806 C LYS A 52 0.800 -7.932 -3.475 1.00 0.00 C ATOM 807 O LYS A 52 1.426 -7.244 -2.669 1.00 0.00 O ATOM 808 CB LYS A 52 -0.437 -7.394 -5.582 1.00 0.00 C ATOM 809 CG LYS A 52 -1.761 -7.079 -6.256 1.00 0.00 C ATOM 810 CD LYS A 52 -2.532 -8.345 -6.589 1.00 0.00 C ATOM 811 CE LYS A 52 -3.587 -8.091 -7.655 1.00 0.00 C ATOM 812 NZ LYS A 52 -3.032 -8.231 -9.030 1.00 0.00 N ATOM 0 H LYS A 52 -0.150 -5.426 -3.639 1.00 0.00 H new ATOM 0 HA LYS A 52 -1.307 -8.148 -3.766 1.00 0.00 H new ATOM 0 HB2 LYS A 52 0.296 -6.641 -5.870 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -0.071 -8.353 -5.950 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -2.362 -6.447 -5.602 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -1.580 -6.512 -7.169 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -1.840 -9.113 -6.936 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -3.009 -8.729 -5.688 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -4.412 -8.791 -7.523 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -3.996 -7.089 -7.529 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -3.548 -7.603 -9.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -2.025 -7.972 -9.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -3.135 -9.216 -9.347 1.00 0.00 H new ATOM 826 N GLY A 53 1.222 -9.121 -3.892 1.00 0.00 N ATOM 827 CA GLY A 53 2.471 -9.678 -3.405 1.00 0.00 C ATOM 828 C GLY A 53 2.290 -10.485 -2.135 1.00 0.00 C ATOM 829 O GLY A 53 3.207 -11.179 -1.697 1.00 0.00 O ATOM 0 H GLY A 53 0.722 -9.709 -4.558 1.00 0.00 H new ATOM 0 HA2 GLY A 53 2.907 -10.313 -4.176 1.00 0.00 H new ATOM 0 HA3 GLY A 53 3.178 -8.869 -3.220 1.00 0.00 H new ATOM 833 N TRP A 54 1.105 -10.393 -1.541 1.00 0.00 N ATOM 834 CA TRP A 54 0.807 -11.120 -0.312 1.00 0.00 C ATOM 835 C TRP A 54 1.308 -12.557 -0.395 1.00 0.00 C ATOM 836 O TRP A 54 0.958 -13.295 -1.317 1.00 0.00 O ATOM 837 CB TRP A 54 -0.698 -11.105 -0.039 1.00 0.00 C ATOM 838 CG TRP A 54 -1.183 -9.813 0.545 1.00 0.00 C ATOM 839 CD1 TRP A 54 -2.116 -8.971 0.011 1.00 0.00 C ATOM 840 CD2 TRP A 54 -0.758 -9.215 1.775 1.00 0.00 C ATOM 841 NE1 TRP A 54 -2.297 -7.886 0.834 1.00 0.00 N ATOM 842 CE2 TRP A 54 -1.476 -8.013 1.923 1.00 0.00 C ATOM 843 CE3 TRP A 54 0.158 -9.580 2.765 1.00 0.00 C ATOM 844 CZ2 TRP A 54 -1.304 -7.174 3.021 1.00 0.00 C ATOM 845 CZ3 TRP A 54 0.327 -8.747 3.855 1.00 0.00 C ATOM 846 CH2 TRP A 54 -0.401 -7.556 3.976 1.00 0.00 C ATOM 0 H TRP A 54 0.335 -9.822 -1.891 1.00 0.00 H new ATOM 0 HA TRP A 54 1.323 -10.623 0.510 1.00 0.00 H new ATOM 0 HB2 TRP A 54 -1.231 -11.297 -0.970 1.00 0.00 H new ATOM 0 HB3 TRP A 54 -0.944 -11.919 0.643 1.00 0.00 H new ATOM 0 HD1 TRP A 54 -2.636 -9.134 -0.922 1.00 0.00 H new ATOM 0 HE1 TRP A 54 -2.938 -7.112 0.662 1.00 0.00 H new ATOM 0 HE3 TRP A 54 0.724 -10.496 2.680 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 -1.863 -6.255 3.116 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 1.032 -9.019 4.627 1.00 0.00 H new ATOM 0 HH2 TRP A 54 -0.247 -6.927 4.840 1.00 0.00 H new ATOM 857 N LYS A 55 2.128 -12.950 0.573 1.00 0.00 N ATOM 858 CA LYS A 55 2.677 -14.301 0.610 1.00 0.00 C ATOM 859 C LYS A 55 1.627 -15.326 0.191 1.00 0.00 C ATOM 860 O LYS A 55 1.922 -16.265 -0.548 1.00 0.00 O ATOM 861 CB LYS A 55 3.190 -14.626 2.015 1.00 0.00 C ATOM 862 CG LYS A 55 4.288 -15.675 2.034 1.00 0.00 C ATOM 863 CD LYS A 55 3.722 -17.077 1.881 1.00 0.00 C ATOM 864 CE LYS A 55 4.790 -18.137 2.106 1.00 0.00 C ATOM 865 NZ LYS A 55 5.233 -18.184 3.527 1.00 0.00 N ATOM 0 H LYS A 55 2.428 -12.352 1.343 1.00 0.00 H new ATOM 0 HA LYS A 55 3.508 -14.349 -0.094 1.00 0.00 H new ATOM 0 HB2 LYS A 55 3.564 -13.712 2.476 1.00 0.00 H new ATOM 0 HB3 LYS A 55 2.357 -14.973 2.626 1.00 0.00 H new ATOM 0 HG2 LYS A 55 4.995 -15.477 1.229 1.00 0.00 H new ATOM 0 HG3 LYS A 55 4.843 -15.606 2.970 1.00 0.00 H new ATOM 0 HD2 LYS A 55 2.909 -17.222 2.592 1.00 0.00 H new ATOM 0 HD3 LYS A 55 3.298 -17.192 0.884 1.00 0.00 H new ATOM 0 HE2 LYS A 55 4.401 -19.112 1.814 1.00 0.00 H new ATOM 0 HE3 LYS A 55 5.647 -17.931 1.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 5.759 -19.065 3.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 5.848 -17.369 3.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 4.402 -18.151 4.151 1.00 0.00 H new ATOM 879 N THR A 56 0.400 -15.138 0.667 1.00 0.00 N ATOM 880 CA THR A 56 -0.693 -16.046 0.342 1.00 0.00 C ATOM 881 C THR A 56 -1.747 -15.352 -0.513 1.00 0.00 C ATOM 882 O THR A 56 -2.481 -14.490 -0.032 1.00 0.00 O ATOM 883 CB THR A 56 -1.362 -16.599 1.614 1.00 0.00 C ATOM 884 OG1 THR A 56 -2.433 -17.481 1.261 1.00 0.00 O ATOM 885 CG2 THR A 56 -1.894 -15.468 2.481 1.00 0.00 C ATOM 0 H THR A 56 0.138 -14.365 1.279 1.00 0.00 H new ATOM 0 HA THR A 56 -0.260 -16.874 -0.220 1.00 0.00 H new ATOM 0 HB THR A 56 -0.612 -17.149 2.182 1.00 0.00 H new ATOM 0 HG1 THR A 56 -2.852 -17.829 2.076 1.00 0.00 H new ATOM 0 HG21 THR A 56 -2.362 -15.883 3.374 1.00 0.00 H new ATOM 0 HG22 THR A 56 -1.071 -14.815 2.773 1.00 0.00 H new ATOM 0 HG23 THR A 56 -2.630 -14.894 1.919 1.00 0.00 H new ATOM 893 N GLY A 57 -1.819 -15.736 -1.784 1.00 0.00 N ATOM 894 CA GLY A 57 -2.788 -15.140 -2.685 1.00 0.00 C ATOM 895 C GLY A 57 -3.041 -13.677 -2.380 1.00 0.00 C ATOM 896 O GLY A 57 -2.103 -12.910 -2.163 