USER MOD reduce.3.24.130724 H: found=0, std=0, add=773, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 771 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 16 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 80 THR OG1 : rot 41:sc= 1.1 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 153:sc= -2.27! (180deg=-4.76!) USER MOD Single : A 20 ASN : amide:sc= 0.711 K(o=0.71,f=-3.7!) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 CYS SG : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0.00424 USER MOD Single : A 35 LYS NZ :NH3+ -165:sc= -1.45! (180deg=-2.01!) USER MOD Single : A 36 GLN : amide:sc= -0.197 K(o=-0.2,f=-1!) USER MOD Single : A 40 ASN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 43 GLN :FLIP amide:sc= -0.991 F(o=-6.7!,f=-0.99) 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 -131:sc= -2.81 (180deg=-8.52!) USER MOD Single : A 52 LYS NZ :NH3+ -155:sc= -0.0953 (180deg=-0.542) 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 -48:sc= 0.0807 USER MOD Single : A 63 THR OG1 : rot 180:sc= -0.613 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 HE2:sc= -5.43! C(o=-5.4!,f=-6.3!) USER MOD Single : A 72 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0365) USER MOD Single : A 73 ASN : amide:sc= -1.22 X(o=-1.2,f=-0.88) USER MOD Single : A 74 ASN : amide:sc= -4.62 K(o=-4.6,f=-10!) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot -58:sc= 0.0253 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 180:sc= -0.0342 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 91 HIS : no HD1:sc= -0.021 X(o=-0.021,f=0) USER MOD Single : A 96 GLN : amide:sc= -0.154 X(o=-0.15,f=0) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 100 ASN : amide:sc= -0.444 X(o=-0.44,f=-0.58) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 2.366 3.595 18.818 1.00 0.00 N ATOM 2 CA GLY A 1 1.696 2.338 19.099 1.00 0.00 C ATOM 3 C GLY A 1 0.869 2.393 20.368 1.00 0.00 C ATOM 4 O GLY A 1 -0.081 3.170 20.465 1.00 0.00 O ATOM 0 H1 GLY A 1 2.918 3.506 17.941 1.00 0.00 H new ATOM 0 H2 GLY A 1 1.658 4.348 18.706 1.00 0.00 H new ATOM 0 H3 GLY A 1 3.003 3.832 19.605 1.00 0.00 H new ATOM 0 HA2 GLY A 1 1.051 2.078 18.260 1.00 0.00 H new ATOM 0 HA3 GLY A 1 2.439 1.546 19.187 1.00 0.00 H new ATOM 8 N SER A 2 1.228 1.565 21.343 1.00 0.00 N ATOM 9 CA SER A 2 0.509 1.518 22.611 1.00 0.00 C ATOM 10 C SER A 2 1.472 1.308 23.775 1.00 0.00 C ATOM 11 O SER A 2 2.146 0.282 23.859 1.00 0.00 O ATOM 12 CB SER A 2 -0.534 0.399 22.588 1.00 0.00 C ATOM 13 OG SER A 2 -1.340 0.430 23.754 1.00 0.00 O ATOM 0 H SER A 2 2.013 0.917 21.279 1.00 0.00 H new ATOM 0 HA SER A 2 0.004 2.474 22.750 1.00 0.00 H new ATOM 0 HB2 SER A 2 -1.163 0.502 21.704 1.00 0.00 H new ATOM 0 HB3 SER A 2 -0.034 -0.567 22.513 1.00 0.00 H new ATOM 0 HG SER A 2 -2.000 -0.294 23.715 1.00 0.00 H new ATOM 19 N SER A 3 1.531 2.288 24.670 1.00 0.00 N ATOM 20 CA SER A 3 2.415 2.214 25.828 1.00 0.00 C ATOM 21 C SER A 3 2.182 0.922 26.606 1.00 0.00 C ATOM 22 O SER A 3 1.322 0.859 27.484 1.00 0.00 O ATOM 23 CB SER A 3 2.194 3.420 26.743 1.00 0.00 C ATOM 24 OG SER A 3 3.024 4.505 26.365 1.00 0.00 O ATOM 0 H SER A 3 0.977 3.143 24.616 1.00 0.00 H new ATOM 0 HA SER A 3 3.444 2.223 25.470 1.00 0.00 H new ATOM 0 HB2 SER A 3 1.149 3.726 26.701 1.00 0.00 H new ATOM 0 HB3 SER A 3 2.403 3.140 27.776 1.00 0.00 H new ATOM 0 HG SER A 3 2.863 5.264 26.964 1.00 0.00 H new ATOM 30 N GLY A 4 2.957 -0.107 26.277 1.00 0.00 N ATOM 31 CA GLY A 4 2.821 -1.384 26.954 1.00 0.00 C ATOM 32 C GLY A 4 3.383 -2.533 26.141 1.00 0.00 C ATOM 33 O GLY A 4 4.568 -2.546 25.808 1.00 0.00 O ATOM 0 H GLY A 4 3.676 -0.079 25.554 1.00 0.00 H new ATOM 0 HA2 GLY A 4 3.333 -1.339 27.915 1.00 0.00 H new ATOM 0 HA3 GLY A 4 1.768 -1.571 27.162 1.00 0.00 H new ATOM 37 N SER A 5 2.531 -3.503 25.822 1.00 0.00 N ATOM 38 CA SER A 5 2.951 -4.665 25.048 1.00 0.00 C ATOM 39 C SER A 5 3.934 -4.262 23.952 1.00 0.00 C ATOM 40 O SER A 5 3.550 -3.660 22.949 1.00 0.00 O ATOM 41 CB SER A 5 1.736 -5.357 24.428 1.00 0.00 C ATOM 42 OG SER A 5 0.790 -5.714 25.422 1.00 0.00 O ATOM 0 H SER A 5 1.546 -3.507 26.088 1.00 0.00 H new ATOM 0 HA SER A 5 3.451 -5.359 25.724 1.00 0.00 H new ATOM 0 HB2 SER A 5 1.269 -4.695 23.698 1.00 0.00 H new ATOM 0 HB3 SER A 5 2.057 -6.249 23.890 1.00 0.00 H new ATOM 0 HG SER A 5 0.022 -6.153 25.000 1.00 0.00 H new ATOM 48 N SER A 6 5.204 -4.599 24.153 1.00 0.00 N ATOM 49 CA SER A 6 6.244 -4.269 23.185 1.00 0.00 C ATOM 50 C SER A 6 6.090 -5.104 21.917 1.00 0.00 C ATOM 51 O SER A 6 5.738 -6.281 21.974 1.00 0.00 O ATOM 52 CB SER A 6 7.628 -4.498 23.794 1.00 0.00 C ATOM 53 OG SER A 6 7.897 -5.881 23.944 1.00 0.00 O ATOM 0 H SER A 6 5.538 -5.100 24.977 1.00 0.00 H new ATOM 0 HA SER A 6 6.140 -3.216 22.922 1.00 0.00 H new ATOM 0 HB2 SER A 6 8.388 -4.043 23.159 1.00 0.00 H new ATOM 0 HB3 SER A 6 7.688 -4.005 24.765 1.00 0.00 H new ATOM 0 HG SER A 6 8.788 -6.001 24.334 1.00 0.00 H new ATOM 59 N GLY A 7 6.357 -4.483 20.771 1.00 0.00 N ATOM 60 CA GLY A 7 6.242 -5.182 19.505 1.00 0.00 C ATOM 61 C GLY A 7 7.445 -4.960 18.609 1.00 0.00 C ATOM 62 O GLY A 7 8.498 -4.518 19.071 1.00 0.00 O ATOM 0 H GLY A 7 6.651 -3.509 20.698 1.00 0.00 H new ATOM 0 HA2 GLY A 7 6.124 -6.249 19.692 1.00 0.00 H new ATOM 0 HA3 GLY A 7 5.342 -4.848 18.989 1.00 0.00 H new ATOM 66 N ARG A 8 7.290 -5.269 17.326 1.00 0.00 N ATOM 67 CA ARG A 8 8.374 -5.104 16.365 1.00 0.00 C ATOM 68 C ARG A 8 7.883 -4.383 15.112 1.00 0.00 C ATOM 69 O ARG A 8 6.723 -4.513 14.724 1.00 0.00 O ATOM 70 CB ARG A 8 8.961 -6.465 15.986 1.00 0.00 C ATOM 71 CG ARG A 8 7.984 -7.366 15.250 1.00 0.00 C ATOM 72 CD ARG A 8 8.576 -8.744 15.001 1.00 0.00 C ATOM 73 NE ARG A 8 9.781 -8.682 14.178 1.00 0.00 N ATOM 74 CZ ARG A 8 10.309 -9.737 13.566 1.00 0.00 C ATOM 75 NH1 ARG A 8 9.740 -10.928 13.683 1.00 0.00 N ATOM 76 NH2 ARG A 8 11.407 -9.600 12.835 1.00 0.00 N ATOM 0 H ARG A 8 6.425 -5.635 16.928 1.00 0.00 H new ATOM 0 HA ARG A 8 9.151 -4.499 16.832 1.00 0.00 H new ATOM 0 HB2 ARG A 8 9.841 -6.310 15.361 1.00 0.00 H new ATOM 0 HB3 ARG A 8 9.297 -6.971 16.891 1.00 0.00 H new ATOM 0 HG2 ARG A 8 7.067 -7.462 15.832 1.00 0.00 H new ATOM 0 HG3 ARG A 8 7.711 -6.909 14.299 1.00 0.00 H new ATOM 0 HD2 ARG A 8 8.813 -9.215 15.955 1.00 0.00 H new ATOM 0 HD3 ARG A 8 7.834 -9.374 14.510 1.00 0.00 H new ATOM 0 HE ARG A 8 10.243 -7.779 14.067 1.00 0.00 H new ATOM 0 HH11 ARG A 8 8.895 -11.037 14.244 1.00 0.00 H new ATOM 0 HH12 ARG A 8 10.147 -11.736 13.212 1.00 0.00 H new ATOM 0 HH21 ARG A 8 11.847 -8.684 12.742 1.00 0.00 H new ATOM 0 HH22 ARG A 8 11.812 -10.410 12.366 1.00 0.00 H new ATOM 90 N MET A 9 8.776 -3.625 14.484 1.00 0.00 N ATOM 91 CA MET A 9 8.434 -2.884 13.275 1.00 0.00 C ATOM 92 C MET A 9 8.741 -3.708 12.029 1.00 0.00 C ATOM 93 O MET A 9 9.747 -4.416 11.972 1.00 0.00 O ATOM 94 CB MET A 9 9.200 -1.561 13.228 1.00 0.00 C ATOM 95 CG MET A 9 8.946 -0.669 14.432 1.00 0.00 C ATOM 96 SD MET A 9 7.504 0.393 14.219 1.00 0.00 S ATOM 97 CE MET A 9 6.182 -0.812 14.304 1.00 0.00 C ATOM 0 H MET A 9 9.741 -3.508 14.792 1.00 0.00 H new ATOM 0 HA MET A 9 7.365 -2.675 13.297 1.00 0.00 H new ATOM 0 HB2 MET A 9 10.267 -1.771 13.160 1.00 0.00 H new ATOM 0 HB3 MET A 9 8.923 -1.022 12.322 1.00 0.00 H new ATOM 0 HG2 MET A 9 8.807 -1.290 15.317 1.00 0.00 H new ATOM 0 HG3 MET A 9 9.825 -0.050 14.612 1.00 0.00 H new ATOM 0 HE1 MET A 9 5.273 -0.330 14.665 1.00 0.00 H new ATOM 0 HE2 MET A 9 6.003 -1.227 13.312 1.00 0.00 H new ATOM 0 HE3 MET A 9 6.464 -1.613 14.987 1.00 0.00 H new ATOM 107 N LEU A 10 7.869 -3.611 11.031 1.00 0.00 N ATOM 108 CA LEU A 10 8.047 -4.347 9.785 1.00 0.00 C ATOM 109 C LEU A 10 8.309 -3.395 8.623 1.00 0.00 C ATOM 110 O LEU A 10 7.474 -2.551 8.298 1.00 0.00 O ATOM 111 CB LEU A 10 6.811 -5.199 9.492 1.00 0.00 C ATOM 112 CG LEU A 10 6.398 -6.183 10.588 1.00 0.00 C ATOM 113 CD1 LEU A 10 5.018 -6.753 10.301 1.00 0.00 C ATOM 114 CD2 LEU A 10 7.424 -7.300 10.715 1.00 0.00 C ATOM 0 H LEU A 10 7.032 -3.030 11.061 1.00 0.00 H new ATOM 0 HA LEU A 10 8.912 -5.000 9.898 1.00 0.00 H new ATOM 0 HB2 LEU A 10 5.972 -4.531 9.296 1.00 0.00 H new ATOM 0 HB3 LEU A 10 6.991 -5.761 8.576 1.00 0.00 H new ATOM 0 HG LEU A 10 6.356 -5.646 11.536 1.00 0.00 H new ATOM 0 HD11 LEU A 10 4.741 -7.451 11.091 1.00 0.00 H new ATOM 0 HD12 LEU A 10 4.290 -5.942 10.261 1.00 0.00 H new ATOM 0 HD13 LEU A 10 5.032 -7.275 9.344 1.00 0.00 H new ATOM 0 HD21 LEU A 10 7.114 -7.991 11.499 1.00 0.00 H new ATOM 0 HD22 LEU A 10 7.498 -7.835 9.768 1.00 0.00 H new ATOM 0 HD23 LEU A 10 8.395 -6.875 10.969 1.00 0.00 H new ATOM 126 N ASP A 11 9.473 -3.538 7.998 1.00 0.00 N ATOM 127 CA ASP A 11 9.844 -2.693 6.870 1.00 0.00 C ATOM 128 C ASP A 11 9.148 -3.155 5.593 1.00 0.00 C ATOM 129 O ASP A 11 9.566 -4.126 4.962 1.00 0.00 O ATOM 130 CB ASP A 11 11.361 -2.707 6.672 1.00 0.00 C ATOM 131 CG ASP A 11 11.798 -1.869 5.486 1.00 0.00 C ATOM 132 OD1 ASP A 11 11.598 -2.316 4.338 1.00 0.00 O ATOM 133 OD2 ASP A 11 12.341 -0.766 5.707 1.00 0.00 O ATOM 0 H ASP A 11 10.176 -4.232 8.254 1.00 0.00 H new ATOM 0 HA ASP A 11 9.523 -1.675 7.090 1.00 0.00 H new ATOM 0 HB2 ASP A 11 11.846 -2.335 7.575 1.00 0.00 H new ATOM 0 HB3 ASP A 11 11.697 -3.734 6.531 1.00 0.00 H new ATOM 138 N PHE A 12 8.084 -2.453 5.219 1.00 0.00 N ATOM 139 CA PHE A 12 7.328 -2.792 4.018 1.00 0.00 C ATOM 140 C PHE A 12 7.729 -1.894 2.852 1.00 0.00 C ATOM 141 O PHE A 12 7.379 -0.714 2.814 1.00 0.00 O ATOM 142 CB PHE A 12 5.826 -2.664 4.282 1.00 0.00 C ATOM 143 CG PHE A 12 5.248 -3.831 5.031 1.00 0.00 C ATOM 144 CD1 PHE A 12 4.922 -5.003 4.368 1.00 0.00 C ATOM 145 CD2 PHE A 12 5.029 -3.755 6.397 1.00 0.00 C ATOM 146 CE1 PHE A 12 4.390 -6.079 5.053 1.00 0.00 C ATOM 147 CE2 PHE A 12 4.498 -4.828 7.087 1.00 0.00 C ATOM 148 CZ PHE A 12 4.177 -5.991 6.415 1.00 0.00 C ATOM 0 H PHE A 12 7.725 -1.646 5.730 1.00 0.00 H new ATOM 0 HA PHE A 12 7.557 -3.825 3.754 1.00 0.00 H new ATOM 0 HB2 PHE A 12 5.641 -1.751 4.848 1.00 0.00 H new ATOM 0 HB3 PHE A 12 5.305 -2.559 3.330 1.00 0.00 H new ATOM 0 HD1 PHE A 12 5.086 -5.077 3.303 1.00 0.00 H new ATOM 0 HD2 PHE A 12 5.276 -2.848 6.928 1.00 0.00 H new ATOM 0 HE1 PHE A 12 4.141 -6.987 4.524 1.00 0.00 H new ATOM 0 HE2 PHE A 12 4.334 -4.757 8.152 1.00 0.00 H new ATOM 0 HZ PHE A 12 3.760 -6.830 6.953 1.00 0.00 H new ATOM 158 N ARG A 13 8.466 -2.461 1.902 1.00 0.00 N ATOM 159 CA ARG A 13 8.916 -1.712 0.735 1.00 0.00 C ATOM 160 C ARG A 13 7.904 -1.817 -0.402 1.00 0.00 C ATOM 161 O ARG A 13 7.831 -2.835 -1.091 1.00 0.00 O ATOM 162 CB ARG A 13 10.279 -2.226 0.268 1.00 0.00 C ATOM 163 CG ARG A 13 10.954 -1.323 -0.751 1.00 0.00 C ATOM 164 CD ARG A 13 10.561 -1.695 -2.172 1.00 0.00 C ATOM 165 NE ARG A 13 11.253 -2.894 -2.636 1.00 0.00 N ATOM 166 CZ ARG A 13 12.507 -2.896 -3.075 1.00 0.00 C ATOM 167 NH1 ARG A 13 13.202 -1.768 -3.110 1.00 0.00 N ATOM 168 NH2 ARG A 13 13.068 -4.029 -3.480 1.00 0.00 N ATOM 0 H ARG A 13 8.764 -3.436 1.918 1.00 0.00 H new ATOM 0 HA ARG A 13 9.008 -0.664 1.020 1.00 0.00 H new ATOM 0 HB2 ARG A 13 10.933 -2.335 1.133 1.00 0.00 H new ATOM 0 HB3 ARG A 13 10.155 -3.219 -0.165 1.00 0.00 H new ATOM 0 HG2 ARG A 13 10.681 -0.286 -0.557 1.00 0.00 H new ATOM 0 HG3 ARG A 13 12.036 -1.394 -0.641 1.00 0.00 H