USER MOD reduce.3.24.130724 H: found=0, std=0, add=1460, rem=0, adj=55 USER MOD reduce.3.24.130724 removed 1464 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 187 THR OG1 : rot 80:sc= 0.0258 USER MOD Set 1.2: A 188 MET CE :methyl -111:sc= -3.74! (180deg=-5.58!) USER MOD Set 1.3: A 191 ASN :FLIP amide:sc= -0.475 F(o=-5.7!,f=-4.2) USER MOD Set 2.1: A 158 MET CE :methyl -130:sc= -0.0673 (180deg=-1.65) USER MOD Set 2.2: A 166 LYS NZ :NH3+ 177:sc= 1.12 (180deg=0.968) USER MOD Set 3.1: A 155 CYS SG : rot 22:sc= -3.78! USER MOD Set 3.2: A 165 SER OG : rot 22:sc= -0.941 USER MOD Set 4.1: A 148 ASN : amide:sc= 0.854 K(o=0.49,f=-4.2) USER MOD Set 4.2: A 173 THR OG1 : rot -72:sc= -0.359 USER MOD Set 5.1: A 131 SER OG : rot 139:sc= -0.959 USER MOD Set 5.2: A 137 TYR OH : rot -14:sc= -1.8! USER MOD Set 6.1: A 18 ASN : amide:sc= -2.4! C(o=-3.8!,f=-6.9!) USER MOD Set 6.2: A 123 ASN :FLIP amide:sc= -0.126 F(o=-4.8!,f=-3.8) USER MOD Set 6.3: A 124 MET CE :methyl -149:sc= -1.32 (180deg=-2.34) USER MOD Set 7.1: A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 7.2: A 120 TYR OH : rot 180:sc= 0 USER MOD Set 8.1: A 83 MET CE :methyl 154:sc= -0.0216 (180deg=-0.0449) USER MOD Set 8.2: A 94 CYS SG : rot 180:sc= -1.35 USER MOD Set 9.1: A 62 SER OG : rot -24:sc= 0.129 USER MOD Set 9.2: A 125 ASN : amide:sc= 0 X(o=0.13,f=0.12) USER MOD Set10.1: A 46 ASN : amide:sc= -0.0324 K(o=-0.032,f=-1.2!) USER MOD Set10.2: A 48 TYR OH : rot 180:sc= 0 USER MOD Set11.1: A 4 LYS NZ :NH3+ -138:sc= 1.21 (180deg=0) USER MOD Set11.2: A 8 GLN : amide:sc= -0.313! C(o=2.1!,f=-5.4!) USER MOD Set11.3: A 116 TYR OH : rot 73:sc= 1.2 USER MOD Single : A 9 GLN : amide:sc=-0.00975 K(o=-0.0098,f=-1) USER MOD Single : A 10 THR OG1 : rot 90:sc= -3.4! USER MOD Single : A 12 GLN : amide:sc= -0.0114 K(o=-0.011,f=-1.1) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 THR OG1 : rot 26:sc= 0.305 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 180:sc= -0.06 USER MOD Single : A 31 LYS NZ :NH3+ 171:sc=-0.00879 (180deg=-0.117) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 79:sc= 0.108 USER MOD Single : A 36 SER OG : rot -129:sc= 2.12 USER MOD Single : A 37 SER OG : rot 120:sc= 0.954 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 SER OG : rot 180:sc= 0.0327 USER MOD Single : A 60 LYS NZ :NH3+ -156:sc= 1.05 (180deg=-0.58!) USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc= -0.477 K(o=-0.48,f=-11!) USER MOD Single : A 68 THR OG1 : rot -38:sc= -2.43! USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 79 GLN :FLIP amide:sc= -0.772 F(o=-1.8!,f=-0.77) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 ASN : amide:sc= -0.346 X(o=-0.35,f=-0.14) USER MOD Single : A 85 HIS : no HD1:sc= -0.0692 X(o=-0.069,f=-0.013) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 91 THR OG1 : rot 173:sc= -0.035 USER MOD Single : A 95 HIS : no HD1:sc= -0.292 K(o=-0.29,f=-4.5!) USER MOD Single : A 96 THR OG1 : rot 180:sc= -0.695 USER MOD Single : A 98 THR OG1 : rot 36:sc= 1.2 USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot 110:sc= -2.41! USER MOD Single : A 129 SER OG : rot 121:sc= 0.00354 USER MOD Single : A 130 LYS NZ :NH3+ -137:sc= -2.11! (180deg=-4.64!) USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= 0.0342 USER MOD Single : A 142 ASN : amide:sc= 0 K(o=0,f=-0.93) USER MOD Single : A 143 TYR OH : rot 180:sc= 0 USER MOD Single : A 147 TYR OH : rot 180:sc= 0 USER MOD Single : A 149 HIS : no HD1:sc= 0.793 K(o=0.79,f=-5.3!) USER MOD Single : A 151 CYS SG : rot 1:sc= -3.53! USER MOD Single : A 156 SER OG : rot -94:sc= 1.4 USER MOD Single : A 161 ASN : amide:sc= -3.12! C(o=-3.1!,f=-6.9!) USER MOD Single : A 164 TYR OH : rot 180:sc= 0 USER MOD Single : A 169 MET CE :methyl 139:sc= -1.12 (180deg=-6.17!) USER MOD Single : A 172 GLN : amide:sc= -0.0391 X(o=-0.039,f=-0.17) USER MOD Single : A 186 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 190 SER OG : rot -150:sc= -0.69 USER MOD Single : A 194 ASN : amide:sc= 0.841 K(o=0.84,f=0) USER MOD Single : A 198 ASN : amide:sc= -5.43! C(o=-5.4!,f=-10!) USER MOD Single : A 200 LYS NZ :NH3+ -155:sc= -0.0917 (180deg=-0.278) USER MOD Single : A 204 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 20 N ASP A 2 -8.361 -5.496 -19.918 1.00 0.84 N ATOM 21 CA ASP A 2 -9.229 -4.428 -19.459 1.00 0.67 C ATOM 22 C ASP A 2 -8.648 -3.770 -18.228 1.00 0.52 C ATOM 23 O ASP A 2 -8.650 -2.554 -18.110 1.00 0.53 O ATOM 24 CB ASP A 2 -10.619 -4.974 -19.143 1.00 0.98 C ATOM 25 CG ASP A 2 -11.586 -3.889 -18.706 1.00 1.50 C ATOM 26 OD1 ASP A 2 -11.969 -3.051 -19.550 1.00 1.72 O ATOM 27 OD2 ASP A 2 -11.986 -3.884 -17.525 1.00 2.25 O ATOM 0 HA ASP A 2 -9.310 -3.686 -20.253 1.00 0.67 H new ATOM 0 HB2 ASP A 2 -11.017 -5.477 -20.024 1.00 0.98 H new ATOM 0 HB3 ASP A 2 -10.541 -5.724 -18.356 1.00 0.98 H new ATOM 32 N PHE A 3 -8.095 -4.581 -17.340 1.00 0.43 N ATOM 33 CA PHE A 3 -7.562 -4.089 -16.089 1.00 0.34 C ATOM 34 C PHE A 3 -6.385 -3.185 -16.375 1.00 0.37 C ATOM 35 O PHE A 3 -6.168 -2.189 -15.697 1.00 0.40 O ATOM 36 CB PHE A 3 -7.126 -5.246 -15.199 1.00 0.30 C ATOM 37 CG PHE A 3 -8.256 -6.093 -14.683 1.00 0.29 C ATOM 38 CD1 PHE A 3 -8.939 -5.746 -13.528 1.00 0.28 C ATOM 39 CD2 PHE A 3 -8.653 -7.225 -15.373 1.00 0.30 C ATOM 40 CE1 PHE A 3 -9.996 -6.508 -13.080 1.00 0.29 C ATOM 41 CE2 PHE A 3 -9.704 -7.994 -14.926 1.00 0.31 C ATOM 42 CZ PHE A 3 -10.301 -7.680 -13.686 1.00 0.29 C ATOM 0 H PHE A 3 -8.005 -5.589 -17.468 1.00 0.43 H new ATOM 0 HA PHE A 3 -8.338 -3.530 -15.565 1.00 0.34 H new ATOM 0 HB2 PHE A 3 -6.439 -5.880 -15.759 1.00 0.30 H new ATOM 0 HB3 PHE A 3 -6.571 -4.846 -14.350 1.00 0.30 H new ATOM 0 HD1 PHE A 3 -8.640 -4.869 -12.973 1.00 0.28 H new ATOM 0 HD2 PHE A 3 -8.131 -7.509 -16.275 1.00 0.30 H new ATOM 0 HE1 PHE A 3 -10.585 -6.169 -12.241 1.00 0.29 H new ATOM 0 HE2 PHE A 3 -10.066 -8.824 -15.515 1.00 0.31 H new ATOM 0 HZ PHE A 3 -10.994 -8.368 -13.225 1.00 0.29 H new ATOM 52 N LYS A 4 -5.660 -3.527 -17.425 1.00 0.40 N ATOM 53 CA LYS A 4 -4.533 -2.751 -17.865 1.00 0.47 C ATOM 54 C LYS A 4 -5.003 -1.475 -18.536 1.00 0.54 C ATOM 55 O LYS A 4 -4.209 -0.672 -18.979 1.00 0.95 O ATOM 56 CB LYS A 4 -3.701 -3.552 -18.848 1.00 0.54 C ATOM 57 CG LYS A 4 -2.236 -3.177 -18.860 1.00 0.68 C ATOM 58 CD LYS A 4 -1.434 -4.171 -19.673 1.00 0.83 C ATOM 59 CE LYS A 4 0.042 -3.823 -19.735 1.00 1.10 C ATOM 60 NZ LYS A 4 0.316 -2.740 -20.712 1.00 1.51 N ATOM 0 H LYS A 4 -5.843 -4.354 -17.993 1.00 0.40 H new ATOM 0 HA LYS A 4 -3.928 -2.500 -16.994 1.00 0.47 H new ATOM 0 HB2 LYS A 4 -3.793 -4.611 -18.608 1.00 0.54 H new ATOM 0 HB3 LYS A 4 -4.109 -3.416 -19.850 1.00 0.54 H new ATOM 0 HG2 LYS A 4 -2.115 -2.177 -19.277 1.00 0.68 H new ATOM 0 HG3 LYS A 4 -1.856 -3.144 -17.839 1.00 0.68 H new ATOM 0 HD2 LYS A 4 -1.551 -5.165 -19.241 1.00 0.83 H new ATOM 0 HD3 LYS A 4 -1.836 -4.214 -20.685 1.00 0.83 H new ATOM 0 HE2 LYS A 4 0.384 -3.515 -18.747 1.00 1.10 H new ATOM 0 HE3 LYS A 4 0.613 -4.711 -20.008 1.00 1.10 H new ATOM 0 HZ1 LYS A 4 1.175 -2.968 -21.251 1.00 1.51 H new ATOM 0 HZ2 LYS A 4 -0.489 -2.650 -21.365 1.00 1.51 H new ATOM 0 HZ3 LYS A 4 0.454 -1.842 -20.205 1.00 1.51 H new ATOM 74 N ALA A 5 -6.292 -1.322 -18.671 1.00 0.45 N ATOM 75 CA ALA A 5 -6.832 -0.076 -19.140 1.00 0.47 C ATOM 76 C ALA A 5 -7.140 0.822 -17.956 1.00 0.42 C ATOM 77 O ALA A 5 -6.823 2.005 -17.962 1.00 0.42 O ATOM 78 CB ALA A 5 -8.063 -0.320 -19.994 1.00 0.54 C ATOM 0 H ALA A 5 -6.985 -2.041 -18.464 1.00 0.45 H new ATOM 0 HA ALA A 5 -6.096 0.427 -19.767 1.00 0.47 H new ATOM 0 HB1 ALA A 5 -8.460 0.634 -20.341 1.00 0.54 H new ATOM 0 HB2 ALA A 5 -7.794 -0.935 -20.853 1.00 0.54 H new ATOM 0 HB3 ALA A 5 -8.820 -0.834 -19.402 1.00 0.54 H new ATOM 84 N ILE A 6 -7.685 0.226 -16.905 1.00 0.42 N ATOM 85 CA ILE A 6 -8.180 0.994 -15.768 1.00 0.43 C ATOM 86 C ILE A 6 -7.025 1.333 -14.845 1.00 0.37 C ATOM 87 O ILE A 6 -6.884 2.455 -14.365 1.00 0.38 O ATOM 88 CB ILE A 6 -9.251 0.225 -14.958 1.00 0.53 C ATOM 89 CG1 ILE A 6 -10.213 -0.526 -15.880 1.00 0.91 C ATOM 90 CG2 ILE A 6 -10.031 1.190 -14.079 1.00 1.07 C ATOM 91 CD1 ILE A 6 -10.142 -2.030 -15.722 1.00 0.65 C ATOM 0 H ILE A 6 -7.796 -0.784 -16.815 1.00 0.42 H new ATOM 0 HA ILE A 6 -8.642 1.898 -16.166 1.00 0.43 H new ATOM 0 HB ILE A 6 -8.738 -0.506 -14.333 1.00 0.53 H new ATOM 0 HG12 ILE A 6 -11.232 -0.194 -15.679 1.00 0.91 H new ATOM 0 HG13 ILE A 6 -9.991 -0.265 -16.915 1.00 0.91 H new ATOM 0 HG21 