1.00 0.00 O ATOM 0 H GLY A 57 -1.224 -16.449 -2.206 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -2.433 -15.238 -3.711 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -3.727 -15.689 -2.618 1.00 0.00 H new ATOM 900 N ASP A 58 -4.311 -13.289 -2.364 1.00 0.00 N ATOM 901 CA ASP A 58 -4.685 -11.907 -2.084 1.00 0.00 C ATOM 902 C ASP A 58 -5.274 -11.777 -0.683 1.00 0.00 C ATOM 903 O ASP A 58 -6.400 -12.206 -0.430 1.00 0.00 O ATOM 904 CB ASP A 58 -5.691 -11.408 -3.123 1.00 0.00 C ATOM 905 CG ASP A 58 -6.954 -12.245 -3.154 1.00 0.00 C ATOM 906 OD1 ASP A 58 -6.877 -13.447 -2.824 1.00 0.00 O ATOM 907 OD2 ASP A 58 -8.020 -11.699 -3.510 1.00 0.00 O ATOM 0 H ASP A 58 -5.099 -13.912 -2.542 1.00 0.00 H new ATOM 0 HA ASP A 58 -3.785 -11.294 -2.138 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -5.950 -10.372 -2.905 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -5.227 -11.420 -4.109 1.00 0.00 H new ATOM 912 N VAL A 59 -4.505 -11.183 0.224 1.00 0.00 N ATOM 913 CA VAL A 59 -4.951 -10.996 1.600 1.00 0.00 C ATOM 914 C VAL A 59 -6.065 -9.959 1.680 1.00 0.00 C ATOM 915 O VAL A 59 -6.039 -8.950 0.977 1.00 0.00 O ATOM 916 CB VAL A 59 -3.790 -10.558 2.511 1.00 0.00 C ATOM 917 CG1 VAL A 59 -4.313 -10.124 3.872 1.00 0.00 C ATOM 918 CG2 VAL A 59 -2.772 -11.679 2.654 1.00 0.00 C ATOM 0 H VAL A 59 -3.570 -10.823 0.031 1.00 0.00 H new ATOM 0 HA VAL A 59 -5.330 -11.959 1.944 1.00 0.00 H new ATOM 0 HB VAL A 59 -3.293 -9.704 2.051 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -3.478 -9.818 4.502 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -5.000 -9.287 3.748 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -4.837 -10.956 4.343 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -1.959 -11.351 3.301 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -3.253 -12.554 3.091 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -2.374 -11.936 1.673 1.00 0.00 H new ATOM 928 N GLU A 60 -7.044 -10.216 2.543 1.00 0.00 N ATOM 929 CA GLU A 60 -8.168 -9.304 2.715 1.00 0.00 C ATOM 930 C GLU A 60 -7.850 -8.238 3.760 1.00 0.00 C ATOM 931 O GLU A 60 -7.162 -8.506 4.745 1.00 0.00 O ATOM 932 CB GLU A 60 -9.423 -10.077 3.126 1.00 0.00 C ATOM 933 CG GLU A 60 -9.292 -10.782 4.465 1.00 0.00 C ATOM 934 CD GLU A 60 -10.445 -11.727 4.743 1.00 0.00 C ATOM 935 OE1 GLU A 60 -11.472 -11.268 5.286 1.00 0.00 O ATOM 936 OE2 GLU A 60 -10.321 -12.926 4.416 1.00 0.00 O ATOM 0 H GLU A 60 -7.081 -11.047 3.133 1.00 0.00 H new ATOM 0 HA GLU A 60 -8.350 -8.810 1.761 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -10.266 -9.388 3.169 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -9.653 -10.815 2.357 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -8.356 -11.340 4.487 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -9.238 -10.038 5.259 1.00 0.00 H new ATOM 943 N ASP A 61 -8.354 -7.029 3.536 1.00 0.00 N ATOM 944 CA ASP A 61 -8.124 -5.923 4.457 1.00 0.00 C ATOM 945 C ASP A 61 -8.609 -6.274 5.860 1.00 0.00 C ATOM 946 O ASP A 61 -8.284 -5.589 6.830 1.00 0.00 O ATOM 947 CB ASP A 61 -8.832 -4.661 3.960 1.00 0.00 C ATOM 948 CG ASP A 61 -10.217 -4.952 3.416 1.00 0.00 C ATOM 949 OD1 ASP A 61 -11.000 -5.626 4.116 1.00 0.00 O ATOM 950 OD2 ASP A 61 -10.518 -4.504 2.289 1.00 0.00 O ATOM 0 H ASP A 61 -8.924 -6.791 2.725 1.00 0.00 H new ATOM 0 HA ASP A 61 -7.051 -5.735 4.499 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -8.909 -3.945 4.778 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -8.230 -4.192 3.182 1.00 0.00 H new ATOM 955 N SER A 62 -9.390 -7.344 5.960 1.00 0.00 N ATOM 956 CA SER A 62 -9.925 -7.784 7.243 1.00 0.00 C ATOM 957 C SER A 62 -8.939 -8.704 7.956 1.00 0.00 C ATOM 958 O SER A 62 -9.281 -9.355 8.945 1.00 0.00 O ATOM 959 CB SER A 62 -11.260 -8.504 7.044 1.00 0.00 C ATOM 960 OG SER A 62 -11.955 -8.639 8.272 1.00 0.00 O ATOM 0 H SER A 62 -9.667 -7.923 5.167 1.00 0.00 H new ATOM 0 HA SER A 62 -10.086 -6.902 7.863 1.00 0.00 H new ATOM 0 HB2 SER A 62 -11.874 -7.949 6.334 1.00 0.00 H new ATOM 0 HB3 SER A 62 -11.085 -9.489 6.612 1.00 0.00 H new ATOM 0 HG SER A 62 -11.336 -8.947 8.966 1.00 0.00 H new ATOM 966 N THR A 63 -7.712 -8.755 7.447 1.00 0.00 N ATOM 967 CA THR A 63 -6.676 -9.596 8.033 1.00 0.00 C ATOM 968 C THR A 63 -5.628 -8.755 8.754 1.00 0.00 C ATOM 969 O THR A 63 -5.312 -7.643 8.333 1.00 0.00 O ATOM 970 CB THR A 63 -5.978 -10.456 6.962 1.00 0.00 C ATOM 971 OG1 THR A 63 -6.946 -11.245 6.261 1.00 0.00 O ATOM 972 CG2 THR A 63 -4.935 -11.365 7.593 1.00 0.00 C ATOM 0 H THR A 63 -7.412 -8.224 6.630 1.00 0.00 H new ATOM 0 HA THR A 63 -7.169 -10.251 8.751 1.00 0.00 H new ATOM 0 HB THR A 63 -5.477 -9.789 6.261 1.00 0.00 H new ATOM 0 HG1 THR A 63 -6.495 -11.788 5.581 1.00 0.00 H new ATOM 0 HG21 THR A 63 -4.456 -11.962 6.817 1.00 0.00 H new ATOM 0 HG22 THR A 63 -4.184 -10.760 8.101 1.00 0.00 H new ATOM 0 HG23 THR A 63 -5.416 -12.026 8.314 1.00 0.00 H new ATOM 980 N VAL A 64 -5.092 -9.295 9.844 1.00 0.00 N ATOM 981 CA VAL A 64 -4.078 -8.595 10.624 1.00 0.00 C ATOM 982 C VAL A 64 -2.683 -9.130 10.319 1.00 0.00 C ATOM 983 O VAL A 64 -2.504 -10.325 10.077 1.00 0.00 O ATOM 984 CB VAL A 64 -4.345 -8.721 12.135 1.00 0.00 C ATOM 985 CG1 VAL A 64 -4.185 -10.165 12.587 1.00 0.00 C ATOM 986 CG2 VAL A 64 -3.419 -7.803 12.919 1.00 