new ATOM 0 HD2 ARG A 13 9.484 -1.857 -2.219 1.00 0.00 H new ATOM 0 HD3 ARG A 13 10.788 -0.864 -2.840 1.00 0.00 H new ATOM 0 HE ARG A 13 10.746 -3.779 -2.622 1.00 0.00 H new ATOM 0 HH11 ARG A 13 12.774 -0.896 -2.799 1.00 0.00 H new ATOM 0 HH12 ARG A 13 14.165 -1.772 -3.447 1.00 0.00 H new ATOM 0 HH21 ARG A 13 12.536 -4.899 -3.454 1.00 0.00 H new ATOM 0 HH22 ARG A 13 14.031 -4.029 -3.817 1.00 0.00 H new ATOM 182 N VAL A 14 7.124 -0.758 -0.592 1.00 0.00 N ATOM 183 CA VAL A 14 6.116 -0.730 -1.646 1.00 0.00 C ATOM 184 C VAL A 14 6.690 -0.166 -2.941 1.00 0.00 C ATOM 185 O VAL A 14 6.942 1.033 -3.048 1.00 0.00 O ATOM 186 CB VAL A 14 4.893 0.109 -1.231 1.00 0.00 C ATOM 187 CG1 VAL A 14 3.831 0.080 -2.319 1.00 0.00 C ATOM 188 CG2 VAL A 14 4.328 -0.390 0.091 1.00 0.00 C ATOM 0 H VAL A 14 7.170 0.092 -0.030 1.00 0.00 H new ATOM 0 HA VAL A 14 5.801 -1.761 -1.810 1.00 0.00 H new ATOM 0 HB VAL A 14 5.212 1.142 -1.096 1.00 0.00 H new ATOM 0 HG11 VAL A 14 2.975 0.678 -2.008 1.00 0.00 H new ATOM 0 HG12 VAL A 14 4.244 0.489 -3.241 1.00 0.00 H new ATOM 0 HG13 VAL A 14 3.512 -0.948 -2.489 1.00 0.00 H new ATOM 0 HG21 VAL A 14 3.464 0.214 0.369 1.00 0.00 H new ATOM 0 HG22 VAL A 14 4.024 -1.431 -0.013 1.00 0.00 H new ATOM 0 HG23 VAL A 14 5.091 -0.311 0.866 1.00 0.00 H new ATOM 198 N GLU A 15 6.893 -1.040 -3.922 1.00 0.00 N ATOM 199 CA GLU A 15 7.438 -0.629 -5.210 1.00 0.00 C ATOM 200 C GLU A 15 6.328 -0.153 -6.143 1.00 0.00 C ATOM 201 O GLU A 15 5.566 -0.958 -6.680 1.00 0.00 O ATOM 202 CB GLU A 15 8.204 -1.784 -5.858 1.00 0.00 C ATOM 203 CG GLU A 15 9.091 -1.354 -7.014 1.00 0.00 C ATOM 204 CD GLU A 15 9.635 -2.531 -7.801 1.00 0.00 C ATOM 205 OE1 GLU A 15 8.857 -3.152 -8.554 1.00 0.00 O ATOM 206 OE2 GLU A 15 10.839 -2.830 -7.662 1.00 0.00 O ATOM 0 H GLU A 15 6.688 -2.037 -3.849 1.00 0.00 H new ATOM 0 HA GLU A 15 8.124 0.200 -5.037 1.00 0.00 H new ATOM 0 HB2 GLU A 15 8.819 -2.271 -5.101 1.00 0.00 H new ATOM 0 HB3 GLU A 15 7.491 -2.527 -6.215 1.00 0.00 H new ATOM 0 HG2 GLU A 15 8.523 -0.707 -7.682 1.00 0.00 H new ATOM 0 HG3 GLU A 15 9.922 -0.764 -6.629 1.00 0.00 H new ATOM 213 N TYR A 16 6.243 1.159 -6.331 1.00 0.00 N ATOM 214 CA TYR A 16 5.225 1.743 -7.196 1.00 0.00 C ATOM 215 C TYR A 16 5.863 2.454 -8.386 1.00 0.00 C ATOM 216 O TYR A 16 6.960 3.003 -8.279 1.00 0.00 O ATOM 217 CB TYR A 16 4.356 2.724 -6.407 1.00 0.00 C ATOM 218 CG TYR A 16 3.351 3.464 -7.261 1.00 0.00 C ATOM 219 CD1 TYR A 16 2.459 2.776 -8.073 1.00 0.00 C ATOM 220 CD2 TYR A 16 3.293 4.853 -7.254 1.00 0.00 C ATOM 221 CE1 TYR A 16 1.539 3.448 -8.854 1.00 0.00 C ATOM 222 CE2 TYR A 16 2.376 5.533 -8.031 1.00 0.00 C ATOM 223 CZ TYR A 16 1.502 4.826 -8.830 1.00 0.00 C ATOM 224 OH TYR A 16 0.586 5.500 -9.606 1.00 0.00 O ATOM 0 H TYR A 16 6.867 1.839 -5.896 1.00 0.00 H new ATOM 0 HA TYR A 16 4.598 0.935 -7.573 1.00 0.00 H new ATOM 0 HB2 TYR A 16 3.826 2.180 -5.626 1.00 0.00 H new ATOM 0 HB3 TYR A 16 5.001 3.448 -5.909 1.00 0.00 H new ATOM 0 HD1 TYR A 16 2.485 1.697 -8.094 1.00 0.00 H new ATOM 0 HD2 TYR A 16 3.977 5.410 -6.630 1.00 0.00 H new ATOM 0 HE1 TYR A 16 0.853 2.897 -9.480 1.00 0.00 H new ATOM 0 HE2 TYR A 16 2.343 6.612 -8.013 1.00 0.00 H new ATOM 0 HH TYR A 16 0.691 6.465 -9.472 1.00 0.00 H new ATOM 234 N ARG A 17 5.168 2.439 -9.518 1.00 0.00 N ATOM 235 CA ARG A 17 5.666 3.081 -10.729 1.00 0.00 C ATOM 236 C ARG A 17 6.456 4.342 -10.390 1.00 0.00 C ATOM 237 O ARG A 17 7.638 4.452 -10.715 1.00 0.00 O ATOM 238 CB ARG A 17 4.504 3.430 -11.661 1.00 0.00 C ATOM 239 CG ARG A 17 3.772 2.214 -12.203 1.00 0.00 C ATOM 240 CD ARG A 17 2.680 2.612 -13.184 1.00 0.00 C ATOM 241 NE ARG A 17 3.197 2.779 -14.540 1.00 0.00 N ATOM 242 CZ ARG A 17 2.437 2.726 -15.628 1.00 0.00 C ATOM 243 NH1 ARG A 17 1.132 2.513 -15.520 1.00 0.00 N ATOM 244 NH2 ARG A 17 2.980 2.887 -16.828 1.00 0.00 N ATOM 0 H ARG A 17 4.258 1.989 -9.622 1.00 0.00 H new ATOM 0 HA ARG A 17 6.331 2.381 -11.234 1.00 0.00 H new ATOM 0 HB2 ARG A 17 3.795 4.061 -11.124 1.00 0.00 H new ATOM 0 HB3 ARG A 17 4.884 4.017 -12.497 1.00 0.00 H new ATOM 0 HG2 ARG A 17 4.482 1.551 -12.697 1.00 0.00 H new ATOM 0 HG3 ARG A 17 3.334 1.654 -11.377 1.00 0.00 H new ATOM 0 HD2 ARG A 17 1.899 1.852 -13.185 1.00 0.00 H new ATOM 0 HD3 ARG A 17 2.219 3.543 -12.855 1.00 0.00 H new ATOM 0 HE ARG A 17 4.196 2.945 -14.658 1.00 0.00 H new ATOM 0 HH11 ARG A 17 0.710 2.389 -14.600 1.00 0.00 H new ATOM 0 HH12 ARG A 17 0.551 2.473 -16.357 1.00 0.00 H new ATOM 0 HH21 ARG A 17 3.983 3.052 -16.916 1.00 0.00 H new ATOM 0 HH22 ARG A 17 2.395 2.846 -17.662 1.00 0.00 H new ATOM 258 N ASP A 18 5.795 5.290 -9.735 1.00 0.00 N ATOM 259 CA ASP A 18 6.436 6.542 -9.351 1.00 0.00 C ATOM 260 C ASP A 18 7.789 6.282 -8.695 1.00 0.00 C ATOM 261 O ASP A 18 8.827 6.707 -9.203 1.00 0.00 O ATOM 262 CB ASP A 18 5.536 7.329 -8.397 1.00 0.00 C ATOM 263 CG ASP A 18 5.784 8.823 -8.466 1.00 0.00 C ATOM 264 OD1 ASP A 18 5.906 9.352 -9.590 1.00 0.00 O ATOM 265 OD2 ASP A 18 5.857 9.463 -7.396 1.00 0.00 O ATOM 0 H ASP A 18 4.816 5.215 -9.459 1.00 0.00 H new ATOM 0 HA ASP A 18 6.598 7.130 -10.254 1.00 0.00 H new ATOM 0 HB2 ASP A 18 4.492 7.126 -8.636 1.00 0.00 H new ATOM 0 HB3 ASP A 18 5.702 6.983 -7.377 1.00 0.00 H new ATOM 270 N ARG A 19 7.768 5.583 -7.565 1.00 0.00 N ATOM 271 CA ARG A 19 8.993 5.269 -6.839 1.00 0.00 C ATOM 272 C ARG A 19 8.702 4.357 -5.651 1.00 0.00 C ATOM 273 O ARG A 19 7.560 4.247 -5.206 1.00 0.00 O ATOM 274 CB ARG A 19 9.669 6.554 -6.356 1.00 0.00 C ATOM 275 CG ARG A 19 8.943 7.227 -5.203 1.00 0.00 C ATOM 276 CD ARG A 19 9.744 8.394 -4.646 1.00 0.00 C ATOM 277 NE ARG A 19 9.793 9.518 -5.576 1.00 0.00 N ATOM 278 CZ ARG A 19 10.440 10.651 -5.326 1.00 0.00 C ATOM 279 NH1 ARG A 19 11.088 10.809 -4.180 1.00 0.00 N ATOM 280 NH2 ARG A 19 10.439 11.629 -6.223 1.00 0.00 N ATOM 0 H ARG A 19 6.917 5.224 -7.133 1.00 0.00 H new ATOM 0 HA ARG A 19 9.665 4.747 -7.520 1.00 0.00 H new ATOM 0 HB2 ARG A 19 10.689 6.324 -6.048 1.00 0.00 H new ATOM 0 HB3 ARG A 19 9.738 7.254 -7.189 1.00 0.00 H new ATOM 0 HG2 ARG A 19 7.969 7.581 -5.542 1.00 0.00 H new ATOM 0 HG3 ARG A 19 8.760 6.499 -4.412 1.00 0.00 H new ATOM 0 HD2 ARG A 19 9.301 8.721 -3.705 1.00 0.00 H new ATOM 0 HD3 ARG A 19 10.759 8.064 -4.423 1.00 0.00 H new ATOM 0 HE ARG A 19 9.304 9.429 -6.467 1.00 0.00 H new ATOM 0 HH11 ARG A 19 11.090 10.060 -3.488 1.00 0.00 H new ATOM 0 HH12 ARG A 19 11.584 11.680 -3.990 1.00 0.00 H new ATOM 0 HH21 ARG A 19 9.941 11.511 -7.105 1.00 0.00 H new ATOM 0 HH22 ARG A 19 10.936 12.499 -6.030 1.00 0.00 H new ATOM 294 N ASN A 20 9.743 3.705 -5.143 1.00 0.00 N ATOM 295 CA ASN A 20 9.598 2.802 -4.007 1.00 0.00 C ATOM 296 C ASN A 20 9.582 3.577 -2.694 1.00 0.00 C ATOM 297 O ASN A 20 10.475 4.380 -2.423 1.00 0.00 O ATOM 298 CB ASN A 20 10.736 1.779 -3.995 1.00 0.00 C ATOM 299 CG ASN A 20 12.101 2.431 -4.107 1.00 0.00 C ATOM 300 OD1 ASN A 20 12.403 3.097 -5.098 1.00 0.00 O ATOM 301 ND2 ASN A 20 12.933 2.242 -3.090 1.00 0.00 N ATOM 0 H ASN A 20 10.695 3.785 -5.500 1.00 0.00 H new ATOM 0 HA ASN A 20 8.648 2.278 -4.110 1.00 0.00 H new ATOM 0 HB2 ASN A 20 10.689 1.198 -3.074 1.00 0.00 H new ATOM 0 HB3 ASN A 20 10.601 1.080 -4.821 1.00 0.00 H new ATOM 0 HD21 ASN A 20 13.865 2.656 -3.110 1.00 0.00 H new ATOM 0 HD22 ASN A 20 12.640 1.683 -2.289 1.00 0.00 H new ATOM 308 N VAL A 21 8.560 3.331 -1.880 1.00 0.00 N ATOM 309 CA VAL A 21 8.427 4.005 -0.594 1.00 0.00 C ATOM 310 C VAL A 21 8.519 3.011 0.559 1.00 0.00 C ATOM 311 O VAL A 21 8.084 1.866 0.440 1.00 0.00 O ATOM 312 CB VAL A 21 7.093 4.768 -0.495 1.00 0.00 C ATOM 313 CG1 VAL A 21 5.932 3.796 -0.345 1.00 0.00 C ATOM 314 CG2 VAL A 21 7.127 5.752 0.664 1.00 0.00 C ATOM 0 H VAL A 21 7.812 2.670 -2.089 1.00 0.00 H new ATOM 0 HA VAL A 21 9.249 4.717 -0.523 1.00 0.00 H new ATOM 0 HB VAL A 21 6.948 5.332 -1.417 1.00 0.00 H new ATOM 0 HG11 VAL A 21 4.998 4.353 -0.277 1.00 0.00 H new ATOM 0 HG12 VAL A 21 5.897 3.134 -1.210 1.00 0.00 H new ATOM 0 HG13 VAL A 21 6.068 3.203 0.560 1.00 0.00 H new ATOM 0 HG21 VAL A 21 6.176 6.282 0.719 1.00 0.00 H new ATOM 0 HG22 VAL A 21 7.295 5.211 1.595 1.00 0.00 H new ATOM 0 HG23 VAL A 21 7.934 6.469 0.509 1.00 0.00 H new ATOM 324 N ASP A 22 9.087 3.458 1.673 1.00 0.00 N ATOM 325 CA ASP A 22 9.235 2.609 2.849 1.00 0.00 C ATOM 326 C ASP A 22 8.089 2.834 3.830 1.00 0.00 C ATOM 327 O ASP A 22 7.722 3.973 4.121 1.00 0.00 O ATOM 328 CB ASP A 22 10.573 2.882 3.538 1.00 0.00 C ATOM 329 CG ASP A 22 10.758 2.055 4.795 1.00 0.00 C ATOM 330 OD1 ASP A 22 10.149 0.968 4.885 1.00 0.00 O ATOM 331 OD2 ASP A 22 11.512 2.494 5.688 1.00 0.00 O ATOM 0 H ASP A 22 9.453 4.403 1.787 1.00 0.00 H new ATOM 0 HA ASP A 22 9.210 1.570 2.521 1.00 0.00 H new ATOM 0 HB2 ASP A 22 11.386 2.669 2.844 1.00 0.00 H new ATOM 0 HB3 ASP A 22 10.639 3.940 3.790 1.00 0.00 H new ATOM 336 N VAL A 23 7.527 1.742 4.337 1.00 0.00 N ATOM 337 CA VAL A 23 6.422 1.820 5.285 1.00 0.00 C ATOM 338 C VAL A 23 6.730 1.032 6.554 1.00 0.00 C ATOM 339 O VAL A 23 7.197 -0.105 6.493 1.00 0.00 O ATOM 340 CB VAL A 23 5.114 1.289 4.669 1.00 0.00 C ATOM 341 CG1 VAL A 23 3.947 1.511 5.619 1.00 0.00 C ATOM 342 CG2 VAL A 23 4.852 1.952 3.325 1.00 0.00 C ATOM 0 H VAL A 23 7.819 0.792 4.107 1.00 0.00 H new ATOM 0 HA VAL A 23 6.295 2.873 5.536 1.00 0.00 H new ATOM 0 HB VAL A 23 5.218 0.216 4.506 1.00 0.00 H new ATOM 0 HG11 VAL A 23 3.032 1.129 5.166 1.00 0.00 H new ATOM 0 HG12 VAL A 23 4.135 0.986 6.555 1.00 0.00 H new ATOM 0 HG13 VAL A 23 3.837 2.577 5.817 1.00 0.00 H new ATOM 0 HG21 VAL A 23 3.924 1.566 2.903 1.00 0.00 H new ATOM 0 HG22 VAL A 23 4.767 3.030 3.461 1.00 0.00 H new ATOM 0 HG23 VAL A 23 5.677 1.736 2.646 1.00 0.00 H new ATOM 352 N VAL A 24 6.464 1.645 7.703 1.00 0.00 N ATOM 353 CA VAL A 24 6.710 1.000 8.988 1.00 0.00 C ATOM 354 C VAL A 24 5.447 0.972 9.840 1.00 0.00 C ATOM 355 O VAL A 24 4.999 2.005 10.341 1.00 0.00 O ATOM 356 CB VAL A 24 7.828 1.716 9.769 1.00 0.00 C ATOM 357 CG1 VAL A 24 7.779 1.335 11.241 1.00 0.00 C ATOM 358 CG2 VAL A 24 9.188 1.391 9.171 1.00 0.00 C ATOM 0 H VAL A 24 6.078 2.587 7.771 1.00 0.00 H new ATOM 0 HA VAL A 24 7.023 -0.022 8.775 1.00 0.00 H new ATOM 0 HB VAL A 24 7.670 2.792 9.691 1.00 0.00 H new ATOM 0 HG11 VAL A 24 8.576 1.850 11.777 1.00 0.00 H new ATOM 0 HG12 VAL A 24 6.815 1.623 11.660 1.00 0.00 H new ATOM 0 HG13 VAL A 24 7.911 0.258 11.343 1.00 0.00 H new ATOM 0 HG21 VAL A 24 9.966 1.905 9.735 1.00 0.00 H new ATOM 0 HG22 VAL A 24 9.358 0.315 9.216 1.00 0.00 H new ATOM 0 HG23 VAL A 24 9.216 1.719 8.132 1.00 0.00 H new ATOM 368 N LEU A 25 4.876 -0.216 10.003 1.00 0.00 N ATOM 369 CA LEU A 25 3.663 -0.380 10.796 1.00 0.00 C ATOM 370 C LEU A 25 3.754 -1.619 11.681 1.00 0.00 C ATOM 371 O LEU A 25 4.201 -2.677 11.239 1.00 0.00 O ATOM 372 CB LEU A 25 2.441 -0.482 9.881 1.00 0.00 C ATOM 373 CG LEU A 25 2.240 -1.824 9.178 1.00 0.00 C ATOM 374 CD1 LEU A 25 0.919 -1.839 8.423 1.00 0.00 C ATOM 375 CD2 LEU A 25 3.398 -2.111 8.234 1.00 0.00 C ATOM 0 H LEU A 25 5.234 -1.080 9.596 1.00 0.00 H new ATOM 0 HA LEU A 25 3.557 0.495 11.437 1.00 0.00 H new ATOM 0 HB2 LEU A 25 1.551 -0.267 10.472 1.00 0.00 H new ATOM 0 HB3 LEU A 25 2.515 0.296 9.121 1.00 0.00 H new ATOM 0 HG LEU A 25 2.212 -2.608 9.935 1.00 0.00 H new ATOM 0 HD11 LEU A 25 0.793 -2.802 