ILE A 6 -10.783 0.640 -13.513 1.00 1.07 H new ATOM 0 HG22 ILE A 6 -9.349 1.687 -13.389 1.00 1.07 H new ATOM 0 HG23 ILE A 6 -10.522 1.936 -14.704 1.00 1.07 H new ATOM 0 HD11 ILE A 6 -10.849 -2.501 -16.404 1.00 0.65 H new ATOM 0 HD12 ILE A 6 -9.133 -2.373 -15.951 1.00 0.65 H new ATOM 0 HD13 ILE A 6 -10.393 -2.300 -14.696 1.00 0.65 H new ATOM 103 N ALA A 7 -6.197 0.331 -14.621 1.00 0.33 N ATOM 104 CA ALA A 7 -5.051 0.430 -13.741 1.00 0.31 C ATOM 105 C ALA A 7 -3.971 1.299 -14.338 1.00 0.30 C ATOM 106 O ALA A 7 -3.303 2.049 -13.649 1.00 0.32 O ATOM 107 CB ALA A 7 -4.491 -0.940 -13.539 1.00 0.34 C ATOM 0 H ALA A 7 -6.304 -0.587 -15.052 1.00 0.33 H new ATOM 0 HA ALA A 7 -5.375 0.874 -12.800 1.00 0.31 H new ATOM 0 HB1 ALA A 7 -3.626 -0.886 -12.878 1.00 0.34 H new ATOM 0 HB2 ALA A 7 -5.250 -1.581 -13.091 1.00 0.34 H new ATOM 0 HB3 ALA A 7 -4.188 -1.354 -14.500 1.00 0.34 H new ATOM 113 N GLN A 8 -3.794 1.154 -15.625 1.00 0.31 N ATOM 114 CA GLN A 8 -2.804 1.912 -16.361 1.00 0.34 C ATOM 115 C GLN A 8 -3.174 3.378 -16.385 1.00 0.35 C ATOM 116 O GLN A 8 -2.315 4.253 -16.490 1.00 0.39 O ATOM 117 CB GLN A 8 -2.672 1.361 -17.770 1.00 0.38 C ATOM 118 CG GLN A 8 -1.708 0.212 -17.849 1.00 0.96 C ATOM 119 CD GLN A 8 -1.141 0.005 -19.243 1.00 1.04 C ATOM 120 OE1 GLN A 8 0.002 -0.428 -19.397 1.00 1.59 O ATOM 121 NE2 GLN A 8 -1.933 0.285 -20.263 1.00 1.50 N ATOM 0 H GLN A 8 -4.332 0.505 -16.199 1.00 0.31 H new ATOM 0 HA GLN A 8 -1.840 1.817 -15.862 1.00 0.34 H new ATOM 0 HB2 GLN A 8 -3.651 1.035 -18.123 1.00 0.38 H new ATOM 0 HB3 GLN A 8 -2.341 2.156 -18.438 1.00 0.38 H new ATOM 0 HG2 GLN A 8 -0.888 0.385 -17.152 1.00 0.96 H new ATOM 0 HG3 GLN A 8 -2.212 -0.700 -17.529 1.00 0.96 H new ATOM 0 HE21 GLN A 8 -2.874 0.642 -20.095 1.00 1.50 H new ATOM 0 HE22 GLN A 8 -1.604 0.144 -21.218 1.00 1.50 H new ATOM 130 N GLN A 9 -4.460 3.631 -16.263 1.00 0.36 N ATOM 131 CA GLN A 9 -4.947 4.996 -16.096 1.00 0.40 C ATOM 132 C GLN A 9 -4.781 5.402 -14.640 1.00 0.38 C ATOM 133 O GLN A 9 -4.427 6.535 -14.324 1.00 0.45 O ATOM 134 CB GLN A 9 -6.419 5.115 -16.500 1.00 0.48 C ATOM 135 CG GLN A 9 -6.675 4.898 -17.980 1.00 0.74 C ATOM 136 CD GLN A 9 -8.154 4.828 -18.305 1.00 1.65 C ATOM 137 OE1 GLN A 9 -8.971 4.423 -17.473 1.00 2.47 O ATOM 138 NE2 GLN A 9 -8.512 5.207 -19.521 1.00 2.31 N ATOM 0 H GLN A 9 -5.189 2.918 -16.275 1.00 0.36 H new ATOM 0 HA GLN A 9 -4.368 5.656 -16.743 1.00 0.40 H new ATOM 0 HB2 GLN A 9 -7.000 4.389 -15.931 1.00 0.48 H new ATOM 0 HB3 GLN A 9 -6.783 6.104 -16.221 1.00 0.48 H new ATOM 0 HG2 GLN A 9 -6.219 5.709 -18.548 1.00 0.74 H new ATOM 0 HG3 GLN A 9 -6.191 3.974 -18.298 1.00 0.74 H new ATOM 0 HE21 GLN A 9 -7.807 5.536 -20.181 1.00 2.31 H new ATOM 0 HE22 GLN A 9 -9.493 5.170 -19.799 1.00 2.31 H new ATOM 147 N THR A 10 -5.010 4.435 -13.768 1.00 0.34 N ATOM 148 CA THR A 10 -4.928 4.628 -12.336 1.00 0.34 C ATOM 149 C THR A 10 -3.490 4.889 -11.884 1.00 0.30 C ATOM 150 O THR A 10 -3.263 5.682 -10.970 1.00 0.30 O ATOM 151 CB THR A 10 -5.527 3.405 -11.604 1.00 0.37 C ATOM 152 OG1 THR A 10 -6.691 3.801 -10.877 1.00 0.48 O ATOM 153 CG2 THR A 10 -4.527 2.734 -10.669 1.00 0.34 C ATOM 0 H THR A 10 -5.261 3.485 -14.041 1.00 0.34 H new ATOM 0 HA THR A 10 -5.510 5.513 -12.077 1.00 0.34 H new ATOM 0 HB THR A 10 -5.794 2.670 -12.363 1.00 0.37 H new ATOM 0 HG1 THR A 10 -7.481 3.708 -11.449 1.00 0.48 H new ATOM 0 HG21 THR A 10 -5.000 1.882 -10.181 1.00 0.34 H new ATOM 0 HG22 THR A 10 -3.666 2.392 -11.243 1.00 0.34 H new ATOM 0 HG23 THR A 10 -4.199 3.448 -9.914 1.00 0.34 H new ATOM 161 N ALA A 11 -2.528 4.211 -12.508 1.00 0.29 N ATOM 162 CA ALA A 11 -1.115 4.449 -12.213 1.00 0.28 C ATOM 163 C ALA A 11 -0.767 5.934 -12.171 1.00 0.30 C ATOM 164 O ALA A 11 -0.305 6.443 -11.156 1.00 0.31 O ATOM 165 CB ALA A 11 -0.231 3.745 -13.226 1.00 0.31 C ATOM 0 H ALA A 11 -2.699 3.497 -13.216 1.00 0.29 H new ATOM 0 HA ALA A 11 -0.932 4.040 -11.220 1.00 0.28 H new ATOM 0 HB1 ALA A 11 0.816 3.934 -12.989 1.00 0.31 H new ATOM 0 HB2 ALA A 11 -0.422 2.672 -13.193 1.00 0.31 H new ATOM 0 HB3 ALA A 11 -0.451 4.122 -14.225 1.00 0.31 H new ATOM 171 N GLN A 12 -1.012 6.626 -13.267 1.00 0.35 N ATOM 172 CA GLN A 12 -0.666 8.037 -13.370 1.00 0.40 C ATOM 173 C GLN A 12 -1.752 8.909 -12.743 1.00 0.40 C ATOM 174 O GLN A 12 -1.704 10.135 -12.820 1.00 0.45 O ATOM 175 CB GLN A 12 -0.462 8.404 -14.835 1.00 0.48 C ATOM 176 CG GLN A 12 -1.711 8.205 -15.662 1.00 0.98 C ATOM 177 CD GLN A 12 -1.443 8.259 -17.153 1.00 0.97 C ATOM 178 OE1 GLN A 12 -0.370 7.873 -17.619 1.00 1.30 O ATOM 179 NE2 GLN A 12 -2.410 8.750 -17.908 1.00 1.64 N ATOM 0 H GLN A 12 -1.450 6.236 -14.102 1.00 0.35 H new ATOM 0 HA GLN A 12 0.260 8.216 -12.824 1.00 0.40 H new ATOM 0 HB2 GLN A 12 -0.146 9.445 -14.905 1.00 0.48 H new ATOM 0 HB3 GLN A 12 0.344 7.798 -15.249 1.00 0.48 H new ATOM 0 HG2 GLN A 12 -2.157 7.242 -15.412 1.00 0.98 H new ATOM 0 HG3 GLN A 12 -2.440 8.972 -15.401 1.00 0.98 H new ATOM 0 HE21 GLN A 12 -3.284 9.058 -17.481 1.00 1.64 H new ATOM 0 HE22 GLN A 12 -2.283 8.821 -18.918 1.00 1.64 H new ATOM 188 N GLU A 13 -2.733 8.263 -12.132 1.00 0.38 N ATOM 189 CA GLU A 13 -3.772 8.947 -11.403 1.00 0.39 C ATOM 190 C GLU A 13 -3.310 9.112 -9.957 1.00 0.37 C ATOM 191 O GLU A 13 -3.301 10.215 -9.408 1.00 0.42 O ATOM 192 CB GLU A 13 -5.068 8.129 -11.503 1.00 0.43 C ATOM 193 CG GLU A 13 -5.901 8.121 -10.240 1.00 1.10 C ATOM 194 CD GLU A 13 -6.797 9.335 -10.103 1.00 1.65 C ATOM 195 OE1 GLU A 13 -6.278 10.470 -10.214 1.00 1.64 O ATOM 196 OE2 GLU A 13 -8.010 9.171 -9.875 1.00 2.54 O ATOM 0 H GLU A 13 -2.825 7.247 -12.132 1.00 0.38 H new ATOM 0 HA GLU A 13 -3.969 9.936 -11.817 1.00 0.39 H new ATOM 0 HB2 GLU A 13 -5.672 8.526 -12.319 1.00 0.43 H new ATOM 0 HB3 GLU A 13 -4.815 7.101 -11.764 1.00 0.43 H new ATOM 0 HG2 GLU A 13 -6.516 7.221 -10.225 1.00 1.10 H new ATOM 0 HG3 GLU A 13 -5.238 8.069 -9.376 1.00 1.10 H new ATOM 203 N VAL A 14 -2.856 8.009 -9.372 1.00 0.34 N ATOM 204 CA VAL A 14 -2.329 8.028 -8.023 1.00 0.33 C ATOM 205 C VAL A 14 -1.003 8.766 -8.006 1.00 0.33 C ATOM 206 O VAL A 14 -0.677 9.494 -7.068 1.00 0.36 O ATOM 207 CB VAL A 14 -2.139 6.604 -7.473 1.00 0.32 C ATOM 208 CG1 VAL A 14 -1.086 5.835 -8.235 1.00 0.53 C ATOM 209 CG2 VAL A 14 -1.807 6.650 -6.002 1.00 0.49 C ATOM 0 H VAL A 14 -2.845 7.091 -9.817 1.00 0.34 H new ATOM 0 HA VAL A 14 -3.048 8.542 -7.385 1.00 0.33 H new ATOM 0 HB VAL A 14 -3.082 6.073 -7.607 1.00 0.32 H new ATOM 0 HG11 VAL A 14 -0.987 4.836 -7.811 1.00 0.53 H new ATOM 0 HG12 VAL A 14 -1.379 5.757 -9.282 1.00 0.53 H new ATOM 0 HG13 VAL A 14 -0.131 6.356 -8.163 1.00 0.53 H new ATOM 0 HG21 VAL A 14 -1.675 5.635 -5.627 1.00 0.49 H new ATOM 0 HG22 VAL A 14 -0.886 7.214 -5.854 1.00 0.49 H new ATOM 0 HG23 VAL A 14 -2.620 7.134 -5.461 1.00 0.49 H new ATOM 219 N LEU A 15 -0.250 8.578 -9.072 1.00 0.32 N ATOM 220 CA LEU A 15 0.970 9.288 -9.286 1.00 0.33 C ATOM 221 C LEU A 15 0.656 10.714 -9.653 1.00 0.39 C ATOM 222 O LEU A 15 1.485 11.617 -9.534 1.00 0.43 O ATOM 223 CB LEU A 15 1.714 8.583 -10.385 1.00 0.34 C ATOM 224 CG LEU A 15 2.907 9.311 -10.931 1.00 0.43 C ATOM 225 CD1 LEU A 15 4.037 8.331 -11.090 1.00 0.56 C ATOM 226 CD2 LEU A 15 2.582 9.973 -12.263 1.00 0.60 C ATOM 0 H LEU A 15 -0.481 7.918 -9.815 1.00 0.32 H new ATOM 0 HA LEU A 15 1.588 9.309 -8.388 1.00 0.33 H new ATOM 0 HB2 LEU A 15 2.042 7.613 -10.013 1.00 0.34 H new ATOM 0 HB3 LEU A 15 1.021 8.392 -11.204 1.00 0.34 H new ATOM 0 HG LEU A 15 3.196 10.100 -10.237 1.00 0.43 H new ATOM 0 HD11 LEU A 15 4.912 8.846 -11.486 1.00 0.56 H new ATOM 0 HD12 LEU A 15 4.280 7.896 -10.121 1.00 0.56 H new ATOM 0 HD13 LEU A 15 3.739 7.540 -11.778 1.00 0.56 H new ATOM 0 HD21 LEU A 15 3.464 10.493 -12.636 1.00 0.60 H new ATOM 0 HD22 LEU A 15 2.278 9.213 -12.983 1.00 0.60 H new ATOM 0 HD23 LEU A 15 1.770 10.688 -12.126 1.00 0.60 H new ATOM 238 N GLY A 16 -0.577 10.902 -10.073 1.00 0.43 N ATOM 239 CA GLY A 16 -1.082 12.233 -10.307 1.00 0.50 C ATOM 240 C GLY A 16 -1.068 13.020 -9.020 1.00 0.50 C ATOM 241 O GLY A 16 -0.994 14.246 -9.017 1.00 0.57 O ATOM 0 H GLY A 16 -1.243 10.152 -10.258 1.00 0.43 H new ATOM 0 HA2 GLY A 16 -0.473 12.736 -11.058 1.00 0.50 H new ATOM 0 HA3 GLY A 16 -2.097 12.182 -10.702 1.00 0.50 H new ATOM 245 N TYR A 17 -1.093 12.291 -7.916 1.00 0.45 N ATOM 246 CA TYR A 17 -1.040 12.899 -6.600 1.00 0.48 C ATOM 247 C TYR A 17 0.401 13.016 -6.116 1.00 0.50 C ATOM 248 O TYR A 17 0.725 13.908 -5.337 1.00 0.64 O ATOM 249 CB