0.00 C ATOM 0 H VAL A 64 -5.343 -10.215 10.207 1.00 0.00 H new ATOM 0 HA VAL A 64 -4.131 -7.544 10.340 1.00 0.00 H new ATOM 0 HB VAL A 64 -5.373 -8.415 12.331 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -4.378 -10.235 13.658 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -4.893 -10.795 12.049 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -3.169 -10.501 12.378 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -3.622 -7.905 13.985 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -2.383 -8.075 12.719 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -3.588 -6.770 12.615 1.00 0.00 H new ATOM 996 N LEU A 65 -1.698 -8.240 10.332 1.00 0.00 N ATOM 997 CA LEU A 65 -0.317 -8.622 10.057 1.00 0.00 C ATOM 998 C LEU A 65 0.131 -9.747 10.985 1.00 0.00 C ATOM 999 O LEU A 65 0.649 -10.769 10.535 1.00 0.00 O ATOM 1000 CB LEU A 65 0.609 -7.415 10.216 1.00 0.00 C ATOM 1001 CG LEU A 65 0.194 -6.148 9.466 1.00 0.00 C ATOM 1002 CD1 LEU A 65 0.669 -4.909 10.209 1.00 0.00 C ATOM 1003 CD2 LEU A 65 0.743 -6.164 8.047 1.00 0.00 C ATOM 0 H LEU A 65 -1.829 -7.248 10.530 1.00 0.00 H new ATOM 0 HA LEU A 65 -0.263 -8.980 9.029 1.00 0.00 H new ATOM 0 HB2 LEU A 65 0.684 -7.177 11.277 1.00 0.00 H new ATOM 0 HB3 LEU A 65 1.606 -7.701 9.882 1.00 0.00 H new ATOM 0 HG LEU A 65 -0.894 -6.120 9.413 1.00 0.00 H new ATOM 0 HD11 LEU A 65 0.365 -4.017 9.661 1.00 0.00 H new ATOM 0 HD12 LEU A 65 0.228 -4.891 11.205 1.00 0.00 H new ATOM 0 HD13 LEU A 65 1.755 -4.930 10.294 1.00 0.00 H new ATOM 0 HD21 LEU A 65 0.438 -5.255 7.529 1.00 0.00 H new ATOM 0 HD22 LEU A 65 1.831 -6.216 8.078 1.00 0.00 H new ATOM 0 HD23 LEU A 65 0.354 -7.033 7.516 1.00 0.00 H new ATOM 1015 N LYS A 66 -0.073 -9.552 12.284 1.00 0.00 N ATOM 1016 CA LYS A 66 0.306 -10.550 13.277 1.00 0.00 C ATOM 1017 C LYS A 66 -0.193 -11.934 12.875 1.00 0.00 C ATOM 1018 O LYS A 66 0.306 -12.949 13.361 1.00 0.00 O ATOM 1019 CB LYS A 66 -0.255 -10.173 14.649 1.00 0.00 C ATOM 1020 CG LYS A 66 -1.646 -10.722 14.910 1.00 0.00 C ATOM 1021 CD LYS A 66 -2.099 -10.442 16.333 1.00 0.00 C ATOM 1022 CE LYS A 66 -2.418 -8.969 16.537 1.00 0.00 C ATOM 1023 NZ LYS A 66 -2.547 -8.624 17.979 1.00 0.00 N ATOM 0 H LYS A 66 -0.499 -8.711 12.673 1.00 0.00 H new ATOM 0 HA LYS A 66 1.394 -10.577 13.331 1.00 0.00 H new ATOM 0 HB2 LYS A 66 0.421 -10.539 15.422 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -0.280 -9.087 14.736 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -2.351 -10.276 14.209 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -1.653 -11.797 14.730 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -2.981 -11.041 16.560 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -1.319 -10.746 17.031 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -1.633 -8.362 16.087 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -3.346 -8.723 16.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -2.765 -7.612 18.076 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -3.313 -9.185 18.403 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -1.653 -8.834 18.468 1.00 0.00 H new ATOM 1037 N SER A 67 -1.179 -11.967 11.984 1.00 0.00 N ATOM 1038 CA SER A 67 -1.747 -13.227 11.519 1.00 0.00 C ATOM 1039 C SER A 67 -0.808 -13.915 10.533 1.00 0.00 C ATOM 1040 O SER A 67 -0.482 -15.093 10.686 1.00 0.00 O ATOM 1041 CB SER A 67 -3.107 -12.986 10.862 1.00 0.00 C ATOM 1042 OG SER A 67 -3.893 -14.166 10.868 1.00 0.00 O ATOM 0 H SER A 67 -1.601 -11.136 11.570 1.00 0.00 H new ATOM 0 HA SER A 67 -1.879 -13.878 12.383 1.00 0.00 H new ATOM 0 HB2 SER A 67 -3.634 -12.192 11.391 1.00 0.00 H new ATOM 0 HB3 SER A 67 -2.964 -12.646 9.836 1.00 0.00 H new ATOM 0 HG SER A 67 -4.758 -13.985 10.444 1.00 0.00 H new ATOM 1048 N LEU A 68 -0.376 -13.172 9.520 1.00 0.00 N ATOM 1049 CA LEU A 68 0.526 -13.708 8.507 1.00 0.00 C ATOM 1050 C LEU A 68 1.957 -13.769 9.030 1.00 0.00 C ATOM 1051 O LEU A 68 2.804 -14.468 8.472 1.00 0.00 O ATOM 1052 CB LEU A 68 0.470 -12.852 7.241 1.00 0.00 C ATOM 1053 CG LEU A 68 -0.912 -12.676 6.610 1.00 0.00 C ATOM 1054 CD1 LEU A 68 -0.999 -11.347 5.876 1.00 0.00 C ATOM 1055 CD2 LEU A 68 -1.217 -13.830 5.666 1.00 0.00 C ATOM 0 H LEU A 68 -0.636 -12.196 9.378 1.00 0.00 H new ATOM 0 HA LEU A 68 0.202 -14.721 8.268 1.00 0.00 H new ATOM 0 HB2 LEU A 68 0.868 -11.865 7.476 1.00 0.00 H new ATOM 0 HB3 LEU A 68 1.133 -13.295 6.498 1.00 0.00 H new ATOM 0 HG LEU A 68 -1.657 -12.677 7.406 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -1.989 -11.240 5.434 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -0.825 -10.532 6.578 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -0.245 -11.316 5.089 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -2.204 -13.689 5.226 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -0.468 -13.861 4.875 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -1.198 -14.768 6.220 1.00 0.00 H new ATOM 1067 N HIS A 69 2.220 -13.036 10.107 1.00 0.00 N ATOM 1068 CA HIS A 69 3.549 -13.009 10.708 1.00 0.00 C ATOM 1069 C HIS A 69 4.611 -12.679 9.663 1.00 0.00 C ATOM 1070 O HIS A 69 5.575 -13.425 9.485 1.00 0.00 O ATOM 1071 CB HIS A 69 3.863 -14.354 11.363 1.00 0.00 C ATOM 1072 CG HIS A 69 3.067 -14.615 12.605 1.00 0.00 C ATOM 1073 ND1 HIS A 69 3.151 -13.827 13.733 1.00 