7.929 1.00 0.00 H new ATOM 0 HD12 LEU A 25 0.098 -1.680 9.123 1.00 0.00 H new ATOM 0 HD13 LEU A 25 0.918 -1.045 7.676 1.00 0.00 H new ATOM 0 HD21 LEU A 25 3.237 -3.071 7.742 1.00 0.00 H new ATOM 0 HD22 LEU A 25 3.458 -1.324 7.482 1.00 0.00 H new ATOM 0 HD23 LEU A 25 4.329 -2.144 8.800 1.00 0.00 H new ATOM 387 N GLU A 26 3.326 -1.479 12.932 1.00 0.00 N ATOM 388 CA GLU A 26 3.359 -2.588 13.878 1.00 0.00 C ATOM 389 C GLU A 26 2.532 -3.765 13.367 1.00 0.00 C ATOM 390 O GLU A 26 1.600 -3.587 12.582 1.00 0.00 O ATOM 391 CB GLU A 26 2.835 -2.139 15.244 1.00 0.00 C ATOM 392 CG GLU A 26 2.940 -3.208 16.318 1.00 0.00 C ATOM 393 CD GLU A 26 4.334 -3.308 16.907 1.00 0.00 C ATOM 394 OE1 GLU A 26 4.780 -2.333 17.547 1.00 0.00 O ATOM 395 OE2 GLU A 26 4.978 -4.363 16.728 1.00 0.00 O ATOM 0 H GLU A 26 2.953 -0.610 13.313 1.00 0.00 H new ATOM 0 HA GLU A 26 4.395 -2.911 13.982 1.00 0.00 H new ATOM 0 HB2 GLU A 26 3.391 -1.258 15.565 1.00 0.00 H new ATOM 0 HB3 GLU A 26 1.792 -1.839 15.143 1.00 0.00 H new ATOM 0 HG2 GLU A 26 2.228 -2.989 17.114 1.00 0.00 H new ATOM 0 HG3 GLU A 26 2.658 -4.172 15.895 1.00 0.00 H new ATOM 402 N ASP A 27 2.881 -4.965 13.816 1.00 0.00 N ATOM 403 CA ASP A 27 2.172 -6.171 13.405 1.00 0.00 C ATOM 404 C ASP A 27 0.717 -6.129 13.863 1.00 0.00 C ATOM 405 O ASP A 27 -0.085 -6.991 13.500 1.00 0.00 O ATOM 406 CB ASP A 27 2.862 -7.413 13.971 1.00 0.00 C ATOM 407 CG ASP A 27 2.761 -7.493 15.482 1.00 0.00 C ATOM 408 OD1 ASP A 27 1.629 -7.424 16.005 1.00 0.00 O ATOM 409 OD2 ASP A 27 3.814 -7.624 16.142 1.00 0.00 O ATOM 0 H ASP A 27 3.651 -5.129 14.465 1.00 0.00 H new ATOM 0 HA ASP A 27 2.190 -6.220 12.316 1.00 0.00 H new ATOM 0 HB2 ASP A 27 2.415 -8.305 13.532 1.00 0.00 H new ATOM 0 HB3 ASP A 27 3.912 -7.406 13.680 1.00 0.00 H new ATOM 414 N THR A 28 0.383 -5.122 14.663 1.00 0.00 N ATOM 415 CA THR A 28 -0.974 -4.968 15.173 1.00 0.00 C ATOM 416 C THR A 28 -1.890 -4.353 14.121 1.00 0.00 C ATOM 417 O THR A 28 -3.097 -4.599 14.115 1.00 0.00 O ATOM 418 CB THR A 28 -1.002 -4.092 16.439 1.00 0.00 C ATOM 419 OG1 THR A 28 -0.512 -2.780 16.138 1.00 0.00 O ATOM 420 CG2 THR A 28 -0.162 -4.711 17.545 1.00 0.00 C ATOM 0 H THR A 28 1.034 -4.400 14.972 1.00 0.00 H new ATOM 0 HA THR A 28 -1.333 -5.966 15.424 1.00 0.00 H new ATOM 0 HB THR A 28 -2.034 -4.024 16.784 1.00 0.00 H new ATOM 0 HG1 THR A 28 -0.535 -2.229 16.948 1.00 0.00 H new ATOM 0 HG21 THR A 28 -0.197 -4.074 18.429 1.00 0.00 H new ATOM 0 HG22 THR A 28 -0.556 -5.697 17.792 1.00 0.00 H new ATOM 0 HG23 THR A 28 0.870 -4.807 17.208 1.00 0.00 H new ATOM 428 N CYS A 29 -1.310 -3.552 13.234 1.00 0.00 N ATOM 429 CA CYS A 29 -2.075 -2.901 12.177 1.00 0.00 C ATOM 430 C CYS A 29 -2.633 -3.928 11.197 1.00 0.00 C ATOM 431 O CYS A 29 -2.084 -5.021 11.046 1.00 0.00 O ATOM 432 CB CYS A 29 -1.199 -1.892 11.433 1.00 0.00 C ATOM 433 SG CYS A 29 -1.114 -0.266 12.220 1.00 0.00 S ATOM 0 H CYS A 29 -0.313 -3.338 13.226 1.00 0.00 H new ATOM 0 HA CYS A 29 -2.911 -2.375 12.639 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -0.190 -2.296 11.348 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -1.581 -1.773 10.419 1.00 0.00 H new ATOM 0 HG CYS A 29 -0.349 0.516 11.518 1.00 0.00 H new ATOM 439 N THR A 30 -3.729 -3.572 10.534 1.00 0.00 N ATOM 440 CA THR A 30 -4.363 -4.463 9.571 1.00 0.00 C ATOM 441 C THR A 30 -3.744 -4.307 8.187 1.00 0.00 C ATOM 442 O THR A 30 -3.420 -3.198 7.762 1.00 0.00 O ATOM 443 CB THR A 30 -5.878 -4.201 9.476 1.00 0.00 C ATOM 444 OG1 THR A 30 -6.123 -2.800 9.314 1.00 0.00 O ATOM 445 CG2 THR A 30 -6.593 -4.706 10.720 1.00 0.00 C ATOM 0 H THR A 30 -4.196 -2.672 10.647 1.00 0.00 H new ATOM 0 HA THR A 30 -4.199 -5.480 9.926 1.00 0.00 H new ATOM 0 HB THR A 30 -6.265 -4.739 8.611 1.00 0.00 H new ATOM 0 HG1 THR A 30 -7.088 -2.642 9.253 1.00 0.00 H new ATOM 0 HG21 THR A 30 -7.661 -4.510 10.630 1.00 0.00 H new ATOM 0 HG22 THR A 30 -6.428 -5.778 10.824 1.00 0.00 H new ATOM 0 HG23 THR A 30 -6.202 -4.192 11.598 1.00 0.00 H new ATOM 453 N VAL A 31 -3.583 -5.426 7.486 1.00 0.00 N ATOM 454 CA VAL A 31 -3.004 -5.413 6.148 1.00 0.00 C ATOM 455 C VAL A 31 -3.596 -4.290 5.304 1.00 0.00 C ATOM 456 O VAL A 31 -2.958 -3.793 4.377 1.00 0.00 O ATOM 457 CB VAL A 31 -3.228 -6.755 5.427 1.00 0.00 C ATOM 458 CG1 VAL A 31 -2.520 -7.882 6.163 1.00 0.00 C ATOM 459 CG2 VAL A 31 -4.715 -7.046 5.293 1.00 0.00 C ATOM 0 H VAL A 31 -3.846 -6.352 7.823 1.00 0.00 H new ATOM 0 HA VAL A 31 -1.933 -5.248 6.268 1.00 0.00 H new ATOM 0 HB VAL A 31 -2.803 -6.685 4.426 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -2.690 -8.822 5.638 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -1.450 -7.676 6.201 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -2.912 -7.957 7.177 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -4.855 -7.998 4.781 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -5.167 -7.097 6.284 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -5.191 -6.252 4.718 1.00 0.00 H new ATOM 469 N GLY A 32 -4.822 -3.894 5.632 1.00 0.00 N ATOM 470 CA GLY A 32 -5.481 -2.831 4.895 1.00 0.00 C ATOM 471 C GLY A 32 -4.789 -1.493 5.063 1.00 0.00 C ATOM 472 O GLY A 32 -4.651 -0.734 4.105 1.00 0.00 O ATOM 0 H GLY A 32 -5.371 -4.290 6.395 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -5.510 -3.091 3.837 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -6.514 -2.747 5.231 1.00 0.00 H new ATOM 476 N GLU A 33 -4.353 -1.204 6.286 1.00 0.00 N ATOM 477 CA GLU A 33 -3.674 0.054 6.576 1.00 0.00 C ATOM 478 C GLU A 33 -2.662 0.390 5.484 1.00 0.00 C ATOM 479 O GLU A 33 -2.740 1.445 4.854 1.00 0.00 O ATOM 480 CB GLU A 33 -2.971 -0.022 7.933 1.00 0.00 C ATOM 481 CG GLU A 33 -3.891 0.254 9.111 1.00 0.00 C ATOM 482 CD GLU A 33 -4.180 1.732 9.291 1.00 0.00 C ATOM 483 OE1 GLU A 33 -4.390 2.424 8.274 1.00 0.00 O ATOM 484 OE2 GLU A 33 -4.196 2.195 10.451 1.00 0.00 O ATOM 0 H GLU A 33 -4.458 -1.823 7.090 1.00 0.00 H new ATOM 0 HA GLU A 33 -4.424 0.844 6.607 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -2.532 -1.013 8.050 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -2.150 0.695 7.948 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -4.830 -0.281 8.967 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -3.437 -0.137 10.021 1.00 0.00 H new ATOM 491 N ILE A 34 -1.712 -0.515 5.268 1.00 0.00 N ATOM 492 CA ILE A 34 -0.685 -0.315 4.253 1.00 0.00 C ATOM 493 C ILE A 34 -1.241 0.436 3.048 1.00 0.00 C ATOM 494 O ILE A 34 -0.555 1.262 2.446 1.00 0.00 O ATOM 495 CB ILE A 34 -0.093 -1.655 3.780 1.00 0.00 C ATOM 496 CG1 ILE A 34 0.449 -2.448 4.972 1.00 0.00 C ATOM 497 CG2 ILE A 34 1.004 -1.417 2.753 1.00 0.00 C ATOM 498 CD1 ILE A 34 1.087 -3.763 4.583 1.00 0.00 C ATOM 0 H ILE A 34 -1.633 -1.393 5.782 1.00 0.00 H new ATOM 0 HA ILE A 34 0.104 0.279 4.715 1.00 0.00 H new ATOM 0 HB ILE A 34 -0.884 -2.238 3.309 1.00 0.00 H new ATOM 0 HG12 ILE A 34 1.183 -1.839 5.499 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -0.365 -2.641 5.670 1.00 0.00 H new ATOM 0 HG21 ILE A 34 1.412 -2.374 2.428 1.00 0.00 H new ATOM 0 HG22 ILE A 34 0.590 -0.889 1.894 1.00 0.00 H new ATOM 0 HG23 ILE A 34 1.797 -0.817 3.200 1.00 0.00 H new ATOM 0 HD11 ILE A 34 1.448 -4.271 5.477 1.00 0.00 H new ATOM 0 HD12 ILE A 34 0.350 -4.391 4.082 1.00 0.00 H new ATOM 0 HD13 ILE A 34 1.923 -3.576 3.909 1.00 0.00 H new ATOM 510 N LYS A 35 -2.490 0.145 2.702 1.00 0.00 N ATOM 511 CA LYS A 35 -3.142 0.793 1.570 1.00 0.00 C ATOM 512 C LYS A 35 -3.366 2.276 1.849 1.00 0.00 C ATOM 513 O LYS A 35 -2.744 3.135 1.224 1.00 0.00 O ATOM 514 CB LYS A 35 -4.479 0.113 1.266 1.00 0.00 C ATOM 515 CG LYS A 35 -4.362 -1.385 1.043 1.00 0.00 C ATOM 516 CD LYS A 35 -5.473 -1.903 0.145 1.00 0.00 C ATOM 517 CE LYS A 35 -5.054 -1.903 -1.317 1.00 0.00 C ATOM 518 NZ LYS A 35 -5.417 -0.630 -1.998 1.00 0.00 N ATOM 0 H LYS A 35 -3.072 -0.536 3.190 1.00 0.00 H new ATOM 0 HA LYS A 35 -2.488 0.698 0.703 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -5.167 0.296 2.092 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -4.917 0.571 0.379 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -3.395 -1.613 0.595 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -4.398 -1.901 2.003 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -5.744 -2.915 0.447 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -6.362 -1.284 0.270 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -3.977 -2.058 -1.386 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -5.530 -2.738 -1.831 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -5.353 -0.757 -3.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -6.389 -0.364 -1.742 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -4.763 0.122 -1.700 1.00 0.00 H new ATOM 532 N GLN A 36 -4.258 2.569 2.790 1.00 0.00 N ATOM 533 CA GLN A 36 -4.562 3.948 3.151 1.00 0.00 C ATOM 534 C GLN A 36 -3.285 4.729 3.445 1.00 0.00 C ATOM 535 O GLN A 36 -3.187 5.917 3.135 1.00 0.00 O ATOM 536 CB GLN A 36 -5.489 3.987 4.367 1.00 0.00 C ATOM 537 CG GLN A 36 -5.990 5.382 4.706 1.00 0.00 C ATOM 538 CD GLN A 36 -6.669 6.060 3.532 1.00 0.00 C ATOM 539 OE1 GLN A 36 -6.059 6.866 2.829 1.00 0.00 O ATOM 540 NE2 GLN A 36 -7.938 5.735 3.313 1.00 0.00 N ATOM 0 H GLN A 36 -4.782 1.870 3.316 1.00 0.00 H new ATOM 0 HA GLN A 36 -5.065 4.415 2.304 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -6.345 3.338 4.182 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -4.961 3.580 5.229 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -6.690 5.320 5.539 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -5.152 5.994 5.039 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -8.404 5.062 3.921 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -8.446 6.158 2.537 1.00 0.00 H new ATOM 549 N ILE A 37 -2.310 4.054 4.044 1.00 0.00 N ATOM 550 CA ILE A 37 -1.039 4.684 4.379 1.00 0.00 C ATOM 551 C ILE A 37 -0.310 5.152 3.124 1.00 0.00 C ATOM 552 O ILE A 37 0.213 6.266 3.075 1.00 0.00 O ATOM 553 CB ILE A 37 -0.125 3.726 5.163 1.00 0.00 C ATOM 554 CG1 ILE A 37 -0.737 3.404 6.528 1.00 0.00 C ATOM 555 CG2 ILE A 37 1.261 4.332 5.328 1.00 0.00 C ATOM 556 CD1 ILE A 37 -0.132 2.187 7.191 1.00 0.00 C ATOM 0 H ILE A 37 -2.376 3.071 4.307 1.00 0.00 H new ATOM 0 HA ILE A 37 -1.270 5.546 5.005 1.00 0.00 H new ATOM 0 HB ILE A 37 -0.030 2.797 4.600 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -0.612 4.265 7.185 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -1.809 3.247 6.408 1.00 0.00 H new ATOM 0 HG21 ILE A 37 1.896 3.642 5.885 1.00 0.00 H new ATOM 0 HG22 ILE A 37 1.697 4.515 4.346 1.00 0.00 H new ATOM 0 HG23 ILE A 37 1.184 5.274 5.872 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -0.615 2.020 8.154 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -0.280 1.315 6.554 1.00 0.00 H new ATOM 0 HD13 ILE A 37 0.935 2.348 7.343 1.00 0.00 H new ATOM 568 N LEU A 38 -0.281 4.294 2.109 1.00 0.00 N ATOM 569 CA LEU A 38 0.383 4.620 0.852 1.00 0.00 C ATOM 570 C LEU A 38 -0.218 5.875 0.228 1.00 0.00 C ATOM 571 O LEU A 38 0.411 6.527 -0.605 1.00 0.00 O ATOM 572 CB LEU A 38 0.271 3.447 -0.125 1.00 0.00 C ATOM 573 CG LEU A 38 1.226 2.278 0.117 1.00 0.00 C ATOM 574 CD1 LEU A 38 0.891 1.116 -0.804 1.00 0.00 C ATOM 575 CD2 LEU A 38 2.669 