TYR A 17 -1.872 12.103 -5.597 1.00 0.49 C ATOM 250 CG TYR A 17 -3.362 12.262 -5.776 1.00 0.96 C ATOM 251 CD1 TYR A 17 -3.973 11.927 -6.974 1.00 1.41 C ATOM 252 CD2 TYR A 17 -4.155 12.752 -4.752 1.00 1.59 C ATOM 253 CE1 TYR A 17 -5.336 12.071 -7.147 1.00 2.13 C ATOM 254 CE2 TYR A 17 -5.521 12.901 -4.913 1.00 2.29 C ATOM 255 CZ TYR A 17 -6.107 12.554 -6.096 1.00 2.49 C ATOM 256 OH TYR A 17 -7.463 12.705 -6.282 1.00 3.27 O ATOM 0 H TYR A 17 -1.150 11.273 -7.907 1.00 0.45 H new ATOM 0 HA TYR A 17 -1.462 13.901 -6.678 1.00 0.48 H new ATOM 0 HB2 TYR A 17 -1.616 11.047 -5.684 1.00 0.49 H new ATOM 0 HB3 TYR A 17 -1.602 12.414 -4.588 1.00 0.49 H new ATOM 0 HD1 TYR A 17 -3.373 11.546 -7.787 1.00 1.41 H new ATOM 0 HD2 TYR A 17 -3.699 13.023 -3.811 1.00 1.59 H new ATOM 0 HE1 TYR A 17 -5.797 11.811 -8.088 1.00 2.13 H new ATOM 0 HE2 TYR A 17 -6.122 13.291 -4.105 1.00 2.29 H new ATOM 0 HH TYR A 17 -7.869 13.050 -5.460 1.00 3.27 H new ATOM 266 N ASN A 18 1.275 12.112 -6.563 1.00 0.43 N ATOM 267 CA ASN A 18 2.672 12.163 -6.158 1.00 0.51 C ATOM 268 C ASN A 18 3.387 13.369 -6.774 1.00 0.62 C ATOM 269 O ASN A 18 4.458 13.765 -6.308 1.00 0.77 O ATOM 270 CB ASN A 18 3.372 10.838 -6.509 1.00 0.60 C ATOM 271 CG ASN A 18 4.489 10.976 -7.535 1.00 1.20 C ATOM 272 OD1 ASN A 18 4.250 10.970 -8.738 1.00 2.03 O ATOM 273 ND2 ASN A 18 5.724 11.061 -7.061 1.00 1.65 N ATOM 0 H ASN A 18 1.040 11.348 -7.197 1.00 0.43 H new ATOM 0 HA ASN A 18 2.717 12.292 -5.077 1.00 0.51 H new ATOM 0 HB2 ASN A 18 3.783 10.404 -5.597 1.00 0.60 H new ATOM 0 HB3 ASN A 18 2.629 10.137 -6.889 1.00 0.60 H new ATOM 0 HD21 ASN A 18 6.514 11.124 -7.704 1.00 1.65 H new ATOM 0 HD22 ASN A 18 5.885 11.063 -6.054 1.00 1.65 H new ATOM 280 N ARG A 19 2.787 13.981 -7.795 1.00 0.61 N ATOM 281 CA ARG A 19 3.410 15.151 -8.412 1.00 0.80 C ATOM 282 C ARG A 19 2.541 16.404 -8.267 1.00 0.90 C ATOM 283 O ARG A 19 2.965 17.505 -8.628 1.00 1.10 O ATOM 284 CB ARG A 19 3.758 14.897 -9.891 1.00 0.83 C ATOM 285 CG ARG A 19 2.697 15.340 -10.890 1.00 1.26 C ATOM 286 CD ARG A 19 1.543 14.362 -10.975 1.00 1.01 C ATOM 287 NE ARG A 19 0.466 14.868 -11.826 1.00 1.65 N ATOM 288 CZ ARG A 19 0.043 14.269 -12.938 1.00 1.85 C ATOM 289 NH1 ARG A 19 0.603 13.132 -13.338 1.00 1.70 N ATOM 290 NH2 ARG A 19 -0.948 14.804 -13.643 1.00 2.72 N ATOM 0 H ARG A 19 1.896 13.697 -8.203 1.00 0.61 H new ATOM 0 HA ARG A 19 4.341 15.329 -7.874 1.00 0.80 H new ATOM 0 HB2 ARG A 19 4.690 15.412 -10.122 1.00 0.83 H new ATOM 0 HB3 ARG A 19 3.941 13.831 -10.027 1.00 0.83 H new ATOM 0 HG2 ARG A 19 2.318 16.321 -10.603 1.00 1.26 H new ATOM 0 HG3 ARG A 19 3.151 15.449 -11.875 1.00 1.26 H new ATOM 0 HD2 ARG A 19 1.901 13.410 -11.368 1.00 1.01 H new ATOM 0 HD3 ARG A 19 1.156 14.168 -9.975 1.00 1.01 H new ATOM 0 HE ARG A 19 0.009 15.737 -11.550 1.00 1.65 H new ATOM 0 HH11 ARG A 19 1.358 12.716 -12.793 1.00 1.70 H new ATOM 0 HH12 ARG A 19 0.277 12.675 -14.190 1.00 1.70 H new ATOM 0 HH21 ARG A 19 -1.384 15.672 -13.333 1.00 2.72 H new ATOM 0 HH22 ARG A 19 -1.273 14.346 -14.495 1.00 2.72 H new ATOM 304 N ASP A 20 1.339 16.247 -7.728 1.00 0.87 N ATOM 305 CA ASP A 20 0.452 17.388 -7.519 1.00 1.08 C ATOM 306 C ASP A 20 0.070 17.524 -6.063 1.00 0.94 C ATOM 307 O ASP A 20 -0.274 16.545 -5.407 1.00 1.32 O ATOM 308 CB ASP A 20 -0.818 17.283 -8.343 1.00 1.59 C ATOM 309 CG ASP A 20 -0.663 17.849 -9.739 1.00 1.74 C ATOM 310 OD1 ASP A 20 -0.684 19.090 -9.885 1.00 1.91 O ATOM 311 OD2 ASP A 20 -0.528 17.065 -10.696 1.00 2.16 O ATOM 0 H ASP A 20 0.957 15.350 -7.429 1.00 0.87 H new ATOM 0 HA ASP A 20 1.010 18.268 -7.840 1.00 1.08 H new ATOM 0 HB2 ASP A 20 -1.115 16.237 -8.412 1.00 1.59 H new ATOM 0 HB3 ASP A 20 -1.623 17.810 -7.830 1.00 1.59 H new ATOM 316 N THR A 21 0.110 18.748 -5.564 1.00 0.91 N ATOM 317 CA THR A 21 -0.159 19.001 -4.165 1.00 1.05 C ATOM 318 C THR A 21 -1.036 20.235 -3.981 1.00 1.13 C ATOM 319 O THR A 21 -0.675 21.336 -4.402 1.00 1.46 O ATOM 320 CB THR A 21 1.165 19.169 -3.403 1.00 1.45 C ATOM 321 OG1 THR A 21 1.943 20.226 -3.984 1.00 1.82 O ATOM 322 CG2 THR A 21 1.951 17.874 -3.461 1.00 1.70 C ATOM 0 H THR A 21 0.327 19.581 -6.111 1.00 0.91 H new ATOM 0 HA THR A 21 -0.702 18.146 -3.762 1.00 1.05 H new ATOM 0 HB THR A 21 0.945 19.420 -2.365 1.00 1.45 H new ATOM 0 HG1 THR A 21 1.348 20.859 -4.437 1.00 1.82 H new ATOM 0 HG21 THR A 21 2.890 17.994 -2.920 1.00 1.70 H new ATOM 0 HG22 THR A 21 1.369 17.074 -3.004 1.00 1.70 H new ATOM 0 HG23 THR A 21 2.160 17.622 -4.501 1.00 1.70 H new ATOM 330 N SER A 22 -2.194 20.042 -3.368 1.00 1.05 N ATOM 331 CA SER A 22 -3.131 21.130 -3.143 1.00 1.30 C ATOM 332 C SER A 22 -4.211 20.699 -2.161 1.00 1.31 C ATOM 333 O SER A 22 -4.767 19.607 -2.276 1.00 2.15 O ATOM 334 CB SER A 22 -3.768 21.562 -4.472 1.00 1.67 C ATOM 335 OG SER A 22 -4.683 22.634 -4.296 1.00 2.19 O ATOM 0 H SER A 22 -2.508 19.137 -3.016 1.00 1.05 H new ATOM 0 HA SER A 22 -2.590 21.976 -2.720 1.00 1.30 H new ATOM 0 HB2 SER A 22 -2.986 21.863 -5.169 1.00 1.67 H new ATOM 0 HB3 SER A 22 -4.285 20.713 -4.920 1.00 1.67 H new ATOM 0 HG SER A 22 -5.067 22.882 -5.163 1.00 2.19 H new ATOM 341 N GLY A 23 -4.468 21.541 -1.172 1.00 0.96 N ATOM 342 CA GLY A 23 -5.586 21.317 -0.276 1.00 1.10 C ATOM 343 C GLY A 23 -5.259 20.405 0.888 1.00 0.89 C ATOM 344 O GLY A 23 -6.083 20.223 1.787 1.00 1.01 O ATOM 0 H GLY A 23 -3.921 22.379 -0.972 1.00 0.96 H new ATOM 0 HA2 GLY A 23 -5.928 22.277 0.111 1.00 1.10 H new ATOM 0 HA3 GLY A 23 -6.413 20.888 -0.841 1.00 1.10 H new ATOM 348 N TRP A 24 -4.066 19.835 0.883 1.00 0.79 N ATOM 349 CA TRP A 24 -3.669 18.914 1.933 1.00 0.66 C ATOM 350 C TRP A 24 -2.569 19.520 2.789 1.00 0.67 C ATOM 351 O TRP A 24 -2.233 20.696 2.643 1.00 0.83 O ATOM 352 CB TRP A 24 -3.277 17.552 1.336 1.00 0.71 C ATOM 353 CG TRP A 24 -1.926 17.439 0.696 1.00 0.81 C ATOM 354 CD1 TRP A 24 -0.901 18.338 0.714 1.00 1.34 C ATOM 355 CD2 TRP A 24 -1.452 16.307 -0.037 1.00 0.87 C ATOM 356 NE1 TRP A 24 0.189 17.817 0.079 1.00 1.41 N ATOM 357 CE2 TRP A 24 -0.129 16.580 -0.412 1.00 0.99 C ATOM 358 CE3 TRP A 24 -2.021 15.086 -0.406 1.00 1.36 C ATOM 359 CZ2 TRP A 24 0.639 15.679 -1.133 1.00 1.09 C ATOM 360 CZ3 TRP A 24 -1.256 14.190 -1.126 1.00 1.67 C ATOM 361 CH2 TRP A 24 0.061 14.493 -1.484 1.00 1.37 C ATOM 0 H TRP A 24 -3.358 19.993 0.166 1.00 0.79 H new ATOM 0 HA TRP A 24 -4.518 18.737 2.593 1.00 0.66 H new ATOM 0 HB2 TRP A 24 -3.336 16.807 2.130 1.00 0.71 H new ATOM 0 HB3 TRP A 24 -4.026 17.284 0.591 1.00 0.71 H new ATOM 0 HD1 TRP A 24 -0.945 19.319 1.165 1.00 1.34 H new ATOM 0 HE1 TRP A 24 1.095 18.276 -0.015 1.00 1.41 H new ATOM 0 HE3 TRP A 24 -3.039 14.848 -0.134 1.00 1.36 H new ATOM 0 HZ2 TRP A 24 1.658 15.907 -1.407 1.00 1.09 H new ATOM 0 HZ3 TRP A 24 -1.681 13.241 -1.417 1.00 1.67 H new ATOM 0 HH2 TRP A 24 0.633 13.773 -2.050 1.00 1.37 H new ATOM 372 N LYS A 25 -1.994 18.697 3.644 1.00 0.60 N ATOM 373 CA LYS A 25 -1.087 19.139 4.677 1.00 0.70 C ATOM 374 C LYS A 25 -0.596 17.937 5.442 1.00 0.61 C ATOM 375 O LYS A 25 -1.392 17.073 5.815 1.00 0.59 O ATOM 376 CB LYS A 25 -1.797 20.065 5.659 1.00 0.89 C ATOM 377 CG LYS A 25 -1.432 21.528 5.522 1.00 1.29 C ATOM 378 CD LYS A 25 -2.000 22.324 6.681 1.00 1.62 C ATOM 379 CE LYS A 25 -1.578 21.708 8.004 1.00 2.23 C ATOM 380 NZ LYS A 25 -2.329 22.268 9.155 1.00 2.95 N ATOM 0 H LYS A 25 -2.148 17.689 3.638 1.00 0.60 H new ATOM 0 HA LYS A 25 -0.261 19.673 4.208 1.00 0.70 H new ATOM 0 HB2 LYS A 25 -2.873 19.959 5.525 1.00 0.89 H new ATOM 0 HB3 LYS A 25 -1.568 19.741 6.674 1.00 0.89 H new ATOM 0 HG2 LYS A 25 -0.348 21.638 5.493 1.00 1.29 H new ATOM 0 HG3 LYS A 25 -1.817 21.919 4.580 1.00 1.29 H new ATOM 0 HD2 LYS A 25 -1.653 23.356 6.626 1.00 1.62 H new ATOM 0 HD3 LYS A 25 -3.088 22.349 6.615 1.00 1.62 H new ATOM 0 HE2 LYS A 25 -1.731 20.629 7.964 1.00 2.23 H new ATOM 0 HE3 LYS A 25 -0.511 21.874 8.155 1.00 2.23 H new ATOM 0 HZ1 LYS A 25 -2.005 21.816 10.034 1.00 2.95 H new ATOM 0 HZ2 LYS A 25 -2.164 23.293 9.212 1.00 2.95 H new ATOM 0 HZ3 LYS A 25 -3.345 22.088 9.027 1.00 2.95 H new ATOM 394 N VAL A 26 0.699 17.861 5.671 1.00 0.63 N ATOM 395 CA VAL A 26 1.214 16.836 6.547 1.00 0.58 C ATOM 396 C VAL A 26 0.634 17.023 7.930 1.00 0.66 C ATOM 397 O VAL A 26 0.798 18.067 8.564 1.00 0.80 O ATOM 398 CB VAL A 26 2.743 16.809 6.621 1.00 0.64 C ATOM 399 CG1 VAL A 26 3.289 18.213 6.749 1.00 1.22 C ATOM 400 CG2 VAL A 26 3.192 15.940 7.784 1.00 1.56 C ATOM 0 H VAL A 26 1.400 18.484 5.271 1.00 0.63 H new