0.00 N ATOM 1074 CD2 HIS A 69 2.165 -15.584 12.890 1.00 0.00 C ATOM 1075 CE1 HIS A 69 2.338 -14.301 14.660 1.00 0.00 C ATOM 1076 NE2 HIS A 69 1.727 -15.366 14.173 1.00 0.00 N ATOM 0 H HIS A 69 1.531 -12.453 10.582 1.00 0.00 H new ATOM 0 HA HIS A 69 3.560 -12.230 11.471 1.00 0.00 H new ATOM 0 HB2 HIS A 69 3.673 -15.152 10.645 1.00 0.00 H new ATOM 0 HB3 HIS A 69 4.925 -14.391 11.607 1.00 0.00 H new ATOM 0 HD2 HIS A 69 1.849 -16.380 12.231 1.00 0.00 H new ATOM 0 HE1 HIS A 69 2.197 -13.888 15.648 1.00 0.00 H new ATOM 0 HE2 HIS A 69 1.041 -15.934 14.670 1.00 0.00 H new ATOM 1085 N LEU A 70 4.428 -11.558 8.974 1.00 0.00 N ATOM 1086 CA LEU A 70 5.370 -11.129 7.946 1.00 0.00 C ATOM 1087 C LEU A 70 6.781 -11.014 8.514 1.00 0.00 C ATOM 1088 O LEU A 70 6.982 -10.662 9.677 1.00 0.00 O ATOM 1089 CB LEU A 70 4.935 -9.787 7.356 1.00 0.00 C ATOM 1090 CG LEU A 70 3.815 -9.843 6.316 1.00 0.00 C ATOM 1091 CD1 LEU A 70 3.997 -11.042 5.399 1.00 0.00 C ATOM 1092 CD2 LEU A 70 2.456 -9.892 6.998 1.00 0.00 C ATOM 0 H LEU A 70 3.636 -10.930 9.109 1.00 0.00 H new ATOM 0 HA LEU A 70 5.376 -11.881 7.157 1.00 0.00 H new ATOM 0 HB2 LEU A 70 4.613 -9.141 8.173 1.00 0.00 H new ATOM 0 HB3 LEU A 70 5.805 -9.315 6.899 1.00 0.00 H new ATOM 0 HG LEU A 70 3.863 -8.938 5.710 1.00 0.00 H new ATOM 0 HD11 LEU A 70 3.191 -11.065 4.666 1.00 0.00 H new ATOM 0 HD12 LEU A 70 4.954 -10.964 4.883 1.00 0.00 H new ATOM 0 HD13 LEU A 70 3.977 -11.958 5.989 1.00 0.00 H new ATOM 0 HD21 LEU A 70 1.671 -9.931 6.243 1.00 0.00 H new ATOM 0 HD22 LEU A 70 2.397 -10.779 7.629 1.00 0.00 H new ATOM 0 HD23 LEU A 70 2.325 -9.001 7.612 1.00 0.00 H new ATOM 1104 N PRO A 71 7.784 -11.314 7.675 1.00 0.00 N ATOM 1105 CA PRO A 71 9.194 -11.249 8.071 1.00 0.00 C ATOM 1106 C PRO A 71 9.670 -9.817 8.284 1.00 0.00 C ATOM 1107 O PRO A 71 9.003 -8.863 7.883 1.00 0.00 O ATOM 1108 CB PRO A 71 9.924 -11.886 6.887 1.00 0.00 C ATOM 1109 CG PRO A 71 9.015 -11.678 5.725 1.00 0.00 C ATOM 1110 CD PRO A 71 7.618 -11.741 6.276 1.00 0.00 C ATOM 0 HA PRO A 71 9.375 -11.752 9.021 1.00 0.00 H new ATOM 0 HB2 PRO A 71 10.893 -11.416 6.720 1.00 0.00 H new ATOM 0 HB3 PRO A 71 10.109 -12.946 7.060 1.00 0.00 H new ATOM 0 HG2 PRO A 71 9.204 -10.716 5.249 1.00 0.00 H new ATOM 0 HG3 PRO A 71 9.170 -12.445 4.966 1.00 0.00 H new ATOM 0 HD2 PRO A 71 6.941 -11.082 5.732 1.00 0.00 H new ATOM 0 HD3 PRO A 71 7.205 -12.747 6.209 1.00 0.00 H new ATOM 1118 N LYS A 72 10.830 -9.671 8.916 1.00 0.00 N ATOM 1119 CA LYS A 72 11.398 -8.355 9.181 1.00 0.00 C ATOM 1120 C LYS A 72 11.437 -7.514 7.909 1.00 0.00 C ATOM 1121 O LYS A 72 10.983 -6.370 7.896 1.00 0.00 O ATOM 1122 CB LYS A 72 12.809 -8.492 9.757 1.00 0.00 C ATOM 1123 CG LYS A 72 13.418 -7.172 10.196 1.00 0.00 C ATOM 1124 CD LYS A 72 14.932 -7.186 10.066 1.00 0.00 C ATOM 1125 CE LYS A 72 15.571 -6.062 10.868 1.00 0.00 C ATOM 1126 NZ LYS A 72 17.058 -6.138 10.843 1.00 0.00 N ATOM 0 H LYS A 72 11.396 -10.449 9.254 1.00 0.00 H new ATOM 0 HA LYS A 72 10.762 -7.852 9.910 1.00 0.00 H new ATOM 0 HB2 LYS A 72 12.780 -9.170 10.610 1.00 0.00 H new ATOM 0 HB3 LYS A 72 13.455 -8.949 9.008 1.00 0.00 H new ATOM 0 HG2 LYS A 72 13.008 -6.362 9.593 1.00 0.00 H new ATOM 0 HG3 LYS A 72 13.143 -6.969 11.231 1.00 0.00 H new ATOM 0 HD2 LYS A 72 15.319 -8.145 10.410 1.00 0.00 H new ATOM 0 HD3 LYS A 72 15.209 -7.088 9.016 1.00 0.00 H new ATOM 0 HE2 LYS A 72 15.250 -5.101 10.466 1.00 0.00 H new ATOM 0 HE3 LYS A 72 15.222 -6.108 11.900 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 17.455 -5.355 11.401 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 17.366 -7.044 11.250 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 17.393 -6.068 9.861 1.00 0.00 H new ATOM 1140 N ASN A 73 11.981 -8.088 6.841 1.00 0.00 N ATOM 1141 CA ASN A 73 12.077 -7.390 5.564 1.00 0.00 C ATOM 1142 C ASN A 73 10.907 -7.755 4.655 1.00 0.00 C ATOM 1143 O ASN A 73 10.797 -8.890 4.194 1.00 0.00 O ATOM 1144 CB ASN A 73 13.399 -7.729 4.873 1.00 0.00 C ATOM 1145 CG ASN A 73 13.479 -9.186 4.459 1.00 0.00 C ATOM 1146 OD1 ASN A 73 13.248 -10.086 5.267 1.00 0.00 O ATOM 1147 ND2 ASN A 73 13.806 -9.425 3.194 1.00 0.00 N ATOM 0 H ASN A 73 12.362 -9.034 6.834 1.00 0.00 H new ATOM 0 HA ASN A 73 12.041 -6.318 5.760 1.00 0.00 H new ATOM 0 HB2 ASN A 73 13.518 -7.097 3.993 1.00 0.00 H new ATOM 0 HB3 ASN A 73 14.226 -7.499 5.545 1.00 0.00 H new ATOM 0 HD21 ASN A 73 13.874 -10.386 2.858 1.00 0.00 H new ATOM 0 HD22 ASN A 73 13.989 -8.648 2.559 1.00 0.00 H new ATOM 1154 N ASN A 74 10.037 -6.783 4.402 1.00 0.00 N ATOM 1155 CA ASN A 74 8.875 -7.001 3.548 1.00 0.00 C ATOM 1156 C ASN A 74 8.968 -6.163 2.277 1.00 0.00 C ATOM 1157 O ASN A 74 9.350 -4.993 2.320 1.00 0.00 O ATOM 1158 CB ASN A 74 7.589 -6.660 4.304 1.00 0.00 C ATOM 1159 CG ASN A 74 7.221 -7.719 5.326 1.00 0.00 C ATOM 1160 OD1 ASN A 74 6.770 -8.809 4.973 1.00 0.00 O ATOM 1161 ND2 ASN A 74 7.411 -7.401 6.601 1.00 0.00 N ATOM 0 H ASN A 74 10.114 -5.837 4.776 1.00 0.00 H new ATOM 0 HA ASN A 74 8.855 -8.054 3.267 1.00 0.00 H new ATOM 0 HB2 ASN A 74 7.710 -5.700 4.807 1.00 0.00 H new ATOM 0 HB3 ASN A 74 6.771 -6.546 3.592 1.00 0.00 H new ATOM 0 HD21 ASN A 74 7.181 -8.072 7.334 1.00 0.00 H new ATOM 0 HD22 ASN A 74 7.787 -6.486 6.848 1.00 0.00 H new ATOM 1168 N SER A 75 8.616 -6.769 1.148 