2.720 -0.081 1.00 0.00 C ATOM 0 H LEU A 38 -0.709 3.369 2.132 1.00 0.00 H new ATOM 0 HA LEU A 38 1.435 4.810 1.064 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -0.751 3.068 -0.091 1.00 0.00 H new ATOM 0 HB3 LEU A 38 0.438 3.824 -1.134 1.00 0.00 H new ATOM 0 HG LEU A 38 1.107 1.943 1.147 1.00 0.00 H new ATOM 0 HD11 LEU A 38 1.581 0.293 -0.617 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -0.130 0.784 -0.614 1.00 0.00 H new ATOM 0 HD13 LEU A 38 0.981 1.437 -1.842 1.00 0.00 H new ATOM 0 HD21 LEU A 38 3.336 1.876 0.095 1.00 0.00 H new ATOM 0 HD22 LEU A 38 2.802 3.081 -1.101 1.00 0.00 H new ATOM 0 HD23 LEU A 38 2.904 3.520 0.621 1.00 0.00 H new ATOM 587 N GLU A 39 -1.437 6.209 0.639 1.00 0.00 N ATOM 588 CA GLU A 39 -2.121 7.388 0.120 1.00 0.00 C ATOM 589 C GLU A 39 -1.629 8.653 0.817 1.00 0.00 C ATOM 590 O GLU A 39 -1.794 9.759 0.306 1.00 0.00 O ATOM 591 CB GLU A 39 -3.634 7.248 0.302 1.00 0.00 C ATOM 592 CG GLU A 39 -4.425 8.419 -0.256 1.00 0.00 C ATOM 593 CD GLU A 39 -5.900 8.344 0.088 1.00 0.00 C ATOM 594 OE1 GLU A 39 -6.459 7.227 0.058 1.00 0.00 O ATOM 595 OE2 GLU A 39 -6.495 9.400 0.386 1.00 0.00 O ATOM 0 H GLU A 39 -1.971 5.681 1.329 1.00 0.00 H new ATOM 0 HA GLU A 39 -1.896 7.469 -0.943 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -3.967 6.331 -0.184 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -3.856 7.144 1.364 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -4.012 9.350 0.133 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -4.309 8.447 -1.339 1.00 0.00 H new ATOM 602 N ASN A 40 -1.025 8.479 1.988 1.00 0.00 N ATOM 603 CA ASN A 40 -0.510 9.606 2.757 1.00 0.00 C ATOM 604 C ASN A 40 0.941 9.899 2.387 1.00 0.00 C ATOM 605 O ASN A 40 1.518 10.890 2.835 1.00 0.00 O ATOM 606 CB ASN A 40 -0.617 9.320 4.256 1.00 0.00 C ATOM 607 CG ASN A 40 -2.046 9.399 4.759 1.00 0.00 C ATOM 608 OD1 ASN A 40 -2.772 10.344 4.452 1.00 0.00 O ATOM 609 ND2 ASN A 40 -2.455 8.403 5.536 1.00 0.00 N ATOM 0 H ASN A 40 -0.880 7.569 2.425 1.00 0.00 H new ATOM 0 HA ASN A 40 -1.112 10.482 2.517 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -0.216 8.328 4.463 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -0.002 10.034 4.804 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -3.406 8.401 5.904 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -1.818 7.640 5.764 1.00 0.00 H new ATOM 616 N GLU A 41 1.524 9.031 1.566 1.00 0.00 N ATOM 617 CA GLU A 41 2.907 9.197 1.136 1.00 0.00 C ATOM 618 C GLU A 41 2.999 9.265 -0.386 1.00 0.00 C ATOM 619 O GLU A 41 3.833 9.985 -0.937 1.00 0.00 O ATOM 620 CB GLU A 41 3.769 8.047 1.659 1.00 0.00 C ATOM 621 CG GLU A 41 3.780 7.935 3.175 1.00 0.00 C ATOM 622 CD GLU A 41 4.672 8.971 3.830 1.00 0.00 C ATOM 623 OE1 GLU A 41 4.389 10.178 3.682 1.00 0.00 O ATOM 624 OE2 GLU A 41 5.655 8.574 4.491 1.00 0.00 O ATOM 0 H GLU A 41 1.060 8.206 1.186 1.00 0.00 H new ATOM 0 HA GLU A 41 3.278 10.136 1.548 1.00 0.00 H new ATOM 0 HB2 GLU A 41 3.405 7.110 1.237 1.00 0.00 H new ATOM 0 HB3 GLU A 41 4.791 8.181 1.306 1.00 0.00 H new ATOM 0 HG2 GLU A 41 2.763 8.047 3.551 1.00 0.00 H new ATOM 0 HG3 GLU A 41 4.118 6.938 3.459 1.00 0.00 H new ATOM 631 N LEU A 42 2.138 8.510 -1.059 1.00 0.00 N ATOM 632 CA LEU A 42 2.121 8.483 -2.517 1.00 0.00 C ATOM 633 C LEU A 42 0.959 9.306 -3.064 1.00 0.00 C ATOM 634 O LEU A 42 0.882 9.566 -4.265 1.00 0.00 O ATOM 635 CB LEU A 42 2.020 7.041 -3.019 1.00 0.00 C ATOM 636 CG LEU A 42 3.103 6.081 -2.524 1.00 0.00 C ATOM 637 CD1 LEU A 42 2.776 4.653 -2.931 1.00 0.00 C ATOM 638 CD2 LEU A 42 4.466 6.492 -3.060 1.00 0.00 C ATOM 0 H LEU A 42 1.442 7.908 -0.618 1.00 0.00 H new ATOM 0 HA LEU A 42 3.053 8.922 -2.874 1.00 0.00 H new ATOM 0 HB2 LEU A 42 1.048 6.643 -2.727 1.00 0.00 H new ATOM 0 HB3 LEU A 42 2.044 7.054 -4.109 1.00 0.00 H new ATOM 0 HG LEU A 42 3.134 6.129 -1.435 1.00 0.00 H new ATOM 0 HD11 LEU A 42 3.557 3.984 -2.570 1.00 0.00 H new ATOM 0 HD12 LEU A 42 1.820 4.361 -2.497 1.00 0.00 H new ATOM 0 HD13 LEU A 42 2.716 4.589 -4.017 1.00 0.00 H new ATOM 0 HD21 LEU A 42 5.224 5.798 -2.697 1.00 0.00 H new ATOM 0 HD22 LEU A 42 4.449 6.474 -4.150 1.00 0.00 H new ATOM 0 HD23 LEU A 42 4.703 7.499 -2.717 1.00 0.00 H new ATOM 650 N GLN A 43 0.060 9.714 -2.175 1.00 0.00 N ATOM 651 CA GLN A 43 -1.097 10.510 -2.569 1.00 0.00 C ATOM 652 C GLN A 43 -1.997 9.727 -3.519 1.00 0.00 C ATOM 653 O GLN A 43 -2.737 10.312 -4.311 1.00 0.00 O ATOM 654 CB GLN A 43 -0.645 11.812 -3.232 1.00 0.00 C ATOM 655 CG GLN A 43 0.523 12.481 -2.525 1.00 0.00 C ATOM 656 CD GLN A 43 0.375 12.471 -1.017 1.00 0.00 C ATOM 657 OE1 GLN A 43 0.941 11.457 -0.373 1.00 0.00 O flip ATOM 658 NE2 GLN A 43 -0.240 13.366 -0.436 1.00 0.00 N flip ATOM 0 H GLN A 43 0.110 9.507 -1.177 1.00 0.00 H new ATOM 0 HA GLN A 43 -1.667 10.747 -1.671 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -0.364 11.606 -4.265 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -1.486 12.505 -3.263 1.00 0.00 H new ATOM 0 HG2 GLN A 43 1.448 11.973 -2.799 1.00 0.00 H new ATOM 0 HG3 GLN A 43 0.611 13.511 -2.871 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -0.659 14.127 -0.971 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -0.330 13.347 0.580 1.00 0.00 H new ATOM 667 N ILE A 44 -1.928 8.403 -3.436 1.00 0.00 N ATOM 668 CA ILE A 44 -2.738 7.541 -4.288 1.00 0.00 C ATOM 669 C ILE A 44 -3.939 6.988 -3.528 1.00 0.00 C ATOM 670 O ILE A 44 -3.834 6.557 -2.380 1.00 0.00 O ATOM 671 CB ILE A 44 -1.913 6.366 -4.846 1.00 0.00 C ATOM 672 CG1 ILE A 44 -0.583 6.871 -5.410 1.00 0.00 C ATOM 673 CG2 ILE A 44 -2.702 5.627 -5.917 1.00 0.00 C ATOM 674 CD1 ILE A 44 0.315 5.766 -5.921 1.00 0.00 C ATOM 0 H ILE A 44 -1.320 7.904 -2.787 1.00 0.00 H new ATOM 0 HA ILE A 44 -3.088 8.156 -5.117 1.00 0.00 H new ATOM 0 HB ILE A 44 -1.701 5.671 -4.033 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -0.784 7.570 -6.222 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -0.056 7.427 -4.634 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -2.106 4.799 -6.302 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -3.625 5.240 -5.486 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -2.940 6.312 -6.731 1.00 0.00 H new ATOM 0 HD11 ILE A 44 1.239 6.197 -6.306 1.00 0.00 H new ATOM 0 HD12 ILE A 44 0.546 5.079 -5.107 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -0.193 5.224 -6.719 1.00 0.00 H new ATOM 686 N PRO A 45 -5.109 6.999 -4.183 1.00 0.00 N ATOM 687 CA PRO A 45 -6.353 6.500 -3.589 1.00 0.00 C ATOM 688 C PRO A 45 -6.349 4.985 -3.423 1.00 0.00 C ATOM 689 O PRO A 45 -5.956 4.251 -4.330 1.00 0.00 O ATOM 690 CB PRO A 45 -7.423 6.924 -4.599 1.00 0.00 C ATOM 691 CG PRO A 45 -6.698 7.036 -5.895 1.00 0.00 C ATOM 692 CD PRO A 45 -5.308 7.499 -5.554 1.00 0.00 C ATOM 0 HA PRO A 45 -6.513 6.895 -2.586 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -8.226 6.189 -4.657 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -7.879 7.873 -4.317 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -6.674 6.077 -6.413 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -7.193 7.744 -6.559 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -4.568 7.090 -6.242 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -5.223 8.585 -5.602 1.00 0.00 H new ATOM 700 N VAL A 46 -6.789 4.521 -2.257 1.00 0.00 N ATOM 701 CA VAL A 46 -6.837 3.092 -1.972 1.00 0.00 C ATOM 702 C VAL A 46 -7.714 2.359 -2.982 1.00 0.00 C ATOM 703 O VAL A 46 -7.591 1.148 -3.162 1.00 0.00 O ATOM 704 CB VAL A 46 -7.370 2.820 -0.553 1.00 0.00 C ATOM 705 CG1 VAL A 46 -7.513 1.325 -0.313 1.00 0.00 C ATOM 706 CG2 VAL A 46 -6.458 3.451 0.488 1.00 0.00 C ATOM 0 H VAL A 46 -7.117 5.114 -1.495 1.00 0.00 H new ATOM 0 HA VAL A 46 -5.815 2.720 -2.045 1.00 0.00 H new ATOM 0 HB VAL A 46 -8.357 3.274 -0.461 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -7.891 1.153 0.695 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -8.210 0.905 -1.038 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -6.541 0.844 -0.423 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -6.850 3.249 1.485 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -5.457 3.029 0.399 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -6.413 4.528 0.327 1.00 0.00 H new ATOM 716 N SER A 47 -8.599 3.103 -3.638 1.00 0.00 N ATOM 717 CA SER A 47 -9.500 2.523 -4.627 1.00 0.00 C ATOM 718 C SER A 47 -8.743 2.152 -5.899 1.00 0.00 C ATOM 719 O SER A 47 -9.005 1.116 -6.511 1.00 0.00 O ATOM 720 CB SER A 47 -10.626 3.505 -4.959 1.00 0.00 C ATOM 721 OG SER A 47 -11.659 2.867 -5.689 1.00 0.00 O ATOM 0 H SER A 47 -8.711 4.108 -3.503 1.00 0.00 H new ATOM 0 HA SER A 47 -9.931 1.616 -4.203 1.00 0.00 H new ATOM 0 HB2 SER A 47 -11.032 3.923 -4.038 1.00 0.00 H new ATOM 0 HB3 SER A 47 -10.228 4.338 -5.538 1.00 0.00 H new ATOM 0 HG SER A 47 -12.367 3.515 -5.888 1.00 0.00 H new ATOM 727 N LYS A 48 -7.802 3.004 -6.290 1.00 0.00 N ATOM 728 CA LYS A 48 -7.004 2.767 -7.488 1.00 0.00 C ATOM 729 C LYS A 48 -5.822 1.854 -7.182 1.00 0.00 C ATOM 730 O LYS A 48 -5.268 1.219 -8.079 1.00 0.00 O ATOM 731 CB LYS A 48 -6.502 4.094 -8.062 1.00 0.00 C ATOM 732 CG LYS A 48 -7.612 5.090 -8.350 1.00 0.00 C ATOM 733 CD LYS A 48 -8.209 4.877 -9.731 1.00 0.00 C ATOM 734 CE LYS A 48 -9.347 5.849 -10.003 1.00 0.00 C ATOM 735 NZ LYS A 48 -8.860 7.115 -10.617 1.00 0.00 N ATOM 0 H LYS A 48 -7.573 3.866 -5.795 1.00 0.00 H new ATOM 0 HA LYS A 48 -7.638 2.276 -8.226 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -5.797 4.541 -7.360 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -5.953 3.898 -8.983 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -8.393 4.993 -7.596 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -7.220 6.104 -8.275 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -7.434 5.002 -10.487 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -8.575 3.854 -9.816 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -10.074 5.380 -10.666 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -9.864 6.073 -9.