ATOM 0 HA VAL A 26 0.911 15.877 6.128 1.00 0.58 H new ATOM 0 HB VAL A 26 3.136 16.379 5.700 1.00 0.64 H new ATOM 0 HG11 VAL A 26 4.377 18.177 6.800 1.00 1.22 H new ATOM 0 HG12 VAL A 26 2.986 18.802 5.883 1.00 1.22 H new ATOM 0 HG13 VAL A 26 2.898 18.674 7.656 1.00 1.22 H new ATOM 0 HG21 VAL A 26 4.281 15.927 7.829 1.00 1.56 H new ATOM 0 HG22 VAL A 26 2.795 16.345 8.715 1.00 1.56 H new ATOM 0 HG23 VAL A 26 2.822 14.924 7.643 1.00 1.56 H new ATOM 410 N VAL A 27 -0.061 16.008 8.373 1.00 0.62 N ATOM 411 CA VAL A 27 -0.731 16.051 9.644 1.00 0.73 C ATOM 412 C VAL A 27 0.159 15.424 10.695 1.00 0.76 C ATOM 413 O VAL A 27 0.047 15.719 11.885 1.00 0.90 O ATOM 414 CB VAL A 27 -2.102 15.329 9.594 1.00 0.75 C ATOM 415 CG1 VAL A 27 -1.932 13.839 9.318 1.00 1.21 C ATOM 416 CG2 VAL A 27 -2.883 15.554 10.882 1.00 1.22 C ATOM 0 H VAL A 27 -0.178 15.132 7.864 1.00 0.62 H new ATOM 0 HA VAL A 27 -0.926 17.093 9.898 1.00 0.73 H new ATOM 0 HB VAL A 27 -2.673 15.759 8.771 1.00 0.75 H new ATOM 0 HG11 VAL A 27 -2.911 13.360 9.289 1.00 1.21 H new ATOM 0 HG12 VAL A 27 -1.432 13.701 8.359 1.00 1.21 H new ATOM 0 HG13 VAL A 27 -1.331 13.389 10.108 1.00 1.21 H new ATOM 0 HG21 VAL A 27 -3.841 15.037 10.822 1.00 1.22 H new ATOM 0 HG22 VAL A 27 -2.313 15.165 11.726 1.00 1.22 H new ATOM 0 HG23 VAL A 27 -3.055 16.621 11.022 1.00 1.22 H new ATOM 426 N LYS A 28 1.070 14.565 10.247 1.00 0.65 N ATOM 427 CA LYS A 28 1.864 13.802 11.170 1.00 0.68 C ATOM 428 C LYS A 28 3.172 13.343 10.546 1.00 0.58 C ATOM 429 O LYS A 28 3.195 12.798 9.442 1.00 0.55 O ATOM 430 CB LYS A 28 1.069 12.600 11.689 1.00 0.77 C ATOM 431 CG LYS A 28 1.692 11.975 12.918 1.00 0.87 C ATOM 432 CD LYS A 28 2.145 13.061 13.873 1.00 1.45 C ATOM 433 CE LYS A 28 2.831 12.492 15.103 1.00 2.02 C ATOM 434 NZ LYS A 28 1.847 11.986 16.096 1.00 2.41 N ATOM 0 H LYS A 28 1.266 14.390 9.261 1.00 0.65 H new ATOM 0 HA LYS A 28 2.112 14.454 12.008 1.00 0.68 H new ATOM 0 HB2 LYS A 28 0.052 12.916 11.923 1.00 0.77 H new ATOM 0 HB3 LYS A 28 0.997 11.850 10.902 1.00 0.77 H new ATOM 0 HG2 LYS A 28 0.971 11.323 13.411 1.00 0.87 H new ATOM 0 HG3 LYS A 28 2.540 11.354 12.631 1.00 0.87 H new ATOM 0 HD2 LYS A 28 2.829 13.735 13.357 1.00 1.45 H new ATOM 0 HD3 LYS A 28 1.284 13.654 14.181 1.00 1.45 H new ATOM 0 HE2 LYS A 28 3.498 11.682 14.806 1.00 2.02 H new ATOM 0 HE3 LYS A 28 3.450 13.262 15.564 1.00 2.02 H new ATOM 0 HZ1 LYS A 28 2.352 11.605 16.922 1.00 2.41 H new ATOM 0 HZ2 LYS A 28 1.227 12.764 16.398 1.00 2.41 H new ATOM 0 HZ3 LYS A 28 1.273 11.234 15.664 1.00 2.41 H new ATOM 448 N THR A 29 4.258 13.595 11.255 1.00 0.61 N ATOM 449 CA THR A 29 5.562 13.103 10.869 1.00 0.59 C ATOM 450 C THR A 29 6.140 12.255 11.992 1.00 0.72 C ATOM 451 O THR A 29 5.824 12.474 13.164 1.00 0.88 O ATOM 452 CB THR A 29 6.526 14.257 10.535 1.00 0.75 C ATOM 453 OG1 THR A 29 6.580 15.190 11.626 1.00 1.38 O ATOM 454 CG2 THR A 29 6.087 14.976 9.271 1.00 0.82 C ATOM 0 H THR A 29 4.257 14.146 12.113 1.00 0.61 H new ATOM 0 HA THR A 29 5.443 12.497 9.971 1.00 0.59 H new ATOM 0 HB THR A 29 7.518 13.835 10.372 1.00 0.75 H new ATOM 0 HG1 THR A 29 7.197 15.918 11.403 1.00 1.38 H new ATOM 0 HG21 THR A 29 6.782 15.787 9.054 1.00 0.82 H new ATOM 0 HG22 THR A 29 6.077 14.274 8.438 1.00 0.82 H new ATOM 0 HG23 THR A 29 5.086 15.384 9.413 1.00 0.82 H new ATOM 462 N SER A 30 6.948 11.267 11.643 1.00 0.80 N ATOM 463 CA SER A 30 7.539 10.389 12.641 1.00 1.04 C ATOM 464 C SER A 30 8.894 9.860 12.178 1.00 1.45 C ATOM 465 O SER A 30 9.030 8.677 11.872 1.00 2.37 O ATOM 466 CB SER A 30 6.585 9.227 12.945 1.00 1.24 C ATOM 467 OG SER A 30 5.332 9.707 13.412 1.00 1.93 O ATOM 0 H SER A 30 7.209 11.053 10.680 1.00 0.80 H new ATOM 0 HA SER A 30 7.701 10.965 13.552 1.00 1.04 H new ATOM 0 HB2 SER A 30 6.437 8.628 12.046 1.00 1.24 H new ATOM 0 HB3 SER A 30 7.030 8.573 13.694 1.00 1.24 H new ATOM 0 HG SER A 30 4.740 8.949 13.598 1.00 1.93 H new ATOM 473 N LYS A 31 9.886 10.750 12.122 1.00 1.32 N ATOM 474 CA LYS A 31 11.255 10.383 11.754 1.00 1.71 C ATOM 475 C LYS A 31 11.364 10.132 10.258 1.00 1.47 C ATOM 476 O LYS A 31 11.447 8.987 9.818 1.00 2.02 O ATOM 477 CB LYS A 31 11.782 9.166 12.533 1.00 2.29 C ATOM 478 CG LYS A 31 11.940 9.388 14.033 1.00 2.73 C ATOM 479 CD LYS A 31 10.715 8.920 14.805 1.00 3.59 C ATOM 480 CE LYS A 31 10.468 7.432 14.605 1.00 4.18 C ATOM 481 NZ LYS A 31 11.577 6.604 15.151 1.00 4.55 N ATOM 0 H LYS A 31 9.764 11.741 12.329 1.00 1.32 H new ATOM 0 HA LYS A 31 11.882 11.232 12.026 1.00 1.71 H new ATOM 0 HB2 LYS A 31 11.103 8.328 12.373 1.00 2.29 H new ATOM 0 HB3 LYS A 31 12.748 8.877 12.119 1.00 2.29 H new ATOM 0 HG2 LYS A 31 12.820 8.853 14.389 1.00 2.73 H new ATOM 0 HG3 LYS A 31 12.110 10.447 14.228 1.00 2.73 H new ATOM 0 HD2 LYS A 31 10.850 9.129 15.866 1.00 3.59 H new ATOM 0 HD3 LYS A 31 9.840 9.483 14.479 1.00 3.59 H new ATOM 0 HE2 LYS A 31 9.533 7.151 15.090 1.00 4.18 H new ATOM 0 HE3 LYS A 31 10.350 7.224 13.542 1.00 4.18 H new ATOM 0 HZ1 LYS A 31 11.303 5.601 15.133 1.00 4.55 H new ATOM 0 HZ2 LYS A 31 12.430 6.740 14.572 1.00 4.55 H new ATOM 0 HZ3 LYS A 31 11.775 6.891 16.131 1.00 4.55 H new ATOM 495 N LYS A 32 11.289 11.218 9.491 1.00 0.87 N ATOM 496 CA LYS A 32 11.528 11.206 8.045 1.00 0.69 C ATOM 497 C LYS A 32 10.331 10.717 7.255 1.00 0.51 C ATOM 498 O LYS A 32 10.410 10.559 6.036 1.00 0.59 O ATOM 499 CB LYS A 32 12.742 10.362 7.684 1.00 0.80 C ATOM 500 CG LYS A 32 14.064 10.995 8.078 1.00 1.00 C ATOM 501 CD LYS A 32 15.237 10.299 7.408 1.00 0.93 C ATOM 502 CE LYS A 32 16.542 11.019 7.700 1.00 1.14 C ATOM 503 NZ LYS A 32 17.688 10.425 6.964 1.00 1.42 N ATOM 0 H LYS A 32 11.058 12.142 9.858 1.00 0.87 H new ATOM 0 HA LYS A 32 11.714 12.245 7.772 1.00 0.69 H new ATOM 0 HB2 LYS A 32 12.655 9.390 8.170 1.00 0.80 H new ATOM 0 HB3 LYS A 32 12.742 10.182 6.609 1.00 0.80 H new ATOM 0 HG2 LYS A 32 14.060 12.050 7.803 1.00 1.00 H new ATOM 0 HG3 LYS A 32 14.182 10.949 9.161 1.00 1.00 H new ATOM 0 HD2 LYS A 32 15.301 9.269 7.759 1.00 0.93 H new ATOM 0 HD3 LYS A 32 15.073 10.260 6.331 1.00 0.93 H new ATOM 0 HE2 LYS A 32 16.444 12.070 7.429 1.00 1.14 H new ATOM 0 HE3 LYS A 32 16.743 10.984 8.771 1.00 1.14 H new ATOM 0 HZ1 LYS A 32 18.557 10.948 7.194 1.00 1.42 H new ATOM 0 HZ2 LYS A 32 17.800 9.429 7.241 1.00 1.42 H new ATOM 0 HZ3 LYS A 32 17.510 10.482 5.941 1.00 1.42 H new ATOM 517 N ILE A 33 9.237 10.465 7.937 1.00 0.37 N ATOM 518 CA ILE A 33 8.015 10.080 7.267 1.00 0.33 C ATOM 519 C ILE A 33 6.949 11.134 7.480 1.00 0.36 C ATOM 520 O ILE A 33 6.853 11.733 8.551 1.00 0.46 O ATOM 521 CB ILE A 33 7.518 8.698 7.715 1.00 0.41 C ATOM 522 CG1 ILE A 33 7.624 8.554 9.222 1.00 0.58 C ATOM 523 CG2 ILE A 33 8.326 7.612 7.033 1.00 0.76 C ATOM 524 CD1 ILE A 33 7.069 7.240 9.733 1.00 0.75 C ATOM 0 H ILE A 33 9.168 10.519 8.953 1.00 0.37 H new ATOM 0 HA ILE A 33 8.232 10.006 6.201 1.00 0.33 H new ATOM 0 HB ILE A 33 6.470 8.598 7.431 1.00 0.41 H new ATOM 0 HG12 ILE A 33 8.670 8.639 9.517 1.00 0.58 H new ATOM 0 HG13 ILE A 33 7.091 9.377 9.698 1.00 0.58 H new ATOM 0 HG21 ILE A 33 7.967 6.635 7.356 1.00 0.76 H new ATOM 0 HG22 ILE A 33 8.215 7.700 5.952 1.00 0.76 H new ATOM 0 HG23 ILE A 33 9.377 7.719 7.300 1.00 0.76 H new ATOM 0 HD11 ILE A 33 7.174 7.198 10.817 1.00 0.75 H new ATOM 0 HD12 ILE A 33 6.015 7.162 9.467 1.00 0.75 H new ATOM 0 HD13 ILE A 33 7.619 6.413 9.283 1.00 0.75 H new ATOM 536 N THR A 34 6.155 11.341 6.452 1.00 0.33 N ATOM 537 CA THR A 34 5.324 12.521 6.339 1.00 0.36 C ATOM 538 C THR A 34 3.930 12.145 5.859 1.00 0.36 C ATOM 539 O THR A 34 3.739 11.831 4.689 1.00 0.39 O ATOM 540 CB THR A 34 5.972 13.488 5.326 1.00 0.39 C ATOM 541 OG1 THR A 34 7.387 13.550 5.555 1.00 0.58 O ATOM 542 CG2 THR A 34 5.386 14.879 5.429 1.00 0.56 C ATOM 0 H THR A 34 6.067 10.694 5.668 1.00 0.33 H new ATOM 0 HA THR A 34 5.239 12.997 7.316 1.00 0.36 H new ATOM 0 HB THR A 34 5.769 13.108 4.325 1.00 0.39 H new ATOM 0 HG1 THR A 34 7.817 12.763 5.159 1.00 0.58 H new ATOM 0 HG21 THR A 34 5.867 15.531 4.700 1.00 0.56 H new ATOM 0 HG22 THR A 34 4.315 14.839 5.229 1.00 0.56 H new ATOM 0 HG23 THR A 34 5.553 15.271 6.432 1.00 0.56 H new ATOM 550 N VAL A 35 2.963 12.151 6.760 1.00 0.39 N ATOM 551 CA VAL A 35 1.608 11.777 6.401 1.00 0.40 C ATOM 552 C VAL A 35 0.786 13.028 6.105 1.00 0.40 C ATOM 553 O VAL A 35 0.318 13.705 7.018 1.00 0.44 O ATOM 554 CB VAL A 35 0.941 10.957 7.530 1.00 0.48 C ATOM 555 CG1 VAL A 35 -0.287 10.214 7.019 1.00 0.82 C ATOM 556 CG2 