1.00 0.00 N ATOM 1169 CA SER A 75 8.664 -6.079 -0.136 1.00 0.00 C ATOM 1170 C SER A 75 7.362 -6.276 -0.907 1.00 0.00 C ATOM 1171 O SER A 75 7.082 -7.365 -1.408 1.00 0.00 O ATOM 1172 CB SER A 75 9.843 -6.586 -0.968 1.00 0.00 C ATOM 1173 OG SER A 75 9.718 -7.971 -1.240 1.00 0.00 O ATOM 0 H SER A 75 8.295 -7.736 1.096 1.00 0.00 H new ATOM 0 HA SER A 75 8.796 -5.014 0.057 1.00 0.00 H new ATOM 0 HB2 SER A 75 9.896 -6.032 -1.905 1.00 0.00 H new ATOM 0 HB3 SER A 75 10.775 -6.400 -0.435 1.00 0.00 H new ATOM 0 HG SER A 75 8.771 -8.199 -1.349 1.00 0.00 H new ATOM 1179 N LEU A 76 6.569 -5.214 -0.996 1.00 0.00 N ATOM 1180 CA LEU A 76 5.295 -5.267 -1.705 1.00 0.00 C ATOM 1181 C LEU A 76 5.319 -4.368 -2.937 1.00 0.00 C ATOM 1182 O LEU A 76 6.321 -3.711 -3.219 1.00 0.00 O ATOM 1183 CB LEU A 76 4.154 -4.849 -0.776 1.00 0.00 C ATOM 1184 CG LEU A 76 3.810 -5.827 0.348 1.00 0.00 C ATOM 1185 CD1 LEU A 76 2.996 -5.133 1.429 1.00 0.00 C ATOM 1186 CD2 LEU A 76 3.056 -7.029 -0.202 1.00 0.00 C ATOM 0 H LEU A 76 6.786 -4.305 -0.586 1.00 0.00 H new ATOM 0 HA LEU A 76 5.132 -6.294 -2.031 1.00 0.00 H new ATOM 0 HB2 LEU A 76 4.410 -3.888 -0.329 1.00 0.00 H new ATOM 0 HB3 LEU A 76 3.260 -4.692 -1.380 1.00 0.00 H new ATOM 0 HG LEU A 76 4.740 -6.180 0.793 1.00 0.00 H new ATOM 0 HD11 LEU A 76 2.761 -5.845 2.220 1.00 0.00 H new ATOM 0 HD12 LEU A 76 3.572 -4.306 1.844 1.00 0.00 H new ATOM 0 HD13 LEU A 76 2.071 -4.750 0.998 1.00 0.00 H new ATOM 0 HD21 LEU A 76 2.820 -7.714 0.612 1.00 0.00 H new ATOM 0 HD22 LEU A 76 2.132 -6.694 -0.674 1.00 0.00 H new ATOM 0 HD23 LEU A 76 3.675 -7.541 -0.939 1.00 0.00 H new ATOM 1198 N TYR A 77 4.208 -4.342 -3.665 1.00 0.00 N ATOM 1199 CA TYR A 77 4.102 -3.523 -4.867 1.00 0.00 C ATOM 1200 C TYR A 77 2.646 -3.180 -5.166 1.00 0.00 C ATOM 1201 O TYR A 77 1.753 -4.010 -4.994 1.00 0.00 O ATOM 1202 CB TYR A 77 4.722 -4.250 -6.061 1.00 0.00 C ATOM 1203 CG TYR A 77 4.162 -5.637 -6.283 1.00 0.00 C ATOM 1204 CD1 TYR A 77 4.460 -6.675 -5.409 1.00 0.00 C ATOM 1205 CD2 TYR A 77 3.336 -5.909 -7.367 1.00 0.00 C ATOM 1206 CE1 TYR A 77 3.951 -7.944 -5.608 1.00 0.00 C ATOM 1207 CE2 TYR A 77 2.822 -7.174 -7.573 1.00 0.00 C ATOM 1208 CZ TYR A 77 3.133 -8.189 -6.691 1.00 0.00 C ATOM 1209 OH TYR A 77 2.623 -9.451 -6.893 1.00 0.00 O ATOM 0 H TYR A 77 3.369 -4.878 -3.444 1.00 0.00 H new ATOM 0 HA TYR A 77 4.646 -2.595 -4.693 1.00 0.00 H new ATOM 0 HB2 TYR A 77 4.563 -3.655 -6.960 1.00 0.00 H new ATOM 0 HB3 TYR A 77 5.799 -4.322 -5.912 1.00 0.00 H new ATOM 0 HD1 TYR A 77 5.100 -6.487 -4.560 1.00 0.00 H new ATOM 0 HD2 TYR A 77 3.092 -5.118 -8.060 1.00 0.00 H new ATOM 0 HE1 TYR A 77 4.192 -8.740 -4.919 1.00 0.00 H new ATOM 0 HE2 TYR A 77 2.180 -7.368 -8.420 1.00 0.00 H new ATOM 0 HH TYR A 77 2.066 -9.453 -7.699 1.00 0.00 H new ATOM 1219 N VAL A 78 2.414 -1.951 -5.615 1.00 0.00 N ATOM 1220 CA VAL A 78 1.067 -1.497 -5.940 1.00 0.00 C ATOM 1221 C VAL A 78 0.816 -1.553 -7.443 1.00 0.00 C ATOM 1222 O VAL A 78 1.715 -1.294 -8.244 1.00 0.00 O ATOM 1223 CB VAL A 78 0.823 -0.060 -5.443 1.00 0.00 C ATOM 1224 CG1 VAL A 78 -0.500 0.472 -5.973 1.00 0.00 C ATOM 1225 CG2 VAL A 78 0.857 -0.009 -3.923 1.00 0.00 C ATOM 0 H VAL A 78 3.142 -1.251 -5.762 1.00 0.00 H new ATOM 0 HA VAL A 78 0.376 -2.170 -5.433 1.00 0.00 H new ATOM 0 HB VAL A 78 1.621 0.577 -5.823 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -0.655 1.488 -5.611 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -0.481 0.474 -7.063 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -1.314 -0.165 -5.625 1.00 0.00 H new ATOM 0 HG21 VAL A 78 0.683 1.014 -3.589 1.00 0.00 H new ATOM 0 HG22 VAL A 78 0.081 -0.659 -3.520 1.00 0.00 H new ATOM 0 HG23 VAL A 78 1.832 -0.345 -3.569 1.00 0.00 H new ATOM 1235 N LEU A 79 -0.412 -1.892 -7.820 1.00 0.00 N ATOM 1236 CA LEU A 79 -0.783 -1.981 -9.228 1.00 0.00 C ATOM 1237 C LEU A 79 -2.068 -1.207 -9.502 1.00 0.00 C ATOM 1238 O LEU A 79 -3.151 -1.604 -9.071 1.00 0.00 O ATOM 1239 CB LEU A 79 -0.959 -3.444 -9.637 1.00 0.00 C ATOM 1240 CG LEU A 79 0.257 -4.349 -9.432 1.00 0.00 C ATOM 1241 CD1 LEU A 79 -0.107 -5.801 -9.700 1.00 0.00 C ATOM 1242 CD2 LEU A 79 1.406 -3.911 -10.328 1.00 0.00 C ATOM 0 H LEU A 79 -1.168 -2.110 -7.170 1.00 0.00 H new ATOM 0 HA LEU A 79 0.019 -1.538 -9.819 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -1.795 -3.860 -9.075 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -1.237 -3.475 -10.691 1.00 0.00 H new ATOM 0 HG LEU A 79 0.579 -4.262 -8.394 1.00 0.00 H new ATOM 0 HD11 LEU A 79 0.770 -6.430 -9.549 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -0.897 -6.110 -9.016 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -0.456 -5.905 -10.727 1.00 0.00 H new ATOM 0 HD21 LEU A 79 2.262 -4.566 -10.168 1.00 0.00 H new ATOM 0 HD22 LEU A 79 1.096 -3.967 -11.371 1.00 0.00 H new ATOM 0 HD23 LEU A 79 1.685 -2.885 -10.087 1.00 0.00 H new ATOM 1254 N THR A 80 -1.942 -0.098 -10.226 1.00 0.00 N ATOM 1255 CA THR A 80 -3.093 0.732 -10.560 1.00 0.00 C ATOM 1256 C THR A 80 -3.555 0.481 -11.990 1.00 0.00 C ATOM 1257 O THR A 80 -3.004 1.020 -12.950 1.00 0.00 O ATOM 1258 CB THR A 80 -2.773 2.229 -10.391 1.00 0.00 C ATOM 1259 OG1 THR A 80 -1.750 2.619 -11.313 1.00 0.00 O ATOM 1260 CG2 THR A 80 -2.323 2.529 -8.969 1.00 0.00 C ATOM 0 H THR A 80 -1.054 