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -9.665 7.751 -10.787 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -8.185 7.576 -9.974 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -8.389 6.904 -11.520 1.00 0.00 H new ATOM 749 N MET A 49 -5.441 1.792 -5.910 1.00 0.00 N ATOM 750 CA MET A 49 -4.326 0.954 -5.486 1.00 0.00 C ATOM 751 C MET A 49 -4.787 -0.478 -5.233 1.00 0.00 C ATOM 752 O MET A 49 -5.909 -0.708 -4.778 1.00 0.00 O ATOM 753 CB MET A 49 -3.681 1.525 -4.222 1.00 0.00 C ATOM 754 CG MET A 49 -2.992 2.862 -4.443 1.00 0.00 C ATOM 755 SD MET A 49 -1.591 3.112 -3.335 1.00 0.00 S ATOM 756 CE MET A 49 -2.373 4.012 -1.998 1.00 0.00 C ATOM 0 H MET A 49 -5.888 2.312 -5.155 1.00 0.00 H new ATOM 0 HA MET A 49 -3.588 0.943 -6.288 1.00 0.00 H new ATOM 0 HB2 MET A 49 -4.446 1.642 -3.455 1.00 0.00 H new ATOM 0 HB3 MET A 49 -2.953 0.809 -3.840 1.00 0.00 H new ATOM 0 HG2 MET A 49 -2.649 2.923 -5.476 1.00 0.00 H new ATOM 0 HG3 MET A 49 -3.713 3.666 -4.298 1.00 0.00 H new ATOM 0 HE1 MET A 49 -1.780 4.894 -1.758 1.00 0.00 H new ATOM 0 HE2 MET A 49 -3.374 4.319 -2.302 1.00 0.00 H new ATOM 0 HE3 MET A 49 -2.442 3.371 -1.119 1.00 0.00 H new ATOM 766 N LEU A 50 -3.917 -1.437 -5.529 1.00 0.00 N ATOM 767 CA LEU A 50 -4.235 -2.847 -5.334 1.00 0.00 C ATOM 768 C LEU A 50 -3.086 -3.574 -4.643 1.00 0.00 C ATOM 769 O LEU A 50 -2.043 -3.826 -5.248 1.00 0.00 O ATOM 770 CB LEU A 50 -4.541 -3.512 -6.677 1.00 0.00 C ATOM 771 CG LEU A 50 -5.637 -2.856 -7.516 1.00 0.00 C ATOM 772 CD1 LEU A 50 -5.516 -3.275 -8.973 1.00 0.00 C ATOM 773 CD2 LEU A 50 -7.012 -3.212 -6.970 1.00 0.00 C ATOM 0 H LEU A 50 -2.985 -1.264 -5.905 1.00 0.00 H new ATOM 0 HA LEU A 50 -5.116 -2.910 -4.696 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -3.624 -3.534 -7.266 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -4.825 -4.548 -6.491 1.00 0.00 H new ATOM 0 HG LEU A 50 -5.514 -1.775 -7.458 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -6.305 -2.798 -9.555 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -4.544 -2.969 -9.360 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -5.613 -4.358 -9.049 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -7.780 -2.736 -7.580 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -7.145 -4.293 -6.997 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -7.097 -2.862 -5.941 1.00 0.00 H new ATOM 785 N LEU A 51 -3.284 -3.911 -3.373 1.00 0.00 N ATOM 786 CA LEU A 51 -2.265 -4.612 -2.599 1.00 0.00 C ATOM 787 C LEU A 51 -2.016 -6.006 -3.165 1.00 0.00 C ATOM 788 O LEU A 51 -2.952 -6.773 -3.392 1.00 0.00 O ATOM 789 CB LEU A 51 -2.689 -4.712 -1.133 1.00 0.00 C ATOM 790 CG LEU A 51 -1.556 -4.726 -0.106 1.00 0.00 C ATOM 791 CD1 LEU A 51 -0.506 -5.760 -0.484 1.00 0.00 C ATOM 792 CD2 LEU A 51 -0.928 -3.345 0.014 1.00 0.00 C ATOM 0 H LEU A 51 -4.141 -3.710 -2.857 1.00 0.00 H new ATOM 0 HA LEU A 51 -1.338 -4.042 -2.664 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -3.346 -3.872 -0.908 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -3.278 -5.621 -1.007 1.00 0.00 H new ATOM 0 HG LEU A 51 -1.973 -4.999 0.863 1.00 0.00 H new ATOM 0 HD11 LEU A 51 0.292 -5.756 0.258 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -0.964 -6.748 -0.518 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -0.093 -5.518 -1.463 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -0.124 -3.374 0.749 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -0.525 -3.043 -0.953 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -1.685 -2.628 0.332 1.00 0.00 H new ATOM 804 N LYS A 52 -0.747 -6.330 -3.388 1.00 0.00 N ATOM 805 CA LYS A 52 -0.372 -7.634 -3.924 1.00 0.00 C ATOM 806 C LYS A 52 1.067 -7.979 -3.558 1.00 0.00 C ATOM 807 O LYS A 52 1.823 -7.125 -3.097 1.00 0.00 O ATOM 808 CB LYS A 52 -0.541 -7.651 -5.445 1.00 0.00 C ATOM 809 CG LYS A 52 -1.985 -7.514 -5.898 1.00 0.00 C ATOM 810 CD LYS A 52 -2.094 -7.502 -7.413 1.00 0.00 C ATOM 811 CE LYS A 52 -3.495 -7.875 -7.874 1.00 0.00 C ATOM 812 NZ LYS A 52 -3.836 -9.283 -7.527 1.00 0.00 N ATOM 0 H LYS A 52 0.040 -5.707 -3.206 1.00 0.00 H new ATOM 0 HA LYS A 52 -1.030 -8.383 -3.483 1.00 0.00 H new ATOM 0 HB2 LYS A 52 0.045 -6.839 -5.876 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -0.133 -8.582 -5.837 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -2.573 -8.339 -5.496 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -2.408 -6.594 -5.494 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -1.838 -6.512 -7.789 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -1.372 -8.201 -7.836 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -4.220 -7.202 -7.415 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -3.571 -7.738 -8.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -4.562 -9.636 -8.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -2.984 -9.875 -7.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -4.200 -9.322 -6.554 1.00 0.00 H new ATOM 826 N GLY A 53 1.442 -9.238 -3.768 1.00 0.00 N ATOM 827 CA GLY A 53 2.790 -9.673 -3.456 1.00 0.00 C ATOM 828 C GLY A 53 2.826 -10.694 -2.336 1.00 0.00 C ATOM 829 O GLY A 53 3.766 -11.483 -2.237 1.00 0.00 O ATOM 0 H GLY A 53 0.835 -9.964 -4.149 1.00 0.00 H new ATOM 0 HA2 GLY A 53 3.246 -10.101 -4.349 1.00 0.00 H new ATOM 0 HA3 GLY A 53 3.391 -8.809 -3.175 1.00 0.00 H new ATOM 833 N TRP A 54 1.801 -10.679 -1.492 1.00 0.00 N ATOM 834 CA TRP A 54 1.720 -11.611 -0.373 1.00 0.00 C ATOM 835 C TRP A 54 2.230 -12.990 -0.775 1.00 0.00 C ATOM 836 O TRP A 54 2.186 -13.363 -1.947 1.00 0.00 O ATOM 837 CB TRP A 54 0.278 -11.713 0.129 1.00 0.00 C ATOM 838 CG TRP A 54 -0.302 -10.394 0.540 1.00 0.00 C ATOM 839 CD1 TRP A 54 -1.286 -9.696 -0.100 1.00 0.00 C ATOM 840 CD2 TRP A 54 0.067 -9.614 1.683 1.00 0.00 C ATOM 841 NE1 TRP A 54 -1.551 -8.529 0.576 1.00 0.00 N ATOM 842 CE2 TRP A 54 -0.735 -8.456 1.673 1.00 0.00 C ATOM 843 CE3 TRP A 54 0.994 -9.783 2.715 1.00 0.00 C ATOM 844 CZ2 TRP A 54 -0.634 -7.473 2.655 1.00 0.00 C ATOM 845 CZ3 TRP A 54 1.094 -8.806 3.687 1.00 0.00 C ATOM 846 CH2 TRP A 54 0.283 -7.664 3.652 1.00 0.00 C ATOM 0 H TRP A 54 1.015 -10.033 -1.561 1.00 0.00 H new ATOM 0 HA TRP A 54 2.351 -11.231 0.430 1.00 0.00 H new ATOM 0 HB2 TRP A 54 -0.343 -12.146 -0.656 1.00 0.00 H new ATOM 0 HB3 TRP A 54 0.243 -12.397 0.977 1.00 0.00 H new ATOM 0 HD1 TRP A 54 -1.783 -10.014 -1.005 1.00 0.00 H new ATOM 0 HE1 TRP A 54 -2.243 -7.831 0.305 1.00 0.00 H new ATOM 0 HE3 TRP A 54 1.621 -10.662 2.752 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 -1.257 -6.592 2.630 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 1.809 -8.925 4.487 1.00 0.00 H new ATOM 0 HH2 TRP A 54 0.384 -6.919 4.428 1.00 0.00 H new ATOM 857 N LYS A 55 2.715 -13.746 0.205 1.00 0.00 N ATOM 858 CA LYS A 55 3.232 -15.086 -0.045 1.00 0.00 C ATOM 859 C LYS A 55 2.094 -16.089 -0.196 1.00 0.00 C ATOM 860 O LYS A 55 2.064 -16.874 -1.145 1.00 0.00 O ATOM 861 CB LYS A 55 4.160 -15.517 1.092 1.00 0.00 C ATOM 862 CG LYS A 55 5.045 -16.700 0.740 1.00 0.00 C ATOM 863 CD LYS A 55 6.378 -16.248 0.168 1.00 0.00 C ATOM 864 CE LYS A 55 6.321 -16.121 -1.346 1.00 0.00 C ATOM 865 NZ LYS A 55 7.667 -15.872 -1.933 1.00 0.00 N ATOM 0 H LYS A 55 2.761 -13.452 1.181 1.00 0.00 H new ATOM 0 HA LYS A 55 3.797 -15.062 -0.977 1.00 0.00 H new ATOM 0 HB2 LYS A 55 4.790 -14.674 1.374 1.00 0.00 H new ATOM 0 HB3 LYS A 55 3.558 -15.771 1.964 1.00 0.00 H new ATOM 0 HG2 LYS A 55 5.216 -17.305 1.630 1.00 0.00 H new ATOM 0 HG3 LYS A 55 4.534 -17.335 0.016 1.00 0.00 H new ATOM 0 HD2 LYS A 55 6.656 -15.289 0.604 1.00 0.00 H new ATOM 0 HD3 LYS A 55 7.155 -16.961 0.445 1.00 0.00 H new ATOM 0 HE2 LYS A 55 5.902 -17.033 -1.771 1.00 0.00 H new ATOM 0 HE3 LYS A 55 5.650 -15.306 -1.617 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 7.585 -15.792 -2.967 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 8.056 -14.988 -1.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 8.301 -16.662 -1.696 1.00 0.00 H new ATOM 879 N THR A 56 1.156 -16.059 0.746 1.00 0.00 N ATOM 880 CA THR A 56 0.015 -16.966 0.717 1.00 0.00 C ATOM 881 C THR A 56 -1.113 -16.404 -0.140 1.00 0.00 C ATOM 882 O THR A 56 -1.760 -15.426 0.231 1.00 0.00 O ATOM 883 CB THR A 56 -0.521 -17.239 2.135 1.00 0.00 C ATOM 884 OG1 THR A 56 -1.901 -17.615 2.074 1.00 0.00 O ATOM 885 CG2 THR A 56 -0.364 -16.011 3.019 1.00 0.00 C ATOM 0 H THR A 56 1.164 -15.417 1.538 1.00 0.00 H new ATOM 0 HA THR A 56 0.366 -17.902 0.282 1.00 0.00 H new ATOM 0 HB THR A 56 0.059 -18.055 2.567 1.00 0.00 H new ATOM 0 HG1 THR A 56 -2.233 -17.788 2.980 1.00 0.00 H new ATOM 0 HG21 THR A 56 -0.749 -16.228 4.015 1.00 0.00 H new ATOM 0 HG22 THR A 56 0.691 -15.745 3.088 1.00 0.00 H new ATOM 0 HG23 THR A 56 -0.921 -15.179 2.588 1.00 0.00 H new ATOM 893 N GLY A 57 -1.344 -17.031 -1.290 1.00 0.00 N ATOM 894 CA GLY A 57 -2.396 -16.579 -2.183 1.00 0.00 C ATOM 895 C GLY A 57 -2.567 -15.073 -2.160 1.00 0.00 C ATOM 896 O GLY A 57 -1.650 -14.331 -2.513 1.00 0.00 O ATOM 0 H GLY A 57 -0.822 -17.843 -1.619 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -2.169 -16.901 -3.199 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -3.336 -17.053 -1.901 1.00 0.00 H new ATOM 900 N ASP A 58 -3.746 -14.619 -1.747 1.00 0.00 N ATOM 901 CA ASP A 58 -4.035 -13.192 -1.681 1.00 0.00 C ATOM 902 C ASP A 58 -4.625 -12.819 -0.324 1.00 0.00 C ATOM 903 O ASP A 58 -5.652 -13.359 0.088 1.00 0.00 O ATOM 904 CB ASP A 58 -5.002 -12.793 -2.798 1.00 0.00 C ATOM 905 CG ASP A 58 -4.841 -11.344 -3.212 1.00 0.00 C ATOM 906 OD1 ASP A 58 -5.162 -10.455 -2.396 1.00 0.00 O ATOM 907 OD2 ASP A 58 -4.396 -11.099 -4.353 1.00 0.00 O ATOM 0 H ASP A 58 -4.516 -15.219 -1.453 1.00 0.00 H new ATOM 0 HA ASP A 58 -3.098 -12.651 -1.811 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -4.838 -13.435 -3.663 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -6.026 -12.961 -2.465 1.00 0.00 H new ATOM 912 N VAL A 59 -3.967 -11.894 0.367 1.00 0.00 N ATOM 913 CA VAL A 59 -4.426 -11.449 1.678 1.00 0.00 C ATOM 914 C VAL A 59 -5.486 -10.360 1.549 1.00 0.00 C ATOM 915 O VAL A 59 -5.407 -9.506 0.666 1.00 0.00 O ATOM 916 CB VAL A 59 -3.259 -10.915 2.530 1.00 0.00 C ATOM 917 CG1 VAL A 59 -3.760 -10.444 3.887 1.00 0.00 C ATOM 918 CG2 VAL A 59 -2.185 -11.981 2.689 1.00 0.00 C ATOM 0 H VAL A 59 -3.115 -11.438 0.041 1.00 0.00 H new ATOM 0 HA VAL A 59 -4.860 -12.318 2.173 1.00 0.00 H new ATOM 0 HB VAL A 59 -2.818 -10.061 2.017 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -2.922 -10.070 4.475 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -4.490 -9.647 3.749 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -4.228 -11.277 4.411 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -1.368 -11.587 3.294 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -2.611 -12.856 3.180 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -1.806 -12.265 1.707 1.00 0.00 H new ATOM 928 N GLU A 60 -6.476 -10.398 2.435 1.00 0.00 N ATOM 929 CA GLU A 60 -7.552 -9.414 2.420 1.00 0.00 C ATOM 930 C GLU A 60 -7.317 -8.334 3.472 1.00 0.00 C ATOM 931 O GLU A 60 -6.658 -8.572 4.485 1.00 0.00 O ATOM 932 CB GLU A 60 -8.900 -10.095 2.664 1.00 0.00 C ATOM 933 CG GLU A 60 -8.924 -10.969 3.907 1.00 0.00 C ATOM 934 CD GLU A 60 -10.324 -11.416 4.279 1.00 0.00 C ATOM 935 OE1 GLU A 60 -11.203 -11.413 3.391 1.00 0.00 O ATOM 936 OE2 GLU A 60 -10.542 -11.768 5.457 1.00 0.00 O ATOM 0 H GLU A 60 -6.555 -11.099 3.172 1.00 0.00 H new ATOM 0 HA GLU A 60 -7.564 -8.943 1.437 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -9.673 -9.331 2.752 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -9.152 -10.705 1.796 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -8.298 -11.846 3.742 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -8.488 -10.419 4.741 1.00 0.00 H new ATOM 943 N ASP A 61 -7.861 -7.147 3.225 1.00 0.00 N ATOM 944 CA ASP A 61 -7.712 -6.031 4.151 1.00 0.00 C ATOM 945 C ASP A 61 -8.298 -6.375 5.517 1.00 0.00 C ATOM 946 O ASP A 61 -8.034 -5.693 6.507 1.00 0.00 O ATOM 947 CB ASP A 61 -8.393 -4.781 3.590 1.00 0.00 C ATOM 948 CG ASP A 61 -9.773 -5.074 3.035 1.00 0.00 C ATOM 949 OD1 ASP A 61 -9.858 -5.635 1.922 1.00 0.00 O ATOM 950 OD2 ASP A 61 -10.768 -4.743 3.713 1.00 0.00 O ATOM 0 H ASP A 61 -8.409 -6.933 2.392 1.00 0.00 H new ATOM 0 HA ASP A 61 -6.647 -5.832 4.273 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -8.473 -4.030 4.376 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -7.771 -4.354 