VAL A 35 1.936 9.983 8.141 1.00 0.86 C ATOM 0 H VAL A 35 3.090 12.409 7.739 1.00 0.39 H new ATOM 0 HA VAL A 35 1.649 11.153 5.508 1.00 0.40 H new ATOM 0 HB VAL A 35 0.615 11.653 8.303 1.00 0.48 H new ATOM 0 HG11 VAL A 35 -0.735 9.646 7.835 1.00 0.82 H new ATOM 0 HG12 VAL A 35 -1.013 10.931 6.635 1.00 0.82 H new ATOM 0 HG13 VAL A 35 0.006 9.532 6.221 1.00 0.82 H new ATOM 0 HG21 VAL A 35 1.449 9.415 8.934 1.00 0.86 H new ATOM 0 HG22 VAL A 35 2.295 9.299 7.372 1.00 0.86 H new ATOM 0 HG23 VAL A 35 2.778 10.536 8.556 1.00 0.86 H new ATOM 566 N SER A 36 0.645 13.337 4.827 1.00 0.42 N ATOM 567 CA SER A 36 -0.121 14.492 4.383 1.00 0.42 C ATOM 568 C SER A 36 -1.556 14.099 4.112 1.00 0.43 C ATOM 569 O SER A 36 -1.844 13.213 3.305 1.00 0.47 O ATOM 570 CB SER A 36 0.521 15.125 3.155 1.00 0.45 C ATOM 571 OG SER A 36 -0.138 16.319 2.797 1.00 1.10 O ATOM 0 H SER A 36 1.058 12.795 4.068 1.00 0.42 H new ATOM 0 HA SER A 36 -0.120 15.238 5.178 1.00 0.42 H new ATOM 0 HB2 SER A 36 1.572 15.332 3.356 1.00 0.45 H new ATOM 0 HB3 SER A 36 0.488 14.424 2.321 1.00 0.45 H new ATOM 0 HG SER A 36 -0.365 16.294 1.844 1.00 1.10 H new ATOM 577 N SER A 37 -2.442 14.763 4.819 1.00 0.45 N ATOM 578 CA SER A 37 -3.852 14.465 4.775 1.00 0.48 C ATOM 579 C SER A 37 -4.608 15.567 4.052 1.00 0.53 C ATOM 580 O SER A 37 -4.376 16.756 4.283 1.00 0.59 O ATOM 581 CB SER A 37 -4.388 14.305 6.197 1.00 0.59 C ATOM 582 OG SER A 37 -5.776 14.023 6.196 1.00 1.27 O ATOM 0 H SER A 37 -2.200 15.531 5.445 1.00 0.45 H new ATOM 0 HA SER A 37 -3.998 13.533 4.228 1.00 0.48 H new ATOM 0 HB2 SER A 37 -3.852 13.501 6.701 1.00 0.59 H new ATOM 0 HB3 SER A 37 -4.201 15.217 6.763 1.00 0.59 H new ATOM 0 HG SER A 37 -5.935 13.159 6.630 1.00 1.27 H new ATOM 588 N LYS A 38 -5.507 15.159 3.178 1.00 0.59 N ATOM 589 CA LYS A 38 -6.337 16.097 2.440 1.00 0.76 C ATOM 590 C LYS A 38 -7.809 15.817 2.698 1.00 0.90 C ATOM 591 O LYS A 38 -8.392 16.334 3.651 1.00 1.69 O ATOM 592 CB LYS A 38 -6.063 16.030 0.930 1.00 0.99 C ATOM 593 CG LYS A 38 -6.799 17.101 0.136 1.00 1.06 C ATOM 594 CD LYS A 38 -6.738 16.856 -1.365 1.00 1.11 C ATOM 595 CE LYS A 38 -7.362 15.519 -1.743 1.00 1.44 C ATOM 596 NZ LYS A 38 -7.661 15.430 -3.196 1.00 1.91 N ATOM 0 H LYS A 38 -5.684 14.179 2.959 1.00 0.59 H new ATOM 0 HA LYS A 38 -6.086 17.098 2.791 1.00 0.76 H new ATOM 0 HB2 LYS A 38 -4.992 16.132 0.757 1.00 0.99 H new ATOM 0 HB3 LYS A 38 -6.354 15.048 0.558 1.00 0.99 H new ATOM 0 HG2 LYS A 38 -7.841 17.133 0.454 1.00 1.06 H new ATOM 0 HG3 LYS A 38 -6.367 18.076 0.360 1.00 1.06 H new ATOM 0 HD2 LYS A 38 -7.257 17.660 -1.886 1.00 1.11 H new ATOM 0 HD3 LYS A 38 -5.700 16.880 -1.696 1.00 1.11 H new ATOM 0 HE2 LYS A 38 -6.685 14.712 -1.463 1.00 1.44 H new ATOM 0 HE3 LYS A 38 -8.281 15.375 -1.175 1.00 1.44 H new ATOM 0 HZ1 LYS A 38 -8.084 14.504 -3.407 1.00 1.91 H new ATOM 0 HZ2 LYS A 38 -8.327 16.183 -3.460 1.00 1.91 H new ATOM 0 HZ3 LYS A 38 -6.781 15.540 -3.739 1.00 1.91 H new ATOM 722 N ASN A 46 -11.052 11.240 4.328 1.00 1.06 N ATOM 723 CA ASN A 46 -9.849 11.978 3.999 1.00 0.90 C ATOM 724 C ASN A 46 -8.850 11.068 3.317 1.00 0.81 C ATOM 725 O ASN A 46 -8.859 9.858 3.530 1.00 0.95 O ATOM 726 CB ASN A 46 -9.235 12.575 5.256 1.00 0.91 C ATOM 727 CG ASN A 46 -9.956 13.813 5.752 1.00 1.32 C ATOM 728 OD1 ASN A 46 -10.543 14.563 4.975 1.00 2.05 O ATOM 729 ND2 ASN A 46 -9.915 14.036 7.057 1.00 1.87 N ATOM 0 HA ASN A 46 -10.112 12.788 3.319 1.00 0.90 H new ATOM 0 HB2 ASN A 46 -9.237 11.822 6.045 1.00 0.91 H new ATOM 0 HB3 ASN A 46 -8.193 12.826 5.058 1.00 0.91 H new ATOM 0 HD21 ASN A 46 -10.381 14.854 7.450 1.00 1.87 H new ATOM 0 HD22 ASN A 46 -9.417 13.390 7.669 1.00 1.87 H new ATOM 736 N LEU A 47 -8.018 11.649 2.476 1.00 0.70 N ATOM 737 CA LEU A 47 -6.995 10.891 1.784 1.00 0.62 C ATOM 738 C LEU A 47 -5.661 11.195 2.434 1.00 0.54 C ATOM 739 O LEU A 47 -5.368 12.352 2.743 1.00 0.58 O ATOM 740 CB LEU A 47 -6.968 11.260 0.299 1.00 0.66 C ATOM 741 CG LEU A 47 -6.469 10.166 -0.659 1.00 0.70 C ATOM 742 CD1 LEU A 47 -6.707 10.588 -2.095 1.00 0.77 C ATOM 743 CD2 LEU A 47 -4.996 9.863 -0.451 1.00 0.87 C ATOM 0 H LEU A 47 -8.030 12.645 2.255 1.00 0.70 H new ATOM 0 HA LEU A 47 -7.208 9.824 1.854 1.00 0.62 H new ATOM 0 HB2 LEU A 47 -7.976 11.547 -0.002 1.00 0.66 H new ATOM 0 HB3 LEU A 47 -6.336 12.139 0.175 1.00 0.66 H new ATOM 0 HG LEU A 47 -7.031 9.257 -0.444 1.00 0.70 H new ATOM 0 HD11 LEU A 47 -6.351 9.808 -2.767 1.00 0.77 H new ATOM 0 HD12 LEU A 47 -7.773 10.746 -2.256 1.00 0.77 H new ATOM 0 HD13 LEU A 47 -6.168 11.514 -2.296 1.00 0.77 H new ATOM 0 HD21 LEU A 47 -4.683 9.085 -1.147 1.00 0.87 H new ATOM 0 HD22 LEU A 47 -4.410 10.765 -0.628 1.00 0.87 H new ATOM 0 HD23 LEU A 47 -4.836 9.521 0.571 1.00 0.87 H new ATOM 755 N TYR A 48 -4.859 10.168 2.634 1.00 0.48 N ATOM 756 CA TYR A 48 -3.622 10.314 3.372 1.00 0.45 C ATOM 757 C TYR A 48 -2.454 9.831 2.534 1.00 0.46 C ATOM 758 O TYR A 48 -2.471 8.715 2.014 1.00 0.54 O ATOM 759 CB TYR A 48 -3.683 9.524 4.686 1.00 0.48 C ATOM 760 CG TYR A 48 -4.693 10.037 5.690 1.00 0.53 C ATOM 761 CD1 TYR A 48 -6.047 9.772 5.535 1.00 0.63 C ATOM 762 CD2 TYR A 48 -4.297 10.798 6.785 1.00 0.64 C ATOM 763 CE1 TYR A 48 -6.977 10.246 6.442 1.00 0.76 C ATOM 764 CE2 TYR A 48 -5.220 11.273 7.696 1.00 0.78 C ATOM 765 CZ TYR A 48 -6.541 10.969 7.550 1.00 0.82 C ATOM 766 OH TYR A 48 -7.475 11.467 8.431 1.00 0.99 O ATOM 0 H TYR A 48 -5.043 9.224 2.295 1.00 0.48 H new ATOM 0 HA TYR A 48 -3.482 11.370 3.605 1.00 0.45 H new ATOM 0 HB2 TYR A 48 -3.915 8.484 4.458 1.00 0.48 H new ATOM 0 HB3 TYR A 48 -2.695 9.536 5.147 1.00 0.48 H new ATOM 0 HD1 TYR A 48 -6.380 9.185 4.691 1.00 0.63 H new ATOM 0 HD2 TYR A 48 -3.250 11.021 6.925 1.00 0.64 H new ATOM 0 HE1 TYR A 48 -8.030 10.058 6.293 1.00 0.76 H new ATOM 0 HE2 TYR A 48 -4.895 11.885 8.524 1.00 0.78 H new ATOM 0 HH TYR A 48 -7.020 11.947 9.154 1.00 0.99 H new ATOM 776 N ARG A 49 -1.455 10.679 2.380 1.00 0.45 N ATOM 777 CA ARG A 49 -0.242 10.289 1.685 1.00 0.48 C ATOM 778 C ARG A 49 0.911 10.265 2.663 1.00 0.40 C ATOM 779 O ARG A 49 1.230 11.283 3.267 1.00 0.48 O ATOM 780 CB ARG A 49 0.071 11.245 0.521 1.00 0.59 C ATOM 781 CG ARG A 49 1.304 10.845 -0.294 1.00 0.71 C ATOM 782 CD ARG A 49 2.594 11.441 0.256 1.00 1.32 C ATOM 783 NE ARG A 49 2.642 12.898 0.122 1.00 1.69 N ATOM 784 CZ ARG A 49 3.508 13.542 -0.664 1.00 2.18 C ATOM 785 NH1 ARG A 49 4.325 12.864 -1.459 1.00 2.54 N ATOM 786 NH2 ARG A 49 3.554 14.868 -0.659 1.00 2.92 N ATOM 0 H ARG A 49 -1.458 11.639 2.725 1.00 0.45 H new ATOM 0 HA ARG A 49 -0.390 9.294 1.265 1.00 0.48 H new ATOM 0 HB2 ARG A 49 -0.793 11.289 -0.143 1.00 0.59 H new ATOM 0 HB3 ARG A 49 0.220 12.249 0.918 1.00 0.59 H new ATOM 0 HG2 ARG A 49 1.388 9.758 -0.308 1.00 0.71 H new ATOM 0 HG3 ARG A 49 1.172 11.167 -1.327 1.00 0.71 H new ATOM 0 HD2 ARG A 49 2.694 11.173 1.308 1.00 1.32 H new ATOM 0 HD3 ARG A 49 3.444 11.003 -0.267 1.00 1.32 H new ATOM 0 HE ARG A 49 1.976 13.453 0.660 1.00 1.69 H new ATOM 0 HH11 ARG A 49 4.294 11.845 -1.472 1.00 2.54 H new ATOM 0 HH12 ARG A 49 4.984 13.362 -2.057 1.00 2.54 H new ATOM 0 HH21 ARG A 49 2.927 15.398 -0.054 1.00 2.92 H new ATOM 0 HH22 ARG A 49 4.217 15.358 -1.260 1.00 2.92 H new ATOM 800 N VAL A 50 1.537 9.116 2.820 1.00 0.37 N ATOM 801 CA VAL A 50 2.679 9.024 3.694 1.00 0.42 C ATOM 802 C VAL A 50 3.941 9.020 2.850 1.00 0.46 C ATOM 803 O VAL A 50 3.994 8.403 1.783 1.00 0.62 O ATOM 804 CB VAL A 50 2.614 7.798 4.636 1.00 0.63 C ATOM 805 CG1 VAL A 50 2.780 6.491 3.883 1.00 1.29 C ATOM 806 CG2 VAL A 50 3.650 7.919 5.746 1.00 1.33 C ATOM 0 H VAL A 50 1.275 8.245 2.358 1.00 0.37 H new ATOM 0 HA VAL A 50 2.683 9.893 4.352 1.00 0.42 H new ATOM 0 HB VAL A 50 1.621 7.786 5.085 1.00 0.63 H new ATOM 0 HG11 VAL A 50 2.728 5.658 4.584 1.00 1.29 H new ATOM 0 HG12 VAL A 50 1.985 6.394 3.144 1.00 1.29 H new ATOM 0 HG13 VAL A 50 3.747 6.481 3.380 1.00 1.29 H new ATOM 0 HG21 VAL A 50 3.588 7.047 6.398 1.00 1.33 H new ATOM 0 HG22 VAL A 50 4.647 7.975 5.309 1.00 1.33 H new ATOM 0 HG23 VAL A 50 3.457 8.821 6.327 1.00 1.33 H new ATOM 816 N GLU A 51 4.933 9.739 3.316 1.00 0.37 N ATOM 817 CA GLU A 51 6.110 10.027 2.532 1.00 0.37 C ATOM 818 C GLU A 51 7.337 9.905 3.407 1.00 0.38 C ATOM 819 O GLU A 51 7.580 10.745 4.267 1.00 0.56 O ATOM 820 CB GLU A 51 6.009 11.447 1.970 1.00 0.40 C ATOM 821 CG GLU A 51 7.191 11.849 1.112 1.00 0.47 C ATOM 822 CD GLU A 51 7.211 13.326 0.780 1.00 0.52 C ATOM 823 OE1 GLU A 51 6.122 13.927 