0.246 -10.592 1.00 0.00 H new ATOM 0 HA THR A 80 -3.891 0.458 -9.870 1.00 0.00 H new ATOM 0 HB THR A 80 -3.681 2.797 -10.595 1.00 0.00 H new ATOM 0 HG1 THR A 80 -1.927 2.215 -12.188 1.00 0.00 H new ATOM 0 HG21 THR A 80 -2.103 3.592 -8.874 1.00 0.00 H new ATOM 0 HG22 THR A 80 -3.116 2.259 -8.272 1.00 0.00 H new ATOM 0 HG23 THR A 80 -1.427 1.951 -8.741 1.00 0.00 H new ATOM 1268 N PRO A 81 -4.592 -0.357 -12.139 1.00 0.00 N ATOM 1269 CA PRO A 81 -5.153 -0.697 -13.450 1.00 0.00 C ATOM 1270 C PRO A 81 -5.883 0.478 -14.091 1.00 0.00 C ATOM 1271 O PRO A 81 -5.664 0.794 -15.261 1.00 0.00 O ATOM 1272 CB PRO A 81 -6.134 -1.828 -13.134 1.00 0.00 C ATOM 1273 CG PRO A 81 -6.514 -1.613 -11.709 1.00 0.00 C ATOM 1274 CD PRO A 81 -5.298 -1.035 -11.039 1.00 0.00 C ATOM 0 HA PRO A 81 -4.378 -0.974 -14.165 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -7.006 -1.789 -13.786 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -5.672 -2.805 -13.277 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -7.363 -0.934 -11.630 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -6.810 -2.550 -11.238 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -5.569 -0.338 -10.246 1.00 0.00 H new ATOM 0 HD3 PRO A 81 -4.682 -1.811 -10.585 1.00 0.00 H new ATOM 1282 N ASP A 82 -6.751 1.122 -13.319 1.00 0.00 N ATOM 1283 CA ASP A 82 -7.513 2.264 -13.811 1.00 0.00 C ATOM 1284 C ASP A 82 -6.632 3.506 -13.900 1.00 0.00 C ATOM 1285 O ASP A 82 -6.373 4.019 -14.990 1.00 0.00 O ATOM 1286 CB ASP A 82 -8.710 2.536 -12.900 1.00 0.00 C ATOM 1287 CG ASP A 82 -9.767 1.454 -12.994 1.00 0.00 C ATOM 1288 OD1 ASP A 82 -10.429 1.361 -14.049 1.00 0.00 O ATOM 1289 OD2 ASP A 82 -9.935 0.700 -12.012 1.00 0.00 O ATOM 0 H ASP A 82 -6.945 0.873 -12.349 1.00 0.00 H new ATOM 0 HA ASP A 82 -7.875 2.025 -14.811 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -8.367 2.616 -11.868 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -9.153 3.496 -13.164 1.00 0.00 H new ATOM 1294 N LEU A 83 -6.177 3.986 -12.748 1.00 0.00 N ATOM 1295 CA LEU A 83 -5.326 5.170 -12.696 1.00 0.00 C ATOM 1296 C LEU A 83 -4.199 5.077 -13.720 1.00 0.00 C ATOM 1297 O LEU A 83 -3.413 4.130 -13.729 1.00 0.00 O ATOM 1298 CB LEU A 83 -4.743 5.341 -11.292 1.00 0.00 C ATOM 1299 CG LEU A 83 -4.424 6.775 -10.868 1.00 0.00 C ATOM 1300 CD1 LEU A 83 -5.693 7.503 -10.452 1.00 0.00 C ATOM 1301 CD2 LEU A 83 -3.408 6.783 -9.735 1.00 0.00 C ATOM 0 H LEU A 83 -6.383 3.574 -11.838 1.00 0.00 H new ATOM 0 HA LEU A 83 -5.939 6.039 -12.937 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -5.447 4.919 -10.574 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -3.828 4.752 -11.226 1.00 0.00 H new ATOM 0 HG LEU A 83 -3.992 7.298 -11.721 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -5.447 8.522 -10.153 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -6.389 7.529 -11.290 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -6.154 6.981 -9.614 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -3.193 7.812 -9.446 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -3.813 6.243 -8.879 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -2.489 6.300 -10.067 1.00 0.00 H new ATOM 1313 N PRO A 84 -4.117 6.084 -14.602 1.00 0.00 N ATOM 1314 CA PRO A 84 -3.088 6.140 -15.645 1.00 0.00 C ATOM 1315 C PRO A 84 -1.698 6.396 -15.074 1.00 0.00 C ATOM 1316 O PRO A 84 -1.535 6.753 -13.907 1.00 0.00 O ATOM 1317 CB PRO A 84 -3.533 7.315 -16.519 1.00 0.00 C ATOM 1318 CG PRO A 84 -4.339 8.178 -15.612 1.00 0.00 C ATOM 1319 CD PRO A 84 -5.021 7.245 -14.650 1.00 0.00 C ATOM 0 HA PRO A 84 -3.003 5.197 -16.186 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -2.676 7.855 -16.922 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -4.124 6.974 -17.369 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -3.704 8.888 -15.083 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -5.069 8.761 -16.174 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -5.143 7.700 -13.667 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -6.016 6.966 -14.998 1.00 0.00 H new ATOM 1327 N PRO A 85 -0.669 6.211 -15.915 1.00 0.00 N ATOM 1328 CA PRO A 85 0.727 6.418 -15.516 1.00 0.00 C ATOM 1329 C PRO A 85 1.051 7.890 -15.286 1.00 0.00 C ATOM 1330 O PRO A 85 0.562 8.776 -15.987 1.00 0.00 O ATOM 1331 CB PRO A 85 1.520 5.875 -16.706 1.00 0.00 C ATOM 1332 CG PRO A 85 0.596 6.001 -17.868 1.00 0.00 C ATOM 1333 CD PRO A 85 -0.788 5.787 -17.320 1.00 0.00 C ATOM 0 HA PRO A 85 0.959 5.925 -14.572 1.00 0.00 H new ATOM 0 HB2 PRO A 85 2.435 6.445 -16.865 1.00 0.00 H new ATOM 0 HB3 PRO A 85 1.814 4.838 -16.545 1.00 0.00 H new ATOM 0 HG2 PRO A 85 0.684 6.983 -18.333 1.00 0.00 H new ATOM 0 HG3 PRO A 85 0.831 5.263 -18.635 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -1.529 6.380 -17.857 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -1.095 4.744 -17.400 1.00 0.00 H new ATOM 1341 N PRO A 86 1.897 8.160 -14.281 1.00 0.00 N ATOM 1342 CA PRO A 86 2.307 9.525 -13.936 1.00 0.00 C ATOM 1343 C PRO A 86 3.214 10.143 -14.995 1.00 0.00 C ATOM 1344 O PRO A 86 3.902 9.433 -15.728 1.00 0.00 O ATOM 1345 CB PRO A 86 3.068 9.345 -12.620 1.00 0.00 C ATOM 1346 CG PRO A 86 3.562 7.940 -12.657 1.00 0.00 C ATOM 1347 CD PRO A 86 2.520 7.154 -13.403 1.00 0.00 C ATOM 0 HA