2.803 1.00 0.00 H new ATOM 955 N SER A 62 -9.096 -7.438 5.562 1.00 0.00 N ATOM 956 CA SER A 62 -9.723 -7.870 6.805 1.00 0.00 C ATOM 957 C SER A 62 -8.786 -8.771 7.602 1.00 0.00 C ATOM 958 O SER A 62 -9.195 -9.411 8.572 1.00 0.00 O ATOM 959 CB SER A 62 -11.031 -8.608 6.511 1.00 0.00 C ATOM 960 OG SER A 62 -11.883 -8.606 7.643 1.00 0.00 O ATOM 0 H SER A 62 -9.323 -8.015 4.752 1.00 0.00 H new ATOM 0 HA SER A 62 -9.940 -6.983 7.401 1.00 0.00 H new ATOM 0 HB2 SER A 62 -11.538 -8.135 5.670 1.00 0.00 H new ATOM 0 HB3 SER A 62 -10.815 -9.635 6.217 1.00 0.00 H new ATOM 0 HG SER A 62 -11.373 -8.870 8.437 1.00 0.00 H new ATOM 966 N THR A 63 -7.524 -8.817 7.187 1.00 0.00 N ATOM 967 CA THR A 63 -6.527 -9.641 7.860 1.00 0.00 C ATOM 968 C THR A 63 -5.502 -8.778 8.588 1.00 0.00 C ATOM 969 O THR A 63 -5.142 -7.697 8.121 1.00 0.00 O ATOM 970 CB THR A 63 -5.793 -10.560 6.865 1.00 0.00 C ATOM 971 OG1 THR A 63 -6.741 -11.223 6.020 1.00 0.00 O ATOM 972 CG2 THR A 63 -4.953 -11.593 7.601 1.00 0.00 C ATOM 0 H THR A 63 -7.168 -8.293 6.388 1.00 0.00 H new ATOM 0 HA THR A 63 -7.061 -10.256 8.584 1.00 0.00 H new ATOM 0 HB THR A 63 -5.131 -9.944 6.256 1.00 0.00 H new ATOM 0 HG1 THR A 63 -6.267 -11.804 5.389 1.00 0.00 H new ATOM 0 HG21 THR A 63 -4.444 -12.230 6.878 1.00 0.00 H new ATOM 0 HG22 THR A 63 -4.214 -11.086 8.221 1.00 0.00 H new ATOM 0 HG23 THR A 63 -5.598 -12.204 8.232 1.00 0.00 H new ATOM 980 N VAL A 64 -5.035 -9.263 9.734 1.00 0.00 N ATOM 981 CA VAL A 64 -4.050 -8.537 10.526 1.00 0.00 C ATOM 982 C VAL A 64 -2.649 -9.098 10.310 1.00 0.00 C ATOM 983 O VAL A 64 -2.463 -10.312 10.209 1.00 0.00 O ATOM 984 CB VAL A 64 -4.386 -8.591 12.028 1.00 0.00 C ATOM 985 CG1 VAL A 64 -4.360 -10.027 12.529 1.00 0.00 C ATOM 986 CG2 VAL A 64 -3.422 -7.723 12.822 1.00 0.00 C ATOM 0 H VAL A 64 -5.323 -10.156 10.135 1.00 0.00 H new ATOM 0 HA VAL A 64 -4.079 -7.500 10.192 1.00 0.00 H new ATOM 0 HB VAL A 64 -5.393 -8.199 12.172 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -4.600 -10.046 13.592 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -5.095 -10.617 11.981 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -3.367 -10.449 12.373 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -3.675 -7.774 13.881 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -2.403 -8.082 12.675 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -3.496 -6.691 12.480 1.00 0.00 H new ATOM 996 N LEU A 65 -1.665 -8.208 10.239 1.00 0.00 N ATOM 997 CA LEU A 65 -0.279 -8.614 10.034 1.00 0.00 C ATOM 998 C LEU A 65 0.104 -9.742 10.987 1.00 0.00 C ATOM 999 O LEU A 65 0.523 -10.817 10.558 1.00 0.00 O ATOM 1000 CB LEU A 65 0.657 -7.421 10.235 1.00 0.00 C ATOM 1001 CG LEU A 65 0.327 -6.165 9.428 1.00 0.00 C ATOM 1002 CD1 LEU A 65 0.792 -4.919 10.166 1.00 0.00 C ATOM 1003 CD2 LEU A 65 0.959 -6.237 8.046 1.00 0.00 C ATOM 0 H LEU A 65 -1.801 -7.200 10.320 1.00 0.00 H new ATOM 0 HA LEU A 65 -0.180 -8.978 9.011 1.00 0.00 H new ATOM 0 HB2 LEU A 65 0.657 -7.159 11.293 1.00 0.00 H new ATOM 0 HB3 LEU A 65 1.671 -7.734 9.984 1.00 0.00 H new ATOM 0 HG LEU A 65 -0.755 -6.108 9.307 1.00 0.00 H new ATOM 0 HD11 LEU A 65 0.549 -4.035 9.577 1.00 0.00 H new ATOM 0 HD12 LEU A 65 0.291 -4.860 11.132 1.00 0.00 H new ATOM 0 HD13 LEU A 65 1.870 -4.968 10.319 1.00 0.00 H new ATOM 0 HD21 LEU A 65 0.713 -5.335 7.486 1.00 0.00 H new ATOM 0 HD22 LEU A 65 2.041 -6.319 8.145 1.00 0.00 H new ATOM 0 HD23 LEU A 65 0.576 -7.109 7.516 1.00 0.00 H new ATOM 1015 N LYS A 66 -0.044 -9.490 12.283 1.00 0.00 N ATOM 1016 CA LYS A 66 0.282 -10.484 13.299 1.00 0.00 C ATOM 1017 C LYS A 66 -0.237 -11.861 12.898 1.00 0.00 C ATOM 1018 O LYS A 66 0.274 -12.885 13.354 1.00 0.00 O ATOM 1019 CB LYS A 66 -0.310 -10.077 14.650 1.00 0.00 C ATOM 1020 CG LYS A 66 -1.779 -10.432 14.802 1.00 0.00 C ATOM 1021 CD LYS A 66 -2.238 -10.300 16.244 1.00 0.00 C ATOM 1022 CE LYS A 66 -2.690 -8.882 16.557 1.00 0.00 C ATOM 1023 NZ LYS A 66 -2.642 -8.594 18.017 1.00 0.00 N ATOM 0 H LYS A 66 -0.388 -8.605 12.655 1.00 0.00 H new ATOM 0 HA LYS A 66 1.367 -10.535 13.387 1.00 0.00 H new ATOM 0 HB2 LYS A 66 0.256 -10.561 15.446 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -0.189 -9.002 14.781 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -2.379 -9.780 14.167 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -1.945 -11.453 14.458 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -3.057 -10.994 16.431 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -1.424 -10.580 16.913 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -2.055 -8.173 16.026 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -3.706 -8.736 16.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -2.957 -7.618 18.189 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -3.267 -9.254 18.522 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -1.667 -8.709 18.362 1.00 0.00 H new ATOM 1037 N SER A 67 -1.254 -11.880 12.043 1.00 0.00 N ATOM 1038 CA SER A 67 -1.843 -13.132 11.583 1.00 0.00 C ATOM 1039 C SER A 67 -0.911 -13.846 10.609 1.00 0.00 C ATOM 1040 O SER A 67 -0.737 -15.063 10.677 1.00 0.00 O ATOM 1041 CB SER A 67 -3.194 -12.868 10.913 1.00 0.00 C ATOM 1042 OG SER A 67 -3.961 -14.057 10.829 1.00 0.00 O ATOM 0 H SER A 67 -1.687 -11.042 11.655 1.00 0.00 H new ATOM 0 HA SER A 67 -1.994 -13.774 12.451 1.00 0.00 H new ATOM 0 HB2 SER A 67 -3.744 -12.116 11.479 1.00 0.00 H new ATOM 0 HB3 SER A 67 -3.035 -12.462 9.914 1.00 0.00 H new ATOM 0 HG SER A 67 -4.820 -13.863 10.399 1.00 0.00 H new ATOM 1048 N LEU A 68 -0.314 -13.080 9.702 1.00 0.00 N ATOM 1049 CA LEU A 68 0.602 -13.638 8.713 1.00 0.00 C ATOM 1050 C LEU A 68 2.028 -13.676 9.252 1.00 0.00 C ATOM 1051 O LEU A 68 2.878 -14.404 8.738 1.00 0.00 O ATOM 1052 CB LEU A 68 0.553 -12.816 7.424 1.00 0.00 C ATOM 1053 CG LEU A 68 -0.766 -12.854 6.653 1.00 0.00 C ATOM 1054 CD1 LEU A 68 -0.754 -11.836 5.523 1.00 0.00 C ATOM 1055 CD2 LEU A 68 -1.027 -14.252 6.111 1.00 0.00 C ATOM 0 H LEU A 68 -0.448 -12.071 9.631 1.00 0.00 H new ATOM 0 HA LEU A 68 0.288 -14.659 8.498 1.00 0.00 H new ATOM 0 HB2 LEU A 68 0.777 -11.778 7.670 1.00 0.00 H new ATOM 0 HB3 LEU A 68 1.347 -13.165 6.764 1.00 0.00 H new ATOM 0 HG LEU A 68 -1.573 -12.595 7.339 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -1.701 -11.878 4.985 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -0.614 -10.837 5.935 1.00 0.00 H new ATOM 0 HD13 LEU A 68 0.062 -12.063 4.837 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -1.970 -14.260 5.565 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -0.217 -14.539 5.441 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -1.081 -14.959 6.939 1.00 0.00 H new ATOM 1067 N HIS A 69 2.284 -12.889 10.292 1.00 0.00 N ATOM 1068 CA HIS A 69 3.608 -12.835 10.903 1.00 0.00 C ATOM 1069 C HIS A 69 4.694 -12.732 9.837 1.00 0.00 C ATOM 1070 O HIS A 69 5.621 -13.543 9.799 1.00 0.00 O ATOM 1071 CB HIS A 69 3.843 -14.072 11.770 1.00 0.00 C ATOM 1072 CG HIS A 69 3.769 -15.360 11.009 1.00 0.00 C ATOM 1073 ND1 HIS A 69 4.857 -15.927 10.381 1.00 0.00 N ATOM 1074 CD2 HIS A 69 2.727 -16.193 10.779 1.00 0.00 C ATOM 1075 CE1 HIS A 69 4.489 -17.052 9.796 1.00 0.00 C ATOM 1076 NE2 HIS A 69 3.201 -17.237 10.023 1.00 0.00 N ATOM 0 H HIS A 69 1.593 -12.280 10.729 1.00 0.00 H new ATOM 0 HA HIS A 69 3.656 -11.946 11.532 1.00 0.00 H new ATOM 0 HB2 HIS A 69 4.823 -13.994 12.242 1.00 0.00 H new ATOM 0 HB3 HIS A 69 3.104 -14.090 12.571 1.00 0.00 H new ATOM 0 HD1 HIS A 69 5.800 -15.538 10.370 1.00 0.00 H new ATOM 0 HD2 HIS A 69 1.713 -16.061 11.125 1.00 0.00 H new ATOM 0 HE1 HIS A 69 5.132 -17.709 9.229 1.00 0.00 H new ATOM 1085 N LEU A 70 4.575 -11.731 8.971 1.00 0.00 N ATOM 1086 CA LEU A 70 5.546 -11.523 7.904 1.00 0.00 C ATOM 1087 C LEU A 70 6.960 -11.415 8.467 1.00 0.00 C ATOM 1088 O LEU A 70 7.166 -11.057 9.627 1.00 0.00 O ATOM 1089 CB LEU A 70 5.202 -10.259 7.113 1.00 0.00 C ATOM 1090 CG LEU A 70 4.011 -10.367 6.161 1.00 0.00 C ATOM 1091 CD1 LEU A 70 4.207 -11.521 5.189 1.00 0.00 C ATOM 1092 CD2 LEU A 70 2.717 -10.541 6.942 1.00 0.00 C ATOM 0 H LEU A 70 3.815 -11.051 8.988 1.00 0.00 H new ATOM 0 HA LEU A 70 5.505 -12.384 7.237 1.00 0.00 H new ATOM 0 HB2 LEU A 70 5.004 -9.454 7.821 1.00 0.00 H new ATOM 0 HB3 LEU A 70 6.078 -9.967 6.535 1.00 0.00 H new ATOM 0 HG LEU A 70 3.945 -9.442 5.588 1.00 0.00 H new ATOM 0 HD11 LEU A 70 3.349 -11.582 4.519 1.00 0.00 H new ATOM 0 HD12 LEU A 70 5.112 -11.355 4.605 1.00 0.00 H new ATOM 0 HD13 LEU A 70 4.300 -12.454 5.745 1.00 0.00 H new ATOM 0 HD21 LEU A 70 1.880 -10.616 6.248 1.00 0.00 H new ATOM 0 HD22 LEU A 70 2.773 -11.449 7.542 1.00 0.00 H new ATOM 0 HD23 LEU A 70 2.569 -9.682 7.597 1.00 0.00 H new ATOM 1104 N PRO A 71 7.957 -11.729 7.627 1.00 0.00 N ATOM 1105 CA PRO A 71 9.369 -11.672 8.019 1.00 0.00 C ATOM 1106 C PRO A 71 9.857 -10.241 8.220 1.00 0.00 C ATOM 1107 O PRO A 71 9.279 -9.295 7.685 1.00 0.00 O ATOM 1108 CB PRO A 71 10.091 -12.322 6.836 1.00 0.00 C ATOM 1109 CG PRO A 71 9.181 -12.114 5.675 1.00 0.00 C ATOM 1110 CD PRO A 71 7.784 -12.163 6.231 1.00 0.00 C ATOM 0 HA PRO A 71 9.549 -12.170 8.972 1.00 0.00 H new ATOM 0 HB2 PRO A 71 11.064 -11.861 6.664 1.00 0.00 H new ATOM 0 HB3 PRO A 71 10.268 -13.383 7.015 1.00 0.00 H new ATOM 0 HG2 PRO A 71 9.376 -11.156 5.193 1.00 0.00 H new ATOM 0 HG3 PRO A 71 9.328 -12.887 4.920 1.00 0.00 H new ATOM 0 HD2 PRO A 71 7.111 -11.502 5.685 1.00 0.00 H new ATOM 0 HD3 PRO A 71 7.363 -13.167 6.171 1.00 0.00 H new ATOM 1118 N LYS A 72 10.926 -10.089 8.995 1.00 0.00 N ATOM 1119 CA LYS A 72 11.494 -8.774 9.267 1.00 0.00 C ATOM 1120 C LYS A 72 11.488 -7.909 8.010 1.00 0.00 C ATOM 1121 O LYS A 72 10.971 -6.793 8.017 1.00 0.00 O ATOM 1122 CB LYS A 72 12.923 -8.913 9.796 1.00 0.00 C ATOM 1123 CG LYS A 72 13.440 -7.663 10.486 1.00 0.00 C ATOM 1124 CD LYS A 72 14.959 -7.616 10.491 1.00 0.00 C ATOM 1125 CE LYS A 72 15.508 -7.221 9.128 1.00 0.00 C ATOM 1126 NZ LYS A 72 15.337 -5.766 8.861 1.00 0.00 N ATOM 0 H LYS A 72 11.417 -10.861 9.446 1.00 0.00 H new ATOM 0 HA LYS A 72 10.878 -8.289 10.024 1.00 0.00 H new ATOM 0 HB2 LYS A 72 12.963 -9.747 10.496 1.00 0.00 H new ATOM 0 HB3 LYS A 72 13.586 -9.161 8.967 1.00 0.00 H new ATOM 0 HG2 LYS A 72 13.050 -6.780 9.981 1.00 0.00 H new ATOM 0 HG3 LYS A 72 13.071 -7.633 11.511 1.00 0.00 H new ATOM 0 HD2 LYS A 72 15.300 -6.904 11.242 1.00 0.00 H new ATOM 0 HD3 LYS A 72 15.354 -8.592 10.775 1.00 0.00 H new ATOM 0 HE2 LYS A 72 16.566 -7.478 9.074 1.00 0.00 H new ATOM 0 HE3 LYS A 72 15.001 -7.795 8.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 15.855 -5.508 7.