0.692 1.00 1.07 O ATOM 824 OE2 GLU A 51 8.305 13.891 0.609 1.00 1.02 O ATOM 0 H GLU A 51 4.947 10.142 4.253 1.00 0.37 H new ATOM 0 HA GLU A 51 6.187 9.319 1.707 1.00 0.37 H new ATOM 0 HB2 GLU A 51 5.097 11.530 1.378 1.00 0.40 H new ATOM 0 HB3 GLU A 51 5.917 12.150 2.798 1.00 0.40 H new ATOM 0 HG2 GLU A 51 8.114 11.587 1.630 1.00 0.47 H new ATOM 0 HG3 GLU A 51 7.171 11.275 0.186 1.00 0.47 H new ATOM 831 N GLY A 52 8.105 8.866 3.191 1.00 0.27 N ATOM 832 CA GLY A 52 9.261 8.643 4.014 1.00 0.29 C ATOM 833 C GLY A 52 10.447 8.198 3.215 1.00 0.25 C ATOM 834 O GLY A 52 10.309 7.446 2.257 1.00 0.29 O ATOM 0 H GLY A 52 7.951 8.171 2.461 1.00 0.27 H new ATOM 0 HA2 GLY A 52 9.508 9.561 4.547 1.00 0.29 H new ATOM 0 HA3 GLY A 52 9.029 7.890 4.767 1.00 0.29 H new ATOM 838 N ILE A 53 11.616 8.663 3.589 1.00 0.24 N ATOM 839 CA ILE A 53 12.818 8.241 2.911 1.00 0.23 C ATOM 840 C ILE A 53 13.340 6.966 3.535 1.00 0.23 C ATOM 841 O ILE A 53 13.552 6.890 4.746 1.00 0.30 O ATOM 842 CB ILE A 53 13.922 9.308 2.947 1.00 0.29 C ATOM 843 CG1 ILE A 53 13.369 10.647 2.461 1.00 0.37 C ATOM 844 CG2 ILE A 53 15.092 8.858 2.077 1.00 0.27 C ATOM 845 CD1 ILE A 53 14.342 11.795 2.605 1.00 0.58 C ATOM 0 H ILE A 53 11.760 9.326 4.350 1.00 0.24 H new ATOM 0 HA ILE A 53 12.552 8.075 1.867 1.00 0.23 H new ATOM 0 HB ILE A 53 14.275 9.435 3.971 1.00 0.29 H new ATOM 0 HG12 ILE A 53 13.084 10.553 1.413 1.00 0.37 H new ATOM 0 HG13 ILE A 53 12.462 10.879 3.019 1.00 0.37 H new ATOM 0 HG21 ILE A 53 15.876 9.615 2.102 1.00 0.27 H new ATOM 0 HG22 ILE A 53 15.486 7.915 2.456 1.00 0.27 H new ATOM 0 HG23 ILE A 53 14.751 8.722 1.051 1.00 0.27 H new ATOM 0 HD11 ILE A 53 13.880 12.712 2.240 1.00 0.58 H new ATOM 0 HD12 ILE A 53 14.609 11.916 3.655 1.00 0.58 H new ATOM 0 HD13 ILE A 53 15.240 11.586 2.024 1.00 0.58 H new ATOM 857 N ILE A 54 13.506 5.958 2.712 1.00 0.24 N ATOM 858 CA ILE A 54 14.087 4.718 3.157 1.00 0.26 C ATOM 859 C ILE A 54 15.500 4.620 2.621 1.00 0.29 C ATOM 860 O ILE A 54 15.708 4.607 1.409 1.00 0.31 O ATOM 861 CB ILE A 54 13.242 3.500 2.724 1.00 0.26 C ATOM 862 CG1 ILE A 54 11.830 3.638 3.292 1.00 0.32 C ATOM 863 CG2 ILE A 54 13.890 2.201 3.195 1.00 0.32 C ATOM 864 CD1 ILE A 54 10.888 2.551 2.862 1.00 0.35 C ATOM 0 H ILE A 54 13.245 5.975 1.726 1.00 0.24 H new ATOM 0 HA ILE A 54 14.107 4.709 4.247 1.00 0.26 H new ATOM 0 HB ILE A 54 13.188 3.468 1.636 1.00 0.26 H new ATOM 0 HG12 ILE A 54 11.887 3.645 4.380 1.00 0.32 H new ATOM 0 HG13 ILE A 54 11.420 4.601 2.988 1.00 0.32 H new ATOM 0 HG21 ILE A 54 13.279 1.355 2.880 1.00 0.32 H new ATOM 0 HG22 ILE A 54 14.885 2.112 2.760 1.00 0.32 H new ATOM 0 HG23 ILE A 54 13.969 2.207 4.282 1.00 0.32 H new ATOM 0 HD11 ILE A 54 9.908 2.722 3.308 1.00 0.35 H new ATOM 0 HD12 ILE A 54 10.799 2.556 1.776 1.00 0.35 H new ATOM 0 HD13 ILE A 54 11.273 1.585 3.190 1.00 0.35 H new ATOM 876 N PRO A 55 16.482 4.653 3.533 1.00 0.36 N ATOM 877 CA PRO A 55 17.908 4.519 3.214 1.00 0.44 C ATOM 878 C PRO A 55 18.229 3.169 2.588 1.00 0.47 C ATOM 879 O PRO A 55 18.889 2.320 3.193 1.00 0.62 O ATOM 880 CB PRO A 55 18.604 4.668 4.575 1.00 0.54 C ATOM 881 CG PRO A 55 17.602 5.352 5.440 1.00 0.53 C ATOM 882 CD PRO A 55 16.263 4.875 4.960 1.00 0.42 C ATOM 0 HA PRO A 55 18.234 5.258 2.482 1.00 0.44 H new ATOM 0 HB2 PRO A 55 18.884 3.698 4.985 1.00 0.54 H new ATOM 0 HB3 PRO A 55 19.519 5.254 4.490 1.00 0.54 H new ATOM 0 HG2 PRO A 55 17.754 5.101 6.490 1.00 0.53 H new ATOM 0 HG3 PRO A 55 17.686 6.435 5.356 1.00 0.53 H new ATOM 0 HD2 PRO A 55 15.955 3.961 5.468 1.00 0.42 H new ATOM 0 HD3 PRO A 55 15.484 5.616 5.138 1.00 0.42 H new ATOM 890 N GLU A 56 17.720 2.982 1.389 1.00 0.43 N ATOM 891 CA GLU A 56 17.945 1.790 0.615 1.00 0.49 C ATOM 892 C GLU A 56 17.624 2.111 -0.835 1.00 0.46 C ATOM 893 O GLU A 56 17.113 3.192 -1.133 1.00 0.60 O ATOM 894 CB GLU A 56 17.051 0.661 1.132 1.00 0.66 C ATOM 895 CG GLU A 56 17.340 -0.690 0.508 1.00 0.77 C ATOM 896 CD GLU A 56 18.744 -1.176 0.796 1.00 1.18 C ATOM 897 OE1 GLU A 56 19.690 -0.702 0.135 1.00 1.68 O ATOM 898 OE2 GLU A 56 18.912 -2.016 1.705 1.00 1.38 O ATOM 0 H GLU A 56 17.129 3.669 0.921 1.00 0.43 H new ATOM 0 HA GLU A 56 18.981 1.462 0.700 1.00 0.49 H new ATOM 0 HB2 GLU A 56 17.170 0.583 2.213 1.00 0.66 H new ATOM 0 HB3 GLU A 56 16.009 0.921 0.944 1.00 0.66 H new ATOM 0 HG2 GLU A 56 16.623 -1.420 0.883 1.00 0.77 H new ATOM 0 HG3 GLU A 56 17.196 -0.626 -0.571 1.00 0.77 H new ATOM 905 N SER A 57 17.915 1.193 -1.731 1.00 0.45 N ATOM 906 CA SER A 57 17.633 1.393 -3.116 1.00 0.45 C ATOM 907 C SER A 57 16.182 1.068 -3.411 1.00 0.43 C ATOM 908 O SER A 57 15.590 0.151 -2.831 1.00 0.43 O ATOM 909 CB SER A 57 18.568 0.531 -3.960 1.00 0.53 C ATOM 910 OG SER A 57 18.671 -0.778 -3.425 1.00 1.18 O ATOM 0 H SER A 57 18.350 0.297 -1.512 1.00 0.45 H new ATOM 0 HA SER A 57 17.800 2.440 -3.370 1.00 0.45 H new ATOM 0 HB2 SER A 57 18.198 0.481 -4.984 1.00 0.53 H new ATOM 0 HB3 SER A 57 19.556 0.991 -4.000 1.00 0.53 H new ATOM 0 HG SER A 57 19.274 -1.313 -3.983 1.00 1.18 H new ATOM 916 N PRO A 58 15.611 1.836 -4.338 1.00 0.44 N ATOM 917 CA PRO A 58 14.221 1.698 -4.776 1.00 0.43 C ATOM 918 C PRO A 58 13.990 0.327 -5.396 1.00 0.46 C ATOM 919 O PRO A 58 12.857 -0.108 -5.596 1.00 0.46 O ATOM 920 CB PRO A 58 14.054 2.824 -5.812 1.00 0.44 C ATOM 921 CG PRO A 58 15.203 3.753 -5.573 1.00 0.49 C ATOM 922 CD PRO A 58 16.314 2.911 -5.034 1.00 0.52 C ATOM 0 HA PRO A 58 13.502 1.776 -3.961 1.00 0.43 H new ATOM 0 HB2 PRO A 58 14.072 2.430 -6.828 1.00 0.44 H new ATOM 0 HB3 PRO A 58 13.100 3.337 -5.686 1.00 0.44 H new ATOM 0 HG2 PRO A 58 15.502 4.248 -6.497 1.00 0.49 H new ATOM 0 HG3 PRO A 58 14.930 4.536 -4.866 1.00 0.49 H new ATOM 0 HD2 PRO A 58 16.950 2.526 -5.831 1.00 0.52 H new ATOM 0 HD3 PRO A 58 16.956 3.476 -4.358 1.00 0.52 H new ATOM 930 N ALA A 59 15.097 -0.345 -5.672 1.00 0.50 N ATOM 931 CA ALA A 59 15.084 -1.701 -6.169 1.00 0.54 C ATOM 932 C ALA A 59 14.621 -2.665 -5.102 1.00 0.50 C ATOM 933 O ALA A 59 13.714 -3.459 -5.327 1.00 0.51 O ATOM 934 CB ALA A 59 16.471 -2.092 -6.634 1.00 0.64 C ATOM 0 H ALA A 59 16.033 0.043 -5.555 1.00 0.50 H new ATOM 0 HA ALA A 59 14.388 -1.749 -7.006 1.00 0.54 H new ATOM 0 HB1 ALA A 59 16.454 -3.116 -7.008 1.00 0.64 H new ATOM 0 HB2 ALA A 59 16.791 -1.420 -7.431 1.00 0.64 H new ATOM 0 HB3 ALA A 59 17.168 -2.022 -5.799 1.00 0.64 H new ATOM 940 N LYS A 60 15.240 -2.586 -3.937 1.00 0.49 N ATOM 941 CA LYS A 60 14.902 -3.476 -2.849 1.00 0.49 C ATOM 942 C LYS A 60 13.541 -3.100 -2.315 1.00 0.42 C ATOM 943 O LYS A 60 12.805 -3.931 -1.782 1.00 0.43 O ATOM 944 CB LYS A 60 15.943 -3.389 -1.765 1.00 0.58 C ATOM 945 CG LYS A 60 15.964 -4.609 -0.871 1.00 0.65 C ATOM 946 CD LYS A 60 17.155 -4.551 0.042 1.00 1.35 C ATOM 947 CE LYS A 60 18.423 -4.311 -0.756 1.00 2.45 C ATOM 948 NZ LYS A 60 19.606 -4.070 0.109 1.00 3.30 N ATOM 0 H LYS A 60 15.978 -1.915 -3.724 1.00 0.49 H new ATOM 0 HA LYS A 60 14.876 -4.505 -3.207 1.00 0.49 H new ATOM 0 HB2 LYS A 60 16.925 -3.261 -2.220 1.00 0.58 H new ATOM 0 HB3 LYS A 60 15.756 -2.503 -1.158 1.00 0.58 H new ATOM 0 HG2 LYS A 60 15.047 -4.657 -0.284 1.00 0.65 H new ATOM 0 HG3 LYS A 60 16.003 -5.514 -1.477 1.00 0.65 H new ATOM 0 HD2 LYS A 60 17.022 -3.754 0.773 1.00 1.35 H new ATOM 0 HD3 LYS A 60 17.240 -5.484 0.599 1.00 1.35 H new ATOM 0 HE2 LYS A 60 18.614 -5.173 -1.395 1.00 2.45 H new ATOM 0 HE3 LYS A 60 18.277 -3.454 -1.413 1.00 2.45 H new ATOM 0 HZ1 LYS A 60 20.319 -3.529 -0.421 1.00 3.30 H new ATOM 0 HZ2 LYS A 60 19.317 -3.531 0.950 1.00 3.30 H new ATOM 0 HZ3 LYS A 60 20.011 -4.981 0.405 1.00 3.30 H new ATOM 962 N LEU A 61 13.219 -1.829 -2.471 1.00 0.37 N ATOM 963 CA LEU A 61 11.903 -1.331 -2.128 1.00 0.35 C ATOM 964 C LEU A 61 10.854 -1.979 -3.020 1.00 0.38 C ATOM 965 O LEU A 61 9.901 -2.581 -2.530 1.00 0.41 O ATOM 966 CB LEU A 61 11.864 0.189 -2.249 1.00 0.34 C ATOM 967 CG LEU A 61 12.648 0.944 -1.167 1.00 0.31 C ATOM 968 CD1 LEU A 61 12.474 2.438 -1.329 1.00 0.34 C ATOM 969 CD2 LEU A 61 12.177 0.521 0.206 1.00 0.30 C ATOM 0 H LEU A 61 13.856 -1.121 -2.835 1.00 0.37 H new ATOM 0 HA LEU A 61 11.681 -1.591 -1.093 1.00 0.35 H new ATOM 0 HB2 LEU A 61 12.257 0.471 -3.226 1.00 0.34 H new ATOM 0 HB3 LEU A 61 10.824 0.515 -2.218 1.00 0.34 H new ATOM 0 HG LEU A 61 13.705 0.701 -1.275 1.00 0.31 H new ATOM 0 HD11 LEU A 61 13.037 2.956 -0.553 1.00 0.34 H new ATOM 0 HD12 LEU A 61 12.841 2.743 -2.309 1.00 0.34 H new ATOM 0 HD13 LEU A 61 11.418 2.693 -1.242 1.00 