PRO A 86 1.454 10.200 -13.863 1.00 0.00 H new ATOM 0 HB2 PRO A 86 3.893 10.053 -12.540 1.00 0.00 H new ATOM 0 HB3 PRO A 86 2.419 9.514 -11.761 1.00 0.00 H new ATOM 0 HG2 PRO A 86 4.529 7.879 -13.157 1.00 0.00 H new ATOM 0 HG3 PRO A 86 3.699 7.548 -11.649 1.00 0.00 H new ATOM 0 HD2 PRO A 86 2.964 6.340 -13.976 1.00 0.00 H new ATOM 0 HD3 PRO A 86 1.793 6.706 -12.725 1.00 0.00 H new ATOM 1355 N SER A 87 3.210 11.470 -15.069 1.00 0.00 N ATOM 1356 CA SER A 87 4.030 12.184 -16.042 1.00 0.00 C ATOM 1357 C SER A 87 5.507 12.107 -15.667 1.00 0.00 C ATOM 1358 O SER A 87 5.861 12.112 -14.488 1.00 0.00 O ATOM 1359 CB SER A 87 3.591 13.646 -16.135 1.00 0.00 C ATOM 1360 OG SER A 87 3.953 14.209 -17.384 1.00 0.00 O ATOM 0 H SER A 87 2.649 12.073 -14.467 1.00 0.00 H new ATOM 0 HA SER A 87 3.894 11.709 -17.014 1.00 0.00 H new ATOM 0 HB2 SER A 87 2.511 13.714 -16.001 1.00 0.00 H new ATOM 0 HB3 SER A 87 4.049 14.218 -15.328 1.00 0.00 H new ATOM 0 HG SER A 87 3.660 15.143 -17.419 1.00 0.00 H new ATOM 1366 N SER A 88 6.364 12.036 -16.680 1.00 0.00 N ATOM 1367 CA SER A 88 7.803 11.954 -16.459 1.00 0.00 C ATOM 1368 C SER A 88 8.257 12.998 -15.442 1.00 0.00 C ATOM 1369 O SER A 88 8.841 12.664 -14.412 1.00 0.00 O ATOM 1370 CB SER A 88 8.555 12.149 -17.777 1.00 0.00 C ATOM 1371 OG SER A 88 8.639 10.934 -18.501 1.00 0.00 O ATOM 0 H SER A 88 6.087 12.034 -17.662 1.00 0.00 H new ATOM 0 HA SER A 88 8.029 10.964 -16.063 1.00 0.00 H new ATOM 0 HB2 SER A 88 8.048 12.901 -18.381 1.00 0.00 H new ATOM 0 HB3 SER A 88 9.558 12.526 -17.575 1.00 0.00 H new ATOM 0 HG SER A 88 9.122 11.086 -19.340 1.00 0.00 H new ATOM 1377 N SER A 89 7.983 14.264 -15.741 1.00 0.00 N ATOM 1378 CA SER A 89 8.365 15.358 -14.856 1.00 0.00 C ATOM 1379 C SER A 89 7.134 16.012 -14.238 1.00 0.00 C ATOM 1380 O SER A 89 6.223 16.440 -14.946 1.00 0.00 O ATOM 1381 CB SER A 89 9.180 16.401 -15.623 1.00 0.00 C ATOM 1382 OG SER A 89 8.377 17.076 -16.576 1.00 0.00 O ATOM 0 H SER A 89 7.498 14.557 -16.589 1.00 0.00 H new ATOM 0 HA SER A 89 8.977 14.947 -14.054 1.00 0.00 H new ATOM 0 HB2 SER A 89 9.604 17.122 -14.924 1.00 0.00 H new ATOM 0 HB3 SER A 89 10.016 15.916 -16.126 1.00 0.00 H new ATOM 0 HG SER A 89 7.437 17.033 -16.301 1.00 0.00 H new ATOM 1388 N SER A 90 7.114 16.086 -12.911 1.00 0.00 N ATOM 1389 CA SER A 90 5.994 16.684 -12.195 1.00 0.00 C ATOM 1390 C SER A 90 6.410 17.108 -10.789 1.00 0.00 C ATOM 1391 O SER A 90 7.509 16.790 -10.333 1.00 0.00 O ATOM 1392 CB SER A 90 4.826 15.699 -12.117 1.00 0.00 C ATOM 1393 OG SER A 90 5.189 14.534 -11.397 1.00 0.00 O ATOM 0 H SER A 90 7.861 15.739 -12.310 1.00 0.00 H new ATOM 0 HA SER A 90 5.677 17.571 -12.744 1.00 0.00 H new ATOM 0 HB2 SER A 90 3.974 16.178 -11.634 1.00 0.00 H new ATOM 0 HB3 SER A 90 4.510 15.425 -13.123 1.00 0.00 H new ATOM 0 HG SER A 90 4.425 13.921 -11.360 1.00 0.00 H new ATOM 1399 N HIS A 91 5.525 17.828 -10.108 1.00 0.00 N ATOM 1400 CA HIS A 91 5.800 18.296 -8.754 1.00 0.00 C ATOM 1401 C HIS A 91 6.020 17.120 -7.808 1.00 0.00 C ATOM 1402 O HIS A 91 5.067 16.480 -7.364 1.00 0.00 O ATOM 1403 CB HIS A 91 4.647 19.163 -8.248 1.00 0.00 C ATOM 1404 CG HIS A 91 5.073 20.213 -7.268 1.00 0.00 C ATOM 1405 ND1 HIS A 91 5.853 21.295 -7.616 1.00 0.00 N ATOM 1406 CD2 HIS A 91 4.821 20.343 -5.944 1.00 0.00 C ATOM 1407 CE1 HIS A 91 6.064 22.044 -6.549 1.00 0.00 C ATOM 1408 NE2 HIS A 91 5.449 21.488 -5.521 1.00 0.00 N ATOM 0 H HIS A 91 4.611 18.100 -10.471 1.00 0.00 H new ATOM 0 HA HIS A 91 6.711 18.894 -8.780 1.00 0.00 H new ATOM 0 HB2 HIS A 91 4.165 19.645 -9.099 1.00 0.00 H new ATOM 0 HB3 HIS A 91 3.900 18.522 -7.780 1.00 0.00 H new ATOM 0 HD2 HIS A 91 4.235 19.671 -5.334 1.00 0.00 H new ATOM 0 HE1 HIS A 91 6.641 22.956 -6.522 1.00 0.00 H new ATOM 0 HE2 HIS A 91 5.442 21.850 -4.568 1.00 0.00 H new ATOM 1417 N ALA A 92 7.284 16.840 -7.503 1.00 0.00 N ATOM 1418 CA ALA A 92 7.629 15.743 -6.609 1.00 0.00 C ATOM 1419 C ALA A 92 8.386 16.248 -5.386 1.00 0.00 C ATOM 1420 O ALA A 92 9.602 16.430 -5.427 1.00 0.00 O ATOM 1421 CB ALA A 92 8.453 14.699 -7.348 1.00 0.00 C ATOM 0 H ALA A 92 8.085 17.359 -7.863 1.00 0.00 H new ATOM 0 HA ALA A 92 6.703 15.283 -6.265 1.00 0.00 H new ATOM 0 HB1 ALA A 92 8.704 13.885 -6.668 1.00 0.00 H new ATOM 0 HB2 ALA A 92 7.877 14.307 -8.186 1.00 0.00 H new ATOM 0 HB3 ALA A 92 9.370 15.156 -7.720 1.00 0.00 H new ATOM 1427 N GLY A 93 7.658 16.475 -4.296 1.00 0.00 N ATOM 1428 CA GLY A 93 8.279 16.959 -3.077 1.00 0.00 C ATOM 1429 C GLY A 93 8.372 15.888 -2.009 1.00 0.00 C ATOM 1430 O GLY A 93 7.361 15.491 -1.429 1.00 0.00 O ATOM 0 H GLY A 93 6.650 16.332 -4.236 1.00 0.00 H new ATOM 0 HA2 GLY A 93 9.279 17.329 -3.304 1.00 0.00 H new ATOM 0 HA3 GLY A 93 7.707 17.803 -2.692 1.00 0.00 H new ATOM 1434 N ALA A 94 9.587 15.417 -1.750 1.00 0.00 N ATOM 1435 CA ALA A 94 9.808 14.385 -0.744 1.00 0.00 C ATOM 1436 C ALA A 94 11.297 14.148 -0.519 1.00 0.00 C ATOM 1437 O ALA A 94 12.079 14.096 -1.470 1.00 0.00 O ATOM 1438 CB ALA A 94 9.122 13.091 -1.157 1.00 0.00 C ATOM 0 H ALA A 94 10.434 15.733 -2.223 1.00 0.00 H new ATOM 0 HA ALA A 94 9.376 14.729 0.196 1.00 0.00 H new ATOM 0 HB1 ALA A 94 9.295 12.329 -0.397 1.00 0.00 H new ATOM 0 HB2 ALA A 94 8.051 13.264 -1.260 1.00 0.00 H new ATOM 0 HB3 ALA A 94 9.528 12.752 -2.110 1.00 0.00 H new