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 14.327 -5.552 8.736 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 15.709 -5.220 9.664 1.00 0.00 H new ATOM 1140 N ASN A 73 12.064 -8.433 6.933 1.00 0.00 N ATOM 1141 CA ASN A 73 12.124 -7.708 5.670 1.00 0.00 C ATOM 1142 C ASN A 73 10.885 -7.987 4.824 1.00 0.00 C ATOM 1143 O ASN A 73 10.676 -9.107 4.362 1.00 0.00 O ATOM 1144 CB ASN A 73 13.383 -8.097 4.893 1.00 0.00 C ATOM 1145 CG ASN A 73 13.285 -9.485 4.290 1.00 0.00 C ATOM 1146 OD1 ASN A 73 13.548 -10.484 4.959 1.00 0.00 O ATOM 1147 ND2 ASN A 73 12.905 -9.552 3.019 1.00 0.00 N ATOM 0 H ASN A 73 12.496 -9.357 6.910 1.00 0.00 H new ATOM 0 HA ASN A 73 12.158 -6.642 5.893 1.00 0.00 H new ATOM 0 HB2 ASN A 73 13.556 -7.370 4.099 1.00 0.00 H new ATOM 0 HB3 ASN A 73 14.245 -8.053 5.558 1.00 0.00 H new ATOM 0 HD21 ASN A 73 12.821 -10.458 2.559 1.00 0.00 H new ATOM 0 HD22 ASN A 73 12.697 -8.697 2.503 1.00 0.00 H new ATOM 1154 N ASN A 74 10.067 -6.958 4.625 1.00 0.00 N ATOM 1155 CA ASN A 74 8.848 -7.092 3.835 1.00 0.00 C ATOM 1156 C ASN A 74 8.962 -6.319 2.525 1.00 0.00 C ATOM 1157 O ASN A 74 9.572 -5.251 2.473 1.00 0.00 O ATOM 1158 CB ASN A 74 7.641 -6.593 4.631 1.00 0.00 C ATOM 1159 CG ASN A 74 6.990 -7.695 5.445 1.00 0.00 C ATOM 1160 OD1 ASN A 74 6.221 -8.499 4.919 1.00 0.00 O ATOM 1161 ND2 ASN A 74 7.297 -7.736 6.737 1.00 0.00 N ATOM 0 H ASN A 74 10.226 -6.023 5.000 1.00 0.00 H new ATOM 0 HA ASN A 74 8.710 -8.148 3.603 1.00 0.00 H new ATOM 0 HB2 ASN A 74 7.956 -5.790 5.298 1.00 0.00 H new ATOM 0 HB3 ASN A 74 6.907 -6.169 3.946 1.00 0.00 H new ATOM 0 HD21 ASN A 74 6.890 -8.455 7.335 1.00 0.00 H new ATOM 0 HD22 ASN A 74 7.940 -7.049 7.131 1.00 0.00 H new ATOM 1168 N SER A 75 8.370 -6.866 1.467 1.00 0.00 N ATOM 1169 CA SER A 75 8.408 -6.229 0.156 1.00 0.00 C ATOM 1170 C SER A 75 7.067 -6.375 -0.557 1.00 0.00 C ATOM 1171 O SER A 75 6.551 -7.483 -0.713 1.00 0.00 O ATOM 1172 CB SER A 75 9.521 -6.838 -0.698 1.00 0.00 C ATOM 1173 OG SER A 75 9.857 -5.987 -1.781 1.00 0.00 O ATOM 0 H SER A 75 7.859 -7.748 1.493 1.00 0.00 H new ATOM 0 HA SER A 75 8.610 -5.168 0.300 1.00 0.00 H new ATOM 0 HB2 SER A 75 10.403 -7.012 -0.081 1.00 0.00 H new ATOM 0 HB3 SER A 75 9.202 -7.808 -1.079 1.00 0.00 H new ATOM 0 HG SER A 75 10.572 -6.398 -2.311 1.00 0.00 H new ATOM 1179 N LEU A 76 6.507 -5.250 -0.987 1.00 0.00 N ATOM 1180 CA LEU A 76 5.226 -5.250 -1.685 1.00 0.00 C ATOM 1181 C LEU A 76 5.255 -4.302 -2.879 1.00 0.00 C ATOM 1182 O LEU A 76 6.260 -3.637 -3.132 1.00 0.00 O ATOM 1183 CB LEU A 76 4.102 -4.849 -0.728 1.00 0.00 C ATOM 1184 CG LEU A 76 3.845 -5.799 0.442 1.00 0.00 C ATOM 1185 CD1 LEU A 76 2.994 -5.121 1.505 1.00 0.00 C ATOM 1186 CD2 LEU A 76 3.175 -7.076 -0.045 1.00 0.00 C ATOM 0 H LEU A 76 6.920 -4.325 -0.865 1.00 0.00 H new ATOM 0 HA LEU A 76 5.041 -6.260 -2.052 1.00 0.00 H new ATOM 0 HB2 LEU A 76 4.330 -3.862 -0.325 1.00 0.00 H new ATOM 0 HB3 LEU A 76 3.180 -4.754 -1.302 1.00 0.00 H new ATOM 0 HG LEU A 76 4.804 -6.062 0.888 1.00 0.00 H new ATOM 0 HD11 LEU A 76 2.822 -5.813 2.329 1.00 0.00 H new ATOM 0 HD12 LEU A 76 3.512 -4.236 1.876 1.00 0.00 H new ATOM 0 HD13 LEU A 76 2.038 -4.827 1.073 1.00 0.00 H new ATOM 0 HD21 LEU A 76 3.000 -7.740 0.801 1.00 0.00 H new ATOM 0 HD22 LEU A 76 2.224 -6.831 -0.517 1.00 0.00 H new ATOM 0 HD23 LEU A 76 3.821 -7.573 -0.769 1.00 0.00 H new ATOM 1198 N TYR A 77 4.147 -4.244 -3.609 1.00 0.00 N ATOM 1199 CA TYR A 77 4.045 -3.377 -4.777 1.00 0.00 C ATOM 1200 C TYR A 77 2.597 -2.966 -5.026 1.00 0.00 C ATOM 1201 O TYR A 77 1.664 -3.660 -4.623 1.00 0.00 O ATOM 1202 CB TYR A 77 4.607 -4.083 -6.012 1.00 0.00 C ATOM 1203 CG TYR A 77 3.955 -5.417 -6.295 1.00 0.00 C ATOM 1204 CD1 TYR A 77 4.390 -6.574 -5.660 1.00 0.00 C ATOM 1205 CD2 TYR A 77 2.905 -5.522 -7.199 1.00 0.00 C ATOM 1206 CE1 TYR A 77 3.798 -7.795 -5.916 1.00 0.00 C ATOM 1207 CE2 TYR A 77 2.306 -6.739 -7.460 1.00 0.00 C ATOM 1208 CZ TYR A 77 2.756 -7.873 -6.817 1.00 0.00 C ATOM 1209 OH TYR A 77 2.163 -9.087 -7.075 1.00 0.00 O ATOM 0 H TYR A 77 3.306 -4.787 -3.413 1.00 0.00 H new ATOM 0 HA TYR A 77 4.630 -2.478 -4.583 1.00 0.00 H new ATOM 0 HB2 TYR A 77 4.481 -3.435 -6.879 1.00 0.00 H new ATOM 0 HB3 TYR A 77 5.678 -4.233 -5.879 1.00 0.00 H new ATOM 0 HD1 TYR A 77 5.205 -6.517 -4.954 1.00 0.00 H new ATOM 0 HD2 TYR A 77 2.551 -4.637 -7.706 1.00 0.00 H new ATOM 0 HE1 TYR A 77 4.149 -8.684 -5.414 1.00 0.00 H new ATOM 0 HE2 TYR A 77 1.489 -6.802 -8.164 1.00 0.00 H new ATOM 0 HH TYR A 77 1.445 -8.968 -7.732 1.00 0.00 H new ATOM 1219 N VAL A 78 2.418 -1.831 -5.694 1.00 0.00 N ATOM 1220 CA VAL A 78 1.085 -1.326 -6.000 1.00 0.00 C ATOM 1221 C VAL A 78 0.819 -1.350 -7.501 1.00 0.00 C ATOM 1222 O VAL A 78 1.733 -1.171 -8.308 1.00 0.00 O ATOM 1223 CB VAL A 78 0.895 0.111 -5.479 1.00 0.00 C ATOM 1224 CG1 VAL A 78 -0.352 0.738 -6.083 1.00 0.00 C ATOM 1225 CG2 VAL A 78 0.825 0.121 -3.960 1.00 0.00 C ATOM 0 H VAL A 78 3.180 -1.244 -6.034 1.00 0.00 H new ATOM 0 HA VAL A 78 0.375 -1.983 -5.498 1.00 0.00 H new ATOM 0 HB VAL A 78 1.755 0.707 -5.784 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -0.469 1.753 -5.703 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -0.256 0.766 -7.168 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -1.225 0.145 -5.811 1.00 0.00 H new ATOM 0 HG21 VAL A 78 0.691 1.144 -3.609 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -0.016 -0.489 -3.630 1.00 0.00 H new ATOM 0 HG23 VAL A 78 1.750 -0.285 -3.550 1.00 0.00 H new ATOM 1235 N LEU A 79 -0.437 -1.571 -7.871 1.00 0.00 N ATOM 1236 CA LEU A 79 -0.825 -1.618 -9.276 1.00 0.00 C ATOM 1237 C LEU A 79 -2.119 -0.844 -9.511 1.00 0.00 C ATOM 1238 O LEU A 79 -3.201 -1.293 -9.132 1.00 0.00 O ATOM 1239 CB LEU A 79 -0.995 -3.068 -9.731 1.00 0.00 C ATOM 1240 CG LEU A 79 0.241 -3.960 -9.609 1.00 0.00 C ATOM 1241 CD1 LEU A 79 -0.147 -5.427 -9.704 1.00 0.00 C ATOM 1242 CD2 LEU A 79 1.262 -3.605 -10.680 1.00 0.00 C ATOM 0 H LEU A 79 -1.205 -1.721 -7.217 1.00 0.00 H new ATOM 0 HA LEU A 79 -0.033 -1.151 -9.861 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -1.801 -3.517 -9.151 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -1.315 -3.065 -10.773 1.00 0.00 H new ATOM 0 HG LEU A 79 0.694 -3.789 -8.632 1.00 0.00 H new ATOM 0 HD11 LEU A 79 0.746 -6.046 -9.615 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -0.841 -5.673 -8.900 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -0.625 -5.615 -10.665 1.00 0.00 H new ATOM 0 HD21 LEU A 79 2.135 -4.250 -10.578 1.00 0.00 H new ATOM 0 HD22 LEU A 79 0.819 -3.747 -11.666 1.00 0.00 H new ATOM 0 HD23 LEU A 79 1.564 -2.564 -10.564 1.00 0.00 H new ATOM 1254 N THR A 80 -2.000 0.321 -10.140 1.00 0.00 N ATOM 1255 CA THR A 80 -3.159 1.157 -10.426 1.00 0.00 C ATOM 1256 C THR A 80 -3.557 1.061 -11.894 1.00 0.00 C ATOM 1257 O THR A 80 -3.021 1.760 -12.755 1.00 0.00 O ATOM 1258 CB THR A 80 -2.889 2.632 -10.074 1.00 0.00 C ATOM 1259 OG1 THR A 80 -1.807 3.134 -10.867 1.00 0.00 O ATOM 1260 CG2 THR A 80 -2.555 2.784 -8.598 1.00 0.00 C ATOM 0 H THR A 80 -1.112 0.707 -10.461 1.00 0.00 H new ATOM 0 HA THR A 80 -3.976 0.787 -9.806 1.00 0.00 H new ATOM 0 HB THR A 80 -3.792 3.205 -10.287 1.00 0.00 H new ATOM 0 HG1 THR A 80 -1.894 2.804 -11.786 1.00 0.00 H new ATOM 0 HG21 THR A 80 -2.368 3.834 -8.373 1.00 0.00 H new ATOM 0 HG22 THR A 80 -3.392 2.428 -7.997 1.00 0.00 H new ATOM 0 HG23 THR A 80 -1.665 2.199 -8.364 1.00 0.00 H new ATOM 1268 N PRO A 81 -4.520 0.175 -12.191 1.00 0.00 N ATOM 1269 CA PRO A 81 -5.011 -0.032 -13.556 1.00 0.00 C ATOM 1270 C PRO A 81 -5.813 1.160 -14.071 1.00 0.00 C ATOM 1271 O PRO A 81 -5.556 1.668 -15.162 1.00 0.00 O ATOM 1272 CB PRO A 81 -5.910 -1.264 -13.427 1.00 0.00 C ATOM 1273 CG PRO A 81 -6.348 -1.265 -12.003 1.00 0.00 C ATOM 1274 CD PRO A 81 -5.202 -0.692 -11.216 1.00 0.00 C ATOM 0 HA PRO A 81 -4.195 -0.155 -14.268 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -6.763 -1.205 -14.104 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -5.369 -2.177 -13.676 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -7.249 -0.666 -11.872 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -6.585 -2.275 -11.668 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -5.551 -0.128 -10.351 1.00 0.00 H new ATOM 0 HD3 PRO A 81 -4.541 -1.474 -10.841 1.00 0.00 H new ATOM 1282 N ASP A 82 -6.783 1.601 -13.278 1.00 0.00 N ATOM 1283 CA ASP A 82 -7.621 2.734 -13.652 1.00 0.00 C ATOM 1284 C ASP A 82 -6.807 4.024 -13.686 1.00 0.00 C ATOM 1285 O ASP A 82 -6.633 4.634 -14.742 1.00 0.00 O ATOM 1286 CB ASP A 82 -8.788 2.877 -12.675 1.00 0.00 C ATOM 1287 CG ASP A 82 -9.775 1.731 -12.779 1.00 0.00 C ATOM 1288 OD1 ASP A 82 -9.831 1.093 -13.851 1.00 0.00 O ATOM 1289 OD2 ASP A 82 -10.492 1.473 -11.789 1.00 0.00 O ATOM 0 H ASP A 82 -7.009 1.191 -12.372 1.00 0.00 H new ATOM 0 HA ASP A 82 -8.016 2.549 -14.651 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -8.401 2.928 -11.657 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -9.306 3.817 -12.867 1.00 0.00 H new ATOM 1294 N LEU A 83 -6.312 4.435 -12.524 1.00 0.00 N ATOM 1295 CA LEU A 83 -5.518 5.654 -12.419 1.00 0.00 C ATOM 1296 C LEU A 83 -4.652 5.848 -13.660 1.00 0.00 C ATOM 1297 O LEU A 83 -4.007 4.920 -14.148 1.00 0.00 O ATOM 1298 CB LEU A 83 -4.635 5.605 -11.170 1.00 0.00 C ATOM 1299 CG LEU A 83 -4.156 6.954 -10.634 1.00 0.00 C ATOM 1300 CD1 LEU A 83 -5.314 7.730 -10.027 1.00 0.00 C ATOM 1301 CD2 LEU A 83 -3.048 6.758 -9.610 1.00 0.00 C ATOM 0 H LEU A 83 -6.446 3.942 -11.641 1.00 0.00 H new ATOM 0 HA LEU A 83 -6.202 6.499 -12.340 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -5.187 5.097 -10.379 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -3.760 4.993 -11.391 1.00 0.00 H new ATOM 0 HG LEU A 83 -3.756 7.532 -11.467 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -4.953 8.687 -9.651 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -6.075 7.903 -10.788 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -5.745 7.157 -9.206 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -2.719 7.729 -9.239 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -3.422 6.160 -8.779 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -2.208 6.244 -10.077 1.00 0.00 H new ATOM 1313 N PRO A 84 -4.635 7.083 -14.182 1.00 0.00 N ATOM 1314 CA PRO A 84 -3.850 7.429 -15.371 1.00 0.00 C ATOM 1315 C PRO A 84 -2.349 7.417 -15.099 1.00 0.00 C ATOM 1316 O PRO A 84 -1.898 7.588 -13.966 1.00 0.00 O ATOM 1317 CB PRO A 84 -4.320 8.846 -15.707 1.00 0.00 C ATOM 1318 CG PRO A 84 -4.805 9.401 -14.412 1.00 0.00 C ATOM 1319 CD PRO A 84 -5.379 8.238 -13.651 1.00 0.00 C ATOM 0 HA PRO A 84 -3.998 6.713 -16.179 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -3.507 9.446 -16.115 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -5.113 8.833 -16.454 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -3.990 9.866 -13.857 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -5.559 10.171 -14.576 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -5.234 8.350 -12.576 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -6.451 8.137 -13.819 1.00 0.00 H new ATOM 1327 N PRO A 85 -1.556 7.210 -16.161 1.00 0.00 N ATOM 1328 CA PRO A 85 -0.094 7.171 -16.061 1.00 0.00 C ATOM 1329 C PRO A 85 0.502 8.542 -15.759 1.00 0.00 C ATOM 1330 O PRO A 85 0.011 9.574 -16.216 1.00 0.00 O ATOM 1331 CB PRO A 85 0.343 6.692 -17.447 1.00 0.00 C ATOM 1332 CG PRO A 85 -0.766 7.096 -18.356 1.00 0.00 C ATOM 1333 CD PRO A 85 -2.026 6.999 -17.540 1.00 0.00 C ATOM 0 HA PRO A 85 0.243 6.529 -15.247 1.00 0.00 H new ATOM 0 HB2 PRO A 85 1.286 7.151 -17.745 1.00 0.00 H new ATOM 0 HB3 PRO A 85 0.494 5.613 -17.463 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -0.618 8.111 -18.726 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -0.814 6.443 -19.227 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -2.755 7.753 -17.836 