0.34 H new ATOM 0 HD21 LEU A 61 12.740 1.063 0.966 1.00 0.30 H new ATOM 0 HD22 LEU A 61 11.116 0.745 0.312 1.00 0.30 H new ATOM 0 HD23 LEU A 61 12.336 -0.550 0.331 1.00 0.30 H new ATOM 981 N SER A 62 11.059 -1.898 -4.326 1.00 0.41 N ATOM 982 CA SER A 62 10.175 -2.552 -5.278 1.00 0.46 C ATOM 983 C SER A 62 10.270 -4.069 -5.134 1.00 0.46 C ATOM 984 O SER A 62 9.444 -4.806 -5.675 1.00 0.50 O ATOM 985 CB SER A 62 10.527 -2.125 -6.709 1.00 0.53 C ATOM 986 OG SER A 62 9.637 -2.694 -7.656 1.00 1.29 O ATOM 0 H SER A 62 11.831 -1.385 -4.751 1.00 0.41 H new ATOM 0 HA SER A 62 9.149 -2.249 -5.068 1.00 0.46 H new ATOM 0 HB2 SER A 62 10.493 -1.038 -6.784 1.00 0.53 H new ATOM 0 HB3 SER A 62 11.548 -2.429 -6.940 1.00 0.53 H new ATOM 0 HG SER A 62 9.239 -3.508 -7.283 1.00 1.29 H new ATOM 992 N ASP A 63 11.268 -4.525 -4.392 1.00 0.44 N ATOM 993 CA ASP A 63 11.467 -5.954 -4.185 1.00 0.48 C ATOM 994 C ASP A 63 10.578 -6.487 -3.057 1.00 0.49 C ATOM 995 O ASP A 63 10.007 -7.572 -3.170 1.00 0.60 O ATOM 996 CB ASP A 63 12.937 -6.238 -3.872 1.00 0.53 C ATOM 997 CG ASP A 63 13.493 -7.419 -4.642 1.00 0.87 C ATOM 998 OD1 ASP A 63 13.395 -8.559 -4.153 1.00 1.32 O ATOM 999 OD2 ASP A 63 14.072 -7.204 -5.726 1.00 1.10 O ATOM 0 H ASP A 63 11.951 -3.930 -3.924 1.00 0.44 H new ATOM 0 HA ASP A 63 11.186 -6.468 -5.104 1.00 0.48 H new ATOM 0 HB2 ASP A 63 13.529 -5.352 -4.101 1.00 0.53 H new ATOM 0 HB3 ASP A 63 13.045 -6.426 -2.804 1.00 0.53 H new ATOM 1004 N PHE A 64 10.437 -5.719 -1.974 1.00 0.44 N ATOM 1005 CA PHE A 64 9.712 -6.206 -0.798 1.00 0.48 C ATOM 1006 C PHE A 64 8.196 -6.055 -0.980 1.00 0.51 C ATOM 1007 O PHE A 64 7.440 -6.971 -0.667 1.00 0.61 O ATOM 1008 CB PHE A 64 10.173 -5.493 0.498 1.00 0.51 C ATOM 1009 CG PHE A 64 9.605 -4.113 0.684 1.00 0.46 C ATOM 1010 CD1 PHE A 64 8.379 -3.935 1.284 1.00 0.59 C ATOM 1011 CD2 PHE A 64 10.315 -2.992 0.283 1.00 0.50 C ATOM 1012 CE1 PHE A 64 7.870 -2.670 1.483 1.00 0.59 C ATOM 1013 CE2 PHE A 64 9.816 -1.728 0.487 1.00 0.50 C ATOM 1014 CZ PHE A 64 8.526 -1.579 0.965 1.00 0.47 C ATOM 0 H PHE A 64 10.808 -4.773 -1.886 1.00 0.44 H new ATOM 0 HA PHE A 64 9.945 -7.266 -0.697 1.00 0.48 H new ATOM 0 HB2 PHE A 64 9.893 -6.106 1.355 1.00 0.51 H new ATOM 0 HB3 PHE A 64 11.261 -5.427 0.495 1.00 0.51 H new ATOM 0 HD1 PHE A 64 7.810 -4.796 1.602 1.00 0.59 H new ATOM 0 HD2 PHE A 64 11.275 -3.114 -0.197 1.00 0.50 H new ATOM 0 HE1 PHE A 64 6.957 -2.536 2.045 1.00 0.59 H new ATOM 0 HE2 PHE A 64 10.424 -0.860 0.277 1.00 0.50 H new ATOM 0 HZ PHE A 64 8.040 -0.615 0.931 1.00 0.47 H new ATOM 1024 N LEU A 65 7.755 -4.913 -1.517 1.00 0.49 N ATOM 1025 CA LEU A 65 6.328 -4.594 -1.601 1.00 0.58 C ATOM 1026 C LEU A 65 5.716 -5.190 -2.861 1.00 0.64 C ATOM 1027 O LEU A 65 4.562 -4.929 -3.180 1.00 0.81 O ATOM 1028 CB LEU A 65 6.114 -3.058 -1.518 1.00 0.66 C ATOM 1029 CG LEU A 65 6.270 -2.199 -2.801 1.00 0.78 C ATOM 1030 CD1 LEU A 65 7.308 -2.740 -3.761 1.00 1.25 C ATOM 1031 CD2 LEU A 65 4.942 -2.029 -3.511 1.00 1.50 C ATOM 0 H LEU A 65 8.368 -4.193 -1.900 1.00 0.49 H new ATOM 0 HA LEU A 65 5.813 -5.044 -0.752 1.00 0.58 H new ATOM 0 HB2 LEU A 65 5.110 -2.888 -1.130 1.00 0.66 H new ATOM 0 HB3 LEU A 65 6.812 -2.670 -0.777 1.00 0.66 H new ATOM 0 HG LEU A 65 6.625 -1.225 -2.465 1.00 0.78 H new ATOM 0 HD11 LEU A 65 7.367 -2.093 -4.636 1.00 1.25 H new ATOM 0 HD12 LEU A 65 8.279 -2.771 -3.267 1.00 1.25 H new ATOM 0 HD13 LEU A 65 7.027 -3.746 -4.072 1.00 1.25 H new ATOM 0 HD21 LEU A 65 5.083 -1.423 -4.406 1.00 1.50 H new ATOM 0 HD22 LEU A 65 4.552 -3.007 -3.793 1.00 1.50 H new ATOM 0 HD23 LEU A 65 4.234 -1.534 -2.846 1.00 1.50 H new ATOM 1043 N TYR A 66 6.497 -6.041 -3.521 1.00 0.58 N ATOM 1044 CA TYR A 66 6.181 -6.534 -4.859 1.00 0.64 C ATOM 1045 C TYR A 66 4.694 -6.915 -5.017 1.00 0.72 C ATOM 1046 O TYR A 66 3.954 -6.210 -5.695 1.00 0.89 O ATOM 1047 CB TYR A 66 7.083 -7.721 -5.197 1.00 0.73 C ATOM 1048 CG TYR A 66 7.272 -7.949 -6.682 1.00 0.88 C ATOM 1049 CD1 TYR A 66 7.148 -6.904 -7.592 1.00 0.82 C ATOM 1050 CD2 TYR A 66 7.595 -9.207 -7.173 1.00 1.27 C ATOM 1051 CE1 TYR A 66 7.340 -7.108 -8.946 1.00 1.01 C ATOM 1052 CE2 TYR A 66 7.786 -9.420 -8.526 1.00 1.47 C ATOM 1053 CZ TYR A 66 7.658 -8.367 -9.407 1.00 1.29 C ATOM 1054 OH TYR A 66 7.858 -8.571 -10.754 1.00 1.52 O ATOM 0 H TYR A 66 7.369 -6.409 -3.142 1.00 0.58 H new ATOM 0 HA TYR A 66 6.367 -5.721 -5.561 1.00 0.64 H new ATOM 0 HB2 TYR A 66 8.059 -7.565 -4.737 1.00 0.73 H new ATOM 0 HB3 TYR A 66 6.661 -8.622 -4.752 1.00 0.73 H new ATOM 0 HD1 TYR A 66 6.897 -5.916 -7.235 1.00 0.82 H new ATOM 0 HD2 TYR A 66 7.699 -10.034 -6.486 1.00 1.27 H new ATOM 0 HE1 TYR A 66 7.241 -6.285 -9.638 1.00 1.01 H new ATOM 0 HE2 TYR A 66 8.034 -10.406 -8.891 1.00 1.47 H new ATOM 0 HH TYR A 66 8.076 -9.513 -10.913 1.00 1.52 H new ATOM 1064 N GLN A 67 4.243 -8.015 -4.395 1.00 0.89 N ATOM 1065 CA GLN A 67 2.821 -8.377 -4.471 1.00 1.13 C ATOM 1066 C GLN A 67 2.344 -9.378 -3.409 1.00 1.10 C ATOM 1067 O GLN A 67 1.418 -9.080 -2.658 1.00 1.76 O ATOM 1068 CB GLN A 67 2.435 -8.918 -5.866 1.00 1.54 C ATOM 1069 CG GLN A 67 3.588 -9.274 -6.814 1.00 2.13 C ATOM 1070 CD GLN A 67 4.482 -10.423 -6.354 1.00 2.94 C ATOM 1071 OE1 GLN A 67 4.762 -10.602 -5.168 1.00 3.50 O ATOM 1072 NE2 GLN A 67 4.921 -11.228 -7.304 1.00 3.60 N ATOM 0 H GLN A 67 4.823 -8.652 -3.849 1.00 0.89 H new ATOM 0 HA GLN A 67 2.313 -7.434 -4.272 1.00 1.13 H new ATOM 0 HB2 GLN A 67 1.822 -9.809 -5.727 1.00 1.54 H new ATOM 0 HB3 GLN A 67 1.809 -8.174 -6.358 1.00 1.54 H new ATOM 0 HG2 GLN A 67 3.170 -9.529 -7.788 1.00 2.13 H new ATOM 0 HG3 GLN A 67 4.207 -8.388 -6.955 1.00 2.13 H new ATOM 0 HE21 GLN A 67 4.671 -11.052 -8.277 1.00 3.60 H new ATOM 0 HE22 GLN A 67 5.510 -12.026 -7.065 1.00 3.60 H new ATOM 1081 N THR A 68 2.954 -10.554 -3.336 1.00 0.83 N ATOM 1082 CA THR A 68 2.321 -11.682 -2.659 1.00 0.93 C ATOM 1083 C THR A 68 3.333 -12.746 -2.235 1.00 1.09 C ATOM 1084 O THR A 68 2.977 -13.899 -2.018 1.00 1.39 O ATOM 1085 CB THR A 68 1.309 -12.305 -3.658 1.00 1.18 C ATOM 1086 OG1 THR A 68 0.582 -13.380 -3.081 1.00 1.48 O ATOM 1087 CG2 THR A 68 2.036 -12.808 -4.899 1.00 1.29 C ATOM 0 H THR A 68 3.873 -10.752 -3.731 1.00 0.83 H new ATOM 0 HA THR A 68 1.835 -11.326 -1.750 1.00 0.93 H new ATOM 0 HB THR A 68 0.602 -11.520 -3.927 1.00 1.18 H new ATOM 0 HG1 THR A 68 1.173 -13.897 -2.495 1.00 1.48 H new ATOM 0 HG21 THR A 68 1.315 -13.243 -5.592 1.00 1.29 H new ATOM 0 HG22 THR A 68 2.548 -11.976 -5.383 1.00 1.29 H new ATOM 0 HG23 THR A 68 2.765 -13.565 -4.612 1.00 1.29 H new ATOM 1095 N GLY A 69 4.584 -12.362 -2.065 1.00 1.06 N ATOM 1096 CA GLY A 69 5.610 -13.378 -1.957 1.00 1.39 C ATOM 1097 C GLY A 69 6.512 -13.267 -0.750 1.00 1.17 C ATOM 1098 O GLY A 69 7.417 -14.082 -0.582 1.00 1.46 O ATOM 0 H GLY A 69 4.905 -11.396 -2.001 1.00 1.06 H new ATOM 0 HA2 GLY A 69 5.128 -14.356 -1.940 1.00 1.39 H new ATOM 0 HA3 GLY A 69 6.227 -13.343 -2.855 1.00 1.39 H new ATOM 1102 N ASP A 70 6.275 -12.286 0.102 1.00 0.84 N ATOM 1103 CA ASP A 70 7.236 -11.969 1.155 1.00 0.83 C ATOM 1104 C ASP A 70 6.672 -10.922 2.103 1.00 0.65 C ATOM 1105 O ASP A 70 6.781 -11.042 3.312 1.00 0.61 O ATOM 1106 CB ASP A 70 8.529 -11.465 0.502 1.00 1.12 C ATOM 1107 CG ASP A 70 9.565 -10.973 1.488 1.00 1.45 C ATOM 1108 OD1 ASP A 70 10.047 -11.776 2.311 1.00 2.19 O ATOM 1109 OD2 ASP A 70 9.915 -9.779 1.422 1.00 1.68 O ATOM 0 H ASP A 70 5.440 -11.700 0.091 1.00 0.84 H new ATOM 0 HA ASP A 70 7.444 -12.864 1.741 1.00 0.83 H new ATOM 0 HB2 ASP A 70 8.961 -12.270 -0.092 1.00 1.12 H new ATOM 0 HB3 ASP A 70 8.285 -10.656 -0.187 1.00 1.12 H new ATOM 1114 N ARG A 71 5.997 -9.942 1.531 1.00 0.60 N ATOM 1115 CA ARG A 71 5.500 -8.786 2.262 1.00 0.51 C ATOM 1116 C ARG A 71 4.632 -9.207 3.444 1.00 0.43 C ATOM 1117 O ARG A 71 4.729 -8.640 4.518 1.00 0.49 O ATOM 1118 CB ARG A 71 4.725 -7.846 1.316 1.00 0.59 C ATOM 1119 CG ARG A 71 3.287 -8.262 1.000 1.00 0.83 C ATOM 1120 CD ARG A 71 3.151 -9.067 -0.283 1.00 0.87 C ATOM 1121 NE ARG A 71 4.371 -9.792 -0.663 1.00 1.77 N ATOM 1122 CZ ARG A 71 5.345 -9.242 -1.406 1.00 2.46 C ATOM 1123 NH1 ARG A 71 5.196 -8.007 -1.842 1.00 2.69 N ATOM 1124 NH2 ARG A 71 6.452 -9.922 -1.713 1.00 3.38 N ATOM 0 H ARG A 71 5.775 -9.924 0.536 1.00 0.60 H new ATOM 0 HA ARG A 71 6.357 -8.245 2.662 1.00 0.51 H new ATOM 0 HB2 ARG A 71 4.707 -6.850 1.758 1.00 0.59 H new ATOM 0 HB3 ARG A 71 5.276 -7.769 0.379 1.00 0.59 H new ATOM 0 HG2 ARG A 71 2.898 -8.851 1.831 1.00 0.83 H