ATOM 1444 N LEU A 95 11.685 14.005 0.744 1.00 0.00 N ATOM 1445 CA LEU A 95 13.082 13.774 1.094 1.00 0.00 C ATOM 1446 C LEU A 95 13.197 13.102 2.459 1.00 0.00 C ATOM 1447 O LEU A 95 12.412 13.379 3.365 1.00 0.00 O ATOM 1448 CB LEU A 95 13.852 15.095 1.098 1.00 0.00 C ATOM 1449 CG LEU A 95 15.274 15.042 1.657 1.00 0.00 C ATOM 1450 CD1 LEU A 95 16.271 14.730 0.552 1.00 0.00 C ATOM 1451 CD2 LEU A 95 15.628 16.354 2.342 1.00 0.00 C ATOM 0 H LEU A 95 11.052 14.045 1.542 1.00 0.00 H new ATOM 0 HA LEU A 95 13.514 13.111 0.345 1.00 0.00 H new ATOM 0 HB2 LEU A 95 13.899 15.468 0.075 1.00 0.00 H new ATOM 0 HB3 LEU A 95 13.283 15.822 1.677 1.00 0.00 H new ATOM 0 HG LEU A 95 15.322 14.244 2.398 1.00 0.00 H new ATOM 0 HD11 LEU A 95 17.278 14.696 0.969 1.00 0.00 H new ATOM 0 HD12 LEU A 95 16.030 13.765 0.107 1.00 0.00 H new ATOM 0 HD13 LEU A 95 16.221 15.505 -0.213 1.00 0.00 H new ATOM 0 HD21 LEU A 95 16.644 16.298 2.734 1.00 0.00 H new ATOM 0 HD22 LEU A 95 15.561 17.170 1.622 1.00 0.00 H new ATOM 0 HD23 LEU A 95 14.933 16.536 3.162 1.00 0.00 H new ATOM 1463 N GLN A 96 14.181 12.219 2.596 1.00 0.00 N ATOM 1464 CA GLN A 96 14.399 11.508 3.851 1.00 0.00 C ATOM 1465 C GLN A 96 15.873 11.162 4.031 1.00 0.00 C ATOM 1466 O GLN A 96 16.576 10.879 3.062 1.00 0.00 O ATOM 1467 CB GLN A 96 13.555 10.233 3.893 1.00 0.00 C ATOM 1468 CG GLN A 96 13.813 9.373 5.119 1.00 0.00 C ATOM 1469 CD GLN A 96 13.241 9.977 6.387 1.00 0.00 C ATOM 1470 OE1 GLN A 96 13.731 10.994 6.879 1.00 0.00 O ATOM 1471 NE2 GLN A 96 12.199 9.352 6.923 1.00 0.00 N ATOM 0 H GLN A 96 14.839 11.979 1.855 1.00 0.00 H new ATOM 0 HA GLN A 96 14.096 12.163 4.668 1.00 0.00 H new ATOM 0 HB2 GLN A 96 12.500 10.505 3.866 1.00 0.00 H new ATOM 0 HB3 GLN A 96 13.756 9.645 2.998 1.00 0.00 H new ATOM 0 HG2 GLN A 96 13.378 8.386 4.963 1.00 0.00 H new ATOM 0 HG3 GLN A 96 14.887 9.233 5.240 1.00 0.00 H new ATOM 0 HE21 GLN A 96 11.826 8.512 6.481 1.00 0.00 H new ATOM 0 HE22 GLN A 96 11.772 9.712 7.777 1.00 0.00 H new ATOM 1480 N GLU A 97 16.334 11.188 5.278 1.00 0.00 N ATOM 1481 CA GLU A 97 17.726 10.878 5.584 1.00 0.00 C ATOM 1482 C GLU A 97 17.906 10.600 7.073 1.00 0.00 C ATOM 1483 O GLU A 97 17.190 11.151 7.910 1.00 0.00 O ATOM 1484 CB GLU A 97 18.634 12.032 5.155 1.00 0.00 C ATOM 1485 CG GLU A 97 20.116 11.729 5.307 1.00 0.00 C ATOM 1486 CD GLU A 97 20.518 10.432 4.632 1.00 0.00 C ATOM 1487 OE1 GLU A 97 19.893 10.078 3.610 1.00 0.00 O ATOM 1488 OE2 GLU A 97 21.456 9.772 5.125 1.00 0.00 O ATOM 0 H GLU A 97 15.765 11.420 6.092 1.00 0.00 H new ATOM 0 HA GLU A 97 18.003 9.982 5.029 1.00 0.00 H new ATOM 0 HB2 GLU A 97 18.427 12.278 4.114 1.00 0.00 H new ATOM 0 HB3 GLU A 97 18.390 12.915 5.746 1.00 0.00 H new ATOM 0 HG2 GLU A 97 20.696 12.549 4.884 1.00 0.00 H new ATOM 0 HG3 GLU A 97 20.365 11.675 6.367 1.00 0.00 H new ATOM 1495 N SER A 98 18.868 9.742 7.397 1.00 0.00 N ATOM 1496 CA SER A 98 19.141 9.386 8.784 1.00 0.00 C ATOM 1497 C SER A 98 20.518 8.746 8.920 1.00 0.00 C ATOM 1498 O SER A 98 20.876 7.847 8.158 1.00 0.00 O ATOM 1499 CB SER A 98 18.067 8.430 9.309 1.00 0.00 C ATOM 1500 OG SER A 98 18.204 7.144 8.731 1.00 0.00 O ATOM 0 H SER A 98 19.472 9.280 6.717 1.00 0.00 H new ATOM 0 HA SER A 98 19.125 10.300 9.377 1.00 0.00 H new ATOM 0 HB2 SER A 98 18.141 8.355 10.394 1.00 0.00 H new ATOM 0 HB3 SER A 98 17.078 8.830 9.084 1.00 0.00 H new ATOM 0 HG SER A 98 17.508 6.551 9.083 1.00 0.00 H new ATOM 1506 N LEU A 99 21.288 9.214 9.897 1.00 0.00 N ATOM 1507 CA LEU A 99 22.628 8.688 10.135 1.00 0.00 C ATOM 1508 C LEU A 99 23.153 9.132 11.496 1.00 0.00 C ATOM 1509 O LEU A 99 22.644 10.082 12.089 1.00 0.00 O ATOM 1510 CB LEU A 99 23.581 9.150 9.031 1.00 0.00 C ATOM 1511 CG LEU A 99 24.988 8.551 9.066 1.00 0.00 C ATOM 1512 CD1 LEU A 99 24.941 7.060 8.771 1.00 0.00 C ATOM 1513 CD2 LEU A 99 25.896 9.265 8.075 1.00 0.00 C ATOM 0 H LEU A 99 21.007 9.957 10.537 1.00 0.00 H new ATOM 0 HA LEU A 99 22.572 7.599 10.126 1.00 0.00 H new ATOM 0 HB2 LEU A 99 23.131 8.913 8.067 1.00 0.00 H new ATOM 0 HB3 LEU A 99 23.668 10.235 9.084 1.00 0.00 H new ATOM 0 HG LEU A 99 25.396 8.689 10.067 1.00 0.00 H new ATOM 0 HD11 LEU A 99 25.951 6.651 8.800 1.00 0.00 H new ATOM 0 HD12 LEU A 99 24.326 6.560 9.519 1.00 0.00 H new ATOM 0 HD13 LEU A 99 24.513 6.898 7.782 1.00 0.00 H new ATOM 0 HD21 LEU A 99 26.893 8.826 8.113 1.00 0.00 H new ATOM 0 HD22 LEU A 99 25.491 9.159 7.069 1.00 0.00 H new ATOM 0 HD23 LEU A 99 25.955 10.323 8.332 1.00 0.00 H new ATOM 1525 N ASN A 100 24.178 8.440 11.983 1.00 0.00 N ATOM 1526 CA ASN A 100 24.774 8.764 13.274 1.00 0.00 C ATOM 1527 C ASN A 100 26.275 8.491 13.264 1.00 0.00 C ATOM 1528 O ASN A 100 26.743 7.565 12.602 1.00 0.00 O ATOM 1529 CB ASN A 100 24.105 7.955 14.386 1.00 0.00 C ATOM 1530 CG ASN A 100 24.111 6.465 14.102 1.00 0.00 C ATOM 1531 OD1 ASN A 100 24.925 5.975 13.318 1.00 0.00 O ATOM 1532 ND2 ASN A 100 23.201 5.737 14.738 1.00 0.00 N ATOM 0 H ASN A 100 24.613 7.652 11.503 1.00 0.00 H new ATOM 0 HA ASN A 100 24.617 9.826 13.462 1.00 0.00 H new ATOM 0 HB2 ASN A 100 24.619 8.144 15.329 1.00 0.00 H new ATOM 0 HB3 ASN A 100 23.077 8.294 14.510 1.00 0.00 H new ATOM 0 HD21 ASN A 100 23.157 4.729 14.586 1.00 0.00 H new ATOM 0 HD22 ASN A 100 22.546 6.185 15.379 1.00 0.00 H new TER 1539 ASN A 100