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -2.507 6.028 -17.657 1.00 0.00 H new ATOM 1341 N PRO A 86 1.588 8.554 -14.971 1.00 0.00 N ATOM 1342 CA PRO A 86 2.276 9.792 -14.591 1.00 0.00 C ATOM 1343 C PRO A 86 3.001 10.437 -15.768 1.00 0.00 C ATOM 1344 O PRO A 86 3.652 11.470 -15.617 1.00 0.00 O ATOM 1345 CB PRO A 86 3.280 9.329 -13.533 1.00 0.00 C ATOM 1346 CG PRO A 86 3.524 7.893 -13.844 1.00 0.00 C ATOM 1347 CD PRO A 86 2.228 7.362 -14.391 1.00 0.00 C ATOM 0 HA PRO A 86 1.581 10.552 -14.235 1.00 0.00 H new ATOM 0 HB2 PRO A 86 4.203 9.907 -13.583 1.00 0.00 H new ATOM 0 HB3 PRO A 86 2.880 9.454 -12.527 1.00 0.00 H new ATOM 0 HG2 PRO A 86 4.329 7.782 -14.571 1.00 0.00 H new ATOM 0 HG3 PRO A 86 3.824 7.346 -12.950 1.00 0.00 H new ATOM 0 HD2 PRO A 86 2.395 6.590 -15.142 1.00 0.00 H new ATOM 0 HD3 PRO A 86 1.614 6.917 -13.608 1.00 0.00 H new ATOM 1355 N SER A 87 2.884 9.820 -16.939 1.00 0.00 N ATOM 1356 CA SER A 87 3.532 10.332 -18.141 1.00 0.00 C ATOM 1357 C SER A 87 5.033 10.060 -18.108 1.00 0.00 C ATOM 1358 O SER A 87 5.842 10.950 -18.368 1.00 0.00 O ATOM 1359 CB SER A 87 3.278 11.834 -18.282 1.00 0.00 C ATOM 1360 OG SER A 87 3.531 12.272 -19.606 1.00 0.00 O ATOM 0 H SER A 87 2.347 8.965 -17.081 1.00 0.00 H new ATOM 0 HA SER A 87 3.106 9.816 -19.001 1.00 0.00 H new ATOM 0 HB2 SER A 87 2.246 12.058 -18.012 1.00 0.00 H new ATOM 0 HB3 SER A 87 3.915 12.381 -17.587 1.00 0.00 H new ATOM 0 HG SER A 87 4.456 12.058 -19.850 1.00 0.00 H new ATOM 1366 N SER A 88 5.396 8.822 -17.785 1.00 0.00 N ATOM 1367 CA SER A 88 6.799 8.432 -17.713 1.00 0.00 C ATOM 1368 C SER A 88 7.094 7.287 -18.677 1.00 0.00 C ATOM 1369 O SER A 88 7.216 6.132 -18.268 1.00 0.00 O ATOM 1370 CB SER A 88 7.163 8.019 -16.285 1.00 0.00 C ATOM 1371 OG SER A 88 8.562 7.838 -16.148 1.00 0.00 O ATOM 0 H SER A 88 4.738 8.073 -17.569 1.00 0.00 H new ATOM 0 HA SER A 88 7.405 9.291 -18.000 1.00 0.00 H new ATOM 0 HB2 SER A 88 6.821 8.781 -15.584 1.00 0.00 H new ATOM 0 HB3 SER A 88 6.646 7.094 -16.027 1.00 0.00 H new ATOM 0 HG SER A 88 8.769 7.576 -15.227 1.00 0.00 H new ATOM 1377 N SER A 89 7.209 7.616 -19.960 1.00 0.00 N ATOM 1378 CA SER A 89 7.486 6.616 -20.984 1.00 0.00 C ATOM 1379 C SER A 89 8.418 5.534 -20.448 1.00 0.00 C ATOM 1380 O SER A 89 8.155 4.341 -20.601 1.00 0.00 O ATOM 1381 CB SER A 89 8.108 7.276 -22.216 1.00 0.00 C ATOM 1382 OG SER A 89 9.290 7.980 -21.876 1.00 0.00 O ATOM 0 H SER A 89 7.115 8.568 -20.315 1.00 0.00 H new ATOM 0 HA SER A 89 6.542 6.151 -21.267 1.00 0.00 H new ATOM 0 HB2 SER A 89 8.336 6.516 -22.963 1.00 0.00 H new ATOM 0 HB3 SER A 89 7.390 7.961 -22.667 1.00 0.00 H new ATOM 0 HG SER A 89 9.669 8.391 -22.681 1.00 0.00 H new ATOM 1388 N SER A 90 9.509 5.959 -19.818 1.00 0.00 N ATOM 1389 CA SER A 90 10.483 5.027 -19.262 1.00 0.00 C ATOM 1390 C SER A 90 9.794 3.774 -18.730 1.00 0.00 C ATOM 1391 O SER A 90 9.073 3.824 -17.733 1.00 0.00 O ATOM 1392 CB SER A 90 11.281 5.699 -18.142 1.00 0.00 C ATOM 1393 OG SER A 90 12.548 5.086 -17.981 1.00 0.00 O ATOM 0 H SER A 90 9.740 6.943 -19.680 1.00 0.00 H new ATOM 0 HA SER A 90 11.166 4.734 -20.060 1.00 0.00 H new ATOM 0 HB2 SER A 90 11.412 6.757 -18.369 1.00 0.00 H new ATOM 0 HB3 SER A 90 10.723 5.640 -17.207 1.00 0.00 H new ATOM 0 HG SER A 90 13.039 5.534 -17.261 1.00 0.00 H new ATOM 1399 N HIS A 91 10.021 2.651 -19.403 1.00 0.00 N ATOM 1400 CA HIS A 91 9.424 1.383 -18.999 1.00 0.00 C ATOM 1401 C HIS A 91 10.210 0.752 -17.854 1.00 0.00 C ATOM 1402 O HIS A 91 11.436 0.663 -17.906 1.00 0.00 O ATOM 1403 CB HIS A 91 9.367 0.421 -20.186 1.00 0.00 C ATOM 1404 CG HIS A 91 8.229 -0.551 -20.115 1.00 0.00 C ATOM 1405 ND1 HIS A 91 7.384 -0.799 -21.176 1.00 0.00 N ATOM 1406 CD2 HIS A 91 7.801 -1.340 -19.102 1.00 0.00 C ATOM 1407 CE1 HIS A 91 6.483 -1.697 -20.818 1.00 0.00 C ATOM 1408 NE2 HIS A 91 6.715 -2.042 -19.564 1.00 0.00 N ATOM 0 H HIS A 91 10.614 2.593 -20.231 1.00 0.00 H new ATOM 0 HA HIS A 91 8.410 1.581 -18.653 1.00 0.00 H new ATOM 0 HB2 HIS A 91 9.284 0.998 -21.107 1.00 0.00 H new ATOM 0 HB3 HIS A 91 10.304 -0.133 -20.240 1.00 0.00 H new ATOM 0 HD2 HIS A 91 8.233 -1.405 -18.114 1.00 0.00 H new ATOM 0 HE1 HIS A 91 5.692 -2.083 -21.444 1.00 0.00 H new ATOM 0 HE2 HIS A 91 6.175 -2.720 -19.026 1.00 0.00 H new ATOM 1417 N ALA A 92 9.496 0.316 -16.822 1.00 0.00 N ATOM 1418 CA ALA A 92 10.127 -0.307 -15.665 1.00 0.00 C ATOM 1419 C ALA A 92 10.386 -1.789 -15.914 1.00 0.00 C ATOM 1420 O ALA A 92 11.523 -2.203 -16.135 1.00 0.00 O ATOM 1421 CB ALA A 92 9.262 -0.121 -14.427 1.00 0.00 C ATOM 0 H ALA A 92 8.480 0.383 -16.763 1.00 0.00 H new ATOM 0 HA ALA A 92 11.088 0.181 -15.499 1.00 0.00 H new ATOM 0 HB1 ALA A 92 9.746 -0.591 -13.571 1.00 0.00 H new ATOM 0 HB2 ALA A 92 9.132 0.943 -14.231 1.00 0.00 H new ATOM 0 HB3 ALA A 92 8.288 -0.581 -14.591 1.00 0.00 H new ATOM 1427 N GLY A 93 9.321 -2.586 -15.875 1.00 0.00 N ATOM 1428 CA GLY A 93 9.455 -4.014 -16.097 1.00 0.00 C ATOM 1429 C GLY A 93 8.124 -4.684 -16.375 1.00 0.00 C ATOM 1430 O GLY A 93 7.083 -4.232 -15.900 1.00 0.00 O ATOM 0 H GLY A 93 8.369 -2.268 -15.694 1.00 0.00 H new ATOM 0 HA2 GLY A 93 10.128 -4.187 -16.937 1.00 0.00 H new ATOM 0 HA3 GLY A 93 9.914 -4.473 -15.221 1.00 0.00 H new ATOM 1434 N ALA A 94 8.158 -5.765 -17.147 1.00 0.00 N ATOM 1435 CA ALA A 94 6.945 -6.499 -17.487 1.00 0.00 C ATOM 1436 C ALA A 94 6.280 -7.068 -16.238 1.00 0.00 C ATOM 1437 O ALA A 94 6.739 -6.840 -15.119 1.00 0.00 O ATOM 1438 CB ALA A 94 7.262 -7.614 -18.473 1.00 0.00 C ATOM 0 H ALA A 94 9.012 -6.152 -17.549 1.00 0.00 H new ATOM 0 HA ALA A 94 6.247 -5.804 -17.954 1.00 0.00 H new ATOM 0 HB1 ALA A 94 6.347 -8.154 -18.718 1.00 0.00 H new ATOM 0 HB2 ALA A 94 7.686 -7.187 -19.382 1.00 0.00 H new ATOM 0 HB3 ALA A 94 7.980 -8.301 -18.026 1.00 0.00 H new ATOM 1444 N LEU A 95 5.196 -7.810 -16.437 1.00 0.00 N ATOM 1445 CA LEU A 95 4.466 -8.411 -15.327 1.00 0.00 C ATOM 1446 C LEU A 95 4.879 -9.866 -15.128 1.00 0.00 C ATOM 1447 O LEU A 95 5.282 -10.541 -16.075 1.00 0.00 O ATOM 1448 CB LEU A 95 2.959 -8.326 -15.575 1.00 0.00 C ATOM 1449 CG LEU A 95 2.379 -9.359 -16.542 1.00 0.00 C ATOM 1450 CD1 LEU A 95 0.938 -9.681 -16.178 1.00 0.00 C ATOM 1451 CD2 LEU A 95 2.469 -8.857 -17.976 1.00 0.00 C ATOM 0 H LEU A 95 4.803 -8.010 -17.357 1.00 0.00 H new ATOM 0 HA LEU A 95 4.710 -7.856 -14.421 1.00 0.00 H new ATOM 0 HB2 LEU A 95 2.447 -8.426 -14.618 1.00 0.00 H new ATOM 0 HB3 LEU A 95 2.729 -7.331 -15.957 1.00 0.00 H new ATOM 0 HG LEU A 95 2.966 -10.274 -16.461 1.00 0.00 H new ATOM 0 HD11 LEU A 95 0.542 -10.418 -16.877 1.00 0.00 H new ATOM 0 HD12 LEU A 95 0.900 -10.084 -15.166 1.00 0.00 H new ATOM 0 HD13 LEU A 95 0.338 -8.773 -16.230 1.00 0.00 H new ATOM 0 HD21 LEU A 95 2.052 -9.605 -18.650 1.00 0.00 H new ATOM 0 HD22 LEU A 95 1.907 -7.928 -18.072 1.00 0.00 H new ATOM 0 HD23 LEU A 95 3.513 -8.678 -18.234 1.00 0.00 H new ATOM 1463 N GLN A 96 4.773 -10.342 -13.892 1.00 0.00 N ATOM 1464 CA GLN A 96 5.134 -11.718 -13.570 1.00 0.00 C ATOM 1465 C GLN A 96 3.906 -12.623 -13.594 1.00 0.00 C ATOM 1466 O GLN A 96 2.787 -12.159 -13.806 1.00 0.00 O ATOM 1467 CB GLN A 96 5.805 -11.784 -12.197 1.00 0.00 C ATOM 1468 CG GLN A 96 7.250 -11.314 -12.203 1.00 0.00 C ATOM 1469 CD GLN A 96 8.223 -12.423 -12.549 1.00 0.00 C ATOM 1470 OE1 GLN A 96 8.827 -13.034 -11.666 1.00 0.00 O ATOM 1471 NE2 GLN A 96 8.381 -12.691 -13.840 1.00 0.00 N ATOM 0 H GLN A 96 4.440 -9.796 -13.097 1.00 0.00 H new ATOM 0 HA GLN A 96 5.836 -12.069 -14.326 1.00 0.00 H new ATOM 0 HB2 GLN A 96 5.236 -11.175 -11.494 1.00 0.00 H new ATOM 0 HB3 GLN A 96 5.767 -12.810 -11.832 1.00 0.00 H new ATOM 0 HG2 GLN A 96 7.361 -10.502 -12.921 1.00 0.00 H new ATOM 0 HG3 GLN A 96 7.500 -10.909 -11.222 1.00 0.00 H new ATOM 0 HE21 GLN A 96 7.861 -12.160 -14.538 1.00 0.00 H new ATOM 0 HE22 GLN A 96 9.023 -13.428 -14.133 1.00 0.00 H new ATOM 1480 N GLU A 97 4.126 -13.915 -13.374 1.00 0.00 N ATOM 1481 CA GLU A 97 3.036 -14.885 -13.372 1.00 0.00 C ATOM 1482 C GLU A 97 2.928 -15.578 -12.017 1.00 0.00 C ATOM 1483 O GLU A 97 3.880 -16.204 -11.550 1.00 0.00 O ATOM 1484 CB GLU A 97 3.247 -15.925 -14.474 1.00 0.00 C ATOM 1485 CG GLU A 97 3.199 -15.343 -15.877 1.00 0.00 C ATOM 1486 CD GLU A 97 1.800 -15.347 -16.462 1.00 0.00 C ATOM 1487 OE1 GLU A 97 0.997 -14.467 -16.084 1.00 0.00 O ATOM 1488 OE2 GLU A 97 1.508 -16.228 -17.297 1.00 0.00 O ATOM 0 H GLU A 97 5.047 -14.314 -13.195 1.00 0.00 H new ATOM 0 HA GLU A 97 2.106 -14.349 -13.562 1.00 0.00 H new ATOM 0 HB2 GLU A 97 4.211 -16.411 -14.324 1.00 0.00 H new ATOM 0 HB3 GLU A 97 2.483 -16.698 -14.384 1.00 0.00 H new ATOM 0 HG2 GLU A 97 3.577 -14.321 -15.856 1.00 0.00 H new ATOM 0 HG3 GLU A 97 3.862 -15.915 -16.526 1.00 0.00 H new ATOM 1495 N SER A 98 1.762 -15.461 -11.390 1.00 0.00 N ATOM 1496 CA SER A 98 1.530 -16.072 -10.086 1.00 0.00 C ATOM 1497 C SER A 98 1.638 -17.592 -10.172 1.00 0.00 C ATOM 1498 O SER A 98 1.095 -18.214 -11.086 1.00 0.00 O ATOM 1499 CB SER A 98 0.152 -15.677 -9.552 1.00 0.00 C ATOM 1500 OG SER A 98 -0.859 -15.931 -10.511 1.00 0.00 O ATOM 0 H SER A 98 0.963 -14.949 -11.764 1.00 0.00 H new ATOM 0 HA SER A 98 2.295 -15.708 -9.400 1.00 0.00 H new ATOM 0 HB2 SER A 98 -0.061 -16.233 -8.639 1.00 0.00 H new ATOM 0 HB3 SER A 98 0.150 -14.619 -9.289 1.00 0.00 H new ATOM 0 HG SER A 98 -1.730 -15.672 -10.145 1.00 0.00 H new ATOM 1506 N LEU A 99 2.343 -18.184 -9.214 1.00 0.00 N ATOM 1507 CA LEU A 99 2.523 -19.631 -9.180 1.00 0.00 C ATOM 1508 C LEU A 99 2.808 -20.111 -7.760 1.00 0.00 C ATOM 1509 O LEU A 99 3.024 -19.306 -6.854 1.00 0.00 O ATOM 1510 CB LEU A 99 3.665 -20.045 -10.109 1.00 0.00 C ATOM 1511 CG LEU A 99 4.998 -19.326 -9.895 1.00 0.00 C ATOM 1512 CD1 LEU A 99 5.831 -20.047 -8.847 1.00 0.00 C ATOM 1513 CD2 LEU A 99 5.763 -19.220 -11.206 1.00 0.00 C ATOM 0 H LEU A 99 2.799 -17.684 -8.451 1.00 0.00 H new ATOM 0 HA LEU A 99 1.598 -20.095 -9.522 1.00 0.00 H new ATOM 0 HB2 LEU A 99 3.830 -21.116 -9.994 1.00 0.00 H new ATOM 0 HB3 LEU A 99 3.347 -19.880 -11.139 1.00 0.00 H new ATOM 0 HG LEU A 99 4.792 -18.318 -9.535 1.00 0.00 H new ATOM 0 HD11 LEU A 99 6.776 -19.521 -8.708 1.00 0.00 H new ATOM 0 HD12 LEU A 99 5.287 -20.071 -7.903 1.00 0.00 H new ATOM 0 HD13 LEU A 99 6.029 -21.067 -9.178 1.00 0.00 H new ATOM 0 HD21 LEU A 99 6.709 -18.706 -11.035 1.00 0.00 H new ATOM 0 HD22 LEU A 99 5.959 -20.219 -11.595 1.00 0.00 H new ATOM 0 HD23 LEU A 99 5.171 -18.659 -11.929 1.00 0.00 H new ATOM 1525 N ASN A 100 2.808 -21.427 -7.574 1.00 0.00 N ATOM 1526 CA ASN A 100 3.068 -22.014 -6.265 1.00 0.00 C ATOM 1527 C ASN A 100 4.556 -21.962 -5.931 1.00 0.00 C ATOM 1528 O ASN A 100 4.957 -22.225 -4.798 1.00 0.00 O ATOM 1529 CB ASN A 100 2.575 -23.462 -6.225 1.00 0.00 C ATOM 1530 CG ASN A 100 3.058 -24.203 -4.993 1.00 0.00 C ATOM 1531 OD1 ASN A 100 4.094 -24.867 -5.021 1.00 0.00 O ATOM 1532 ND2 ASN A 100 2.306 -24.093 -3.904 1.00 0.00 N ATOM 0 H ASN A 100 2.631 -22.107 -8.313 1.00 0.00 H new ATOM 0 HA ASN A 100 2.526 -21.432 -5.520 1.00 0.00 H new ATOM 0 HB2 ASN A 100 1.485 -23.473 -6.248 1.00 0.00 H new ATOM 0 HB3 ASN A 100 2.918 -23.985 -7.118 1.00 0.00 H new ATOM 0 HD21 ASN A 100 2.580 -24.570 -3.045 1.00 0.00 H new ATOM 0 HD22 ASN A 100 1.455 -23.532 -3.927 1.00 0.00 H new TER 1539 ASN A 100