new ATOM 0 HG3 ARG A 71 2.668 -7.368 0.925 1.00 0.83 H new ATOM 0 HD2 ARG A 71 2.336 -9.782 -0.167 1.00 0.87 H new ATOM 0 HD3 ARG A 71 2.872 -8.395 -1.094 1.00 0.87 H new ATOM 0 HE ARG A 71 4.483 -10.756 -0.349 1.00 1.77 H new ATOM 0 HH11 ARG A 71 4.350 -7.484 -1.614 1.00 2.69 H new ATOM 0 HH12 ARG A 71 5.926 -7.574 -2.408 1.00 2.69 H new ATOM 0 HH21 ARG A 71 6.571 -10.879 -1.382 1.00 3.38 H new ATOM 0 HH22 ARG A 71 7.179 -9.484 -2.279 1.00 3.38 H new ATOM 1138 N ILE A 72 3.829 -10.245 3.255 1.00 0.44 N ATOM 1139 CA ILE A 72 2.901 -10.685 4.294 1.00 0.44 C ATOM 1140 C ILE A 72 3.577 -11.637 5.255 1.00 0.54 C ATOM 1141 O ILE A 72 2.998 -12.034 6.265 1.00 0.64 O ATOM 1142 CB ILE A 72 1.652 -11.400 3.725 1.00 0.45 C ATOM 1143 CG1 ILE A 72 1.994 -12.781 3.145 1.00 0.62 C ATOM 1144 CG2 ILE A 72 0.986 -10.549 2.670 1.00 0.47 C ATOM 1145 CD1 ILE A 72 2.779 -12.745 1.843 1.00 0.71 C ATOM 0 H ILE A 72 3.799 -10.797 2.398 1.00 0.44 H new ATOM 0 HA ILE A 72 2.584 -9.775 4.804 1.00 0.44 H new ATOM 0 HB ILE A 72 0.962 -11.548 4.556 1.00 0.45 H new ATOM 0 HG12 ILE A 72 2.568 -13.339 3.885 1.00 0.62 H new ATOM 0 HG13 ILE A 72 1.067 -13.331 2.980 1.00 0.62 H new ATOM 0 HG21 ILE A 72 0.110 -11.069 2.282 1.00 0.47 H new ATOM 0 HG22 ILE A 72 0.679 -9.599 3.109 1.00 0.47 H new ATOM 0 HG23 ILE A 72 1.687 -10.363 1.856 1.00 0.47 H new ATOM 0 HD11 ILE A 72 2.975 -13.764 1.508 1.00 0.71 H new ATOM 0 HD12 ILE A 72 2.201 -12.219 1.084 1.00 0.71 H new ATOM 0 HD13 ILE A 72 3.725 -12.227 2.003 1.00 0.71 H new ATOM 1157 N THR A 73 4.791 -12.027 4.932 1.00 0.59 N ATOM 1158 CA THR A 73 5.471 -13.003 5.736 1.00 0.72 C ATOM 1159 C THR A 73 6.273 -12.300 6.826 1.00 0.74 C ATOM 1160 O THR A 73 6.510 -12.861 7.896 1.00 0.88 O ATOM 1161 CB THR A 73 6.377 -13.920 4.871 1.00 0.81 C ATOM 1162 OG1 THR A 73 6.427 -15.240 5.423 1.00 0.97 O ATOM 1163 CG2 THR A 73 7.793 -13.373 4.759 1.00 0.80 C ATOM 0 H THR A 73 5.317 -11.685 4.128 1.00 0.59 H new ATOM 0 HA THR A 73 4.727 -13.646 6.207 1.00 0.72 H new ATOM 0 HB THR A 73 5.939 -13.952 3.873 1.00 0.81 H new ATOM 0 HG1 THR A 73 7.001 -15.806 4.865 1.00 0.97 H new ATOM 0 HG21 THR A 73 8.395 -14.044 4.146 1.00 0.80 H new ATOM 0 HG22 THR A 73 7.766 -12.386 4.298 1.00 0.80 H new ATOM 0 HG23 THR A 73 8.233 -13.297 5.753 1.00 0.80 H new ATOM 1171 N TRP A 74 6.671 -11.056 6.565 1.00 0.64 N ATOM 1172 CA TRP A 74 7.425 -10.298 7.564 1.00 0.66 C ATOM 1173 C TRP A 74 6.625 -9.132 8.143 1.00 0.63 C ATOM 1174 O TRP A 74 7.084 -8.461 9.069 1.00 0.75 O ATOM 1175 CB TRP A 74 8.745 -9.789 6.973 1.00 0.66 C ATOM 1176 CG TRP A 74 8.601 -9.067 5.664 1.00 0.59 C ATOM 1177 CD1 TRP A 74 8.949 -9.535 4.432 1.00 0.66 C ATOM 1178 CD2 TRP A 74 8.075 -7.752 5.448 1.00 0.53 C ATOM 1179 NE1 TRP A 74 8.688 -8.596 3.477 1.00 0.65 N ATOM 1180 CE2 TRP A 74 8.149 -7.497 4.068 1.00 0.58 C ATOM 1181 CE3 TRP A 74 7.553 -6.767 6.281 1.00 0.52 C ATOM 1182 CZ2 TRP A 74 7.718 -6.306 3.506 1.00 0.62 C ATOM 1183 CZ3 TRP A 74 7.126 -5.585 5.723 1.00 0.56 C ATOM 1184 CH2 TRP A 74 7.210 -5.360 4.345 1.00 0.61 C ATOM 0 H TRP A 74 6.490 -10.560 5.692 1.00 0.64 H new ATOM 0 HA TRP A 74 7.637 -10.984 8.384 1.00 0.66 H new ATOM 0 HB2 TRP A 74 9.217 -9.120 7.693 1.00 0.66 H new ATOM 0 HB3 TRP A 74 9.418 -10.636 6.835 1.00 0.66 H new ATOM 0 HD1 TRP A 74 9.371 -10.510 4.239 1.00 0.66 H new ATOM 0 HE1 TRP A 74 8.869 -8.702 2.479 1.00 0.65 H new ATOM 0 HE3 TRP A 74 7.484 -6.928 7.347 1.00 0.52 H new ATOM 0 HZ2 TRP A 74 7.782 -6.134 2.442 1.00 0.62 H new ATOM 0 HZ3 TRP A 74 6.718 -4.815 6.361 1.00 0.56 H new ATOM 0 HH2 TRP A 74 6.866 -4.420 3.939 1.00 0.61 H new ATOM 1195 N ASP A 75 5.430 -8.909 7.610 1.00 0.55 N ATOM 1196 CA ASP A 75 4.641 -7.718 7.938 1.00 0.58 C ATOM 1197 C ASP A 75 4.095 -7.757 9.368 1.00 0.58 C ATOM 1198 O ASP A 75 4.218 -8.755 10.081 1.00 0.73 O ATOM 1199 CB ASP A 75 3.475 -7.587 6.960 1.00 0.83 C ATOM 1200 CG ASP A 75 2.995 -6.155 6.784 1.00 1.44 C ATOM 1201 OD1 ASP A 75 2.286 -5.640 7.679 1.00 1.44 O ATOM 1202 OD2 ASP A 75 3.316 -5.548 5.748 1.00 2.19 O ATOM 0 H ASP A 75 4.980 -9.538 6.945 1.00 0.55 H new ATOM 0 HA ASP A 75 5.306 -6.858 7.858 1.00 0.58 H new ATOM 0 HB2 ASP A 75 3.777 -7.983 5.991 1.00 0.83 H new ATOM 0 HB3 ASP A 75 2.645 -8.200 7.311 1.00 0.83 H new ATOM 1207 N LYS A 76 3.474 -6.654 9.757 1.00 0.58 N ATOM 1208 CA LYS A 76 2.891 -6.490 11.086 1.00 0.65 C ATOM 1209 C LYS A 76 1.382 -6.560 10.983 1.00 0.62 C ATOM 1210 O LYS A 76 0.687 -6.944 11.922 1.00 0.75 O ATOM 1211 CB LYS A 76 3.238 -5.118 11.676 1.00 0.88 C ATOM 1212 CG LYS A 76 4.358 -4.407 10.995 1.00 0.78 C ATOM 1213 CD LYS A 76 5.669 -4.672 11.653 1.00 1.63 C ATOM 1214 CE LYS A 76 6.574 -3.520 11.376 1.00 1.97 C ATOM 1215 NZ LYS A 76 7.978 -3.792 11.775 1.00 3.19 N ATOM 0 H LYS A 76 3.358 -5.838 9.156 1.00 0.58 H new ATOM 0 HA LYS A 76 3.289 -7.280 11.723 1.00 0.65 H new ATOM 0 HB2 LYS A 76 2.350 -4.487 11.638 1.00 0.88 H new ATOM 0 HB3 LYS A 76 3.494 -5.245 12.728 1.00 0.88 H new ATOM 0 HG2 LYS A 76 4.406 -4.720 9.952 1.00 0.78 H new ATOM 0 HG3 LYS A 76 4.161 -3.335 10.997 1.00 0.78 H new ATOM 0 HD2 LYS A 76 5.536 -4.800 12.727 1.00 1.63 H new ATOM 0 HD3 LYS A 76 6.104 -5.596 11.273 1.00 1.63 H new ATOM 0 HE2 LYS A 76 6.541 -3.284 10.312 1.00 1.97 H new ATOM 0 HE3 LYS A 76 6.212 -2.641 11.909 1.00 1.97 H new ATOM 0 HZ1 LYS A 76 8.567 -2.961 11.562 1.00 3.19 H new ATOM 0 HZ2 LYS A 76 8.017 -3.991 12.795 1.00 3.19 H new ATOM 0 HZ3 LYS A 76 8.336 -4.614 11.248 1.00 3.19 H new ATOM 1229 N SER A 77 0.889 -6.151 9.829 1.00 0.61 N ATOM 1230 CA SER A 77 -0.536 -5.996 9.619 1.00 0.72 C ATOM 1231 C SER A 77 -0.988 -6.731 8.368 1.00 0.61 C ATOM 1232 O SER A 77 -2.038 -6.436 7.808 1.00 0.65 O ATOM 1233 CB SER A 77 -0.880 -4.510 9.510 1.00 0.91 C ATOM 1234 OG SER A 77 -0.366 -3.792 10.623 1.00 1.58 O ATOM 0 H SER A 77 1.461 -5.919 9.017 1.00 0.61 H new ATOM 0 HA SER A 77 -1.060 -6.429 10.471 1.00 0.72 H new ATOM 0 HB2 SER A 77 -0.468 -4.103 8.587 1.00 0.91 H new ATOM 0 HB3 SER A 77 -1.962 -4.385 9.458 1.00 0.91 H new ATOM 0 HG SER A 77 -0.595 -2.843 10.534 1.00 1.58 H new ATOM 1240 N LEU A 78 -0.200 -7.689 7.928 1.00 0.54 N ATOM 1241 CA LEU A 78 -0.593 -8.510 6.798 1.00 0.50 C ATOM 1242 C LEU A 78 -0.903 -9.926 7.253 1.00 0.53 C ATOM 1243 O LEU A 78 -0.416 -10.380 8.288 1.00 0.71 O ATOM 1244 CB LEU A 78 0.473 -8.511 5.703 1.00 0.45 C ATOM 1245 CG LEU A 78 0.512 -7.245 4.839 1.00 0.45 C ATOM 1246 CD1 LEU A 78 1.573 -7.361 3.751 1.00 0.49 C ATOM 1247 CD2 LEU A 78 -0.855 -6.980 4.228 1.00 0.51 C ATOM 0 H LEU A 78 0.709 -7.919 8.330 1.00 0.54 H new ATOM 0 HA LEU A 78 -1.497 -8.076 6.370 1.00 0.50 H new ATOM 0 HB2 LEU A 78 1.450 -8.647 6.167 1.00 0.45 H new ATOM 0 HB3 LEU A 78 0.306 -9.371 5.054 1.00 0.45 H new ATOM 0 HG LEU A 78 0.776 -6.403 5.478 1.00 0.45 H new ATOM 0 HD11 LEU A 78 1.581 -6.450 3.152 1.00 0.49 H new ATOM 0 HD12 LEU A 78 2.551 -7.501 4.210 1.00 0.49 H new ATOM 0 HD13 LEU A 78 1.347 -8.214 3.112 1.00 0.49 H new ATOM 0 HD21 LEU A 78 -0.812 -6.078 3.617 1.00 0.51 H new ATOM 0 HD22 LEU A 78 -1.146 -7.826 3.605 1.00 0.51 H new ATOM 0 HD23 LEU A 78 -1.589 -6.845 5.023 1.00 0.51 H new ATOM 1259 N GLN A 79 -1.716 -10.618 6.472 1.00 0.46 N ATOM 1260 CA GLN A 79 -2.265 -11.896 6.886 1.00 0.50 C ATOM 1261 C GLN A 79 -2.039 -12.980 5.852 1.00 0.48 C ATOM 1262 O GLN A 79 -1.385 -13.979 6.127 1.00 0.55 O ATOM 1263 CB GLN A 79 -3.763 -11.766 7.143 1.00 0.56 C ATOM 1264 CG GLN A 79 -4.123 -11.633 8.599 1.00 0.55 C ATOM 1265 CD GLN A 79 -3.618 -12.797 9.422 1.00 1.03 C ATOM 1266 OE1 GLN A 79 -2.394 -12.682 9.909 1.00 1.66 O flip ATOM 1267 NE2 GLN A 79 -4.320 -13.790 9.608 1.00 1.73 N flip ATOM 0 H GLN A 79 -2.011 -10.313 5.544 1.00 0.46 H new ATOM 0 HA GLN A 79 -1.745 -12.182 7.800 1.00 0.50 H new ATOM 0 HB2 GLN A 79 -4.140 -10.896 6.605 1.00 0.56 H new ATOM 0 HB3 GLN A 79 -4.269 -12.639 6.732 1.00 0.56 H new ATOM 0 HG2 GLN A 79 -3.706 -10.705 8.991 1.00 0.55 H new ATOM 0 HG3 GLN A 79 -5.206 -11.563 8.699 1.00 0.55 H new ATOM 0 HE21 GLN A 79 -5.259 -13.832 9.211 1.00 1.73 H new ATOM 0 HE22 GLN A 79 -3.963 -14.571 10.159 1.00 1.73 H new ATOM 1276 N VAL A 80 -2.585 -12.794 4.667 1.00 0.41 N ATOM 1277 CA VAL A 80 -2.596 -13.864 3.694 1.00 0.43 C ATOM 1278 C VAL A 80 -2.736 -13.338 2.274 1.00 0.39 C ATOM 1279 O VAL A 80 -3.627 -12.546 1.963 1.00 0.45 O ATOM 1280 CB VAL A 80 -3.713 -14.881 4.022 1.00 0.48 C ATOM 1281 CG1 VAL A 80 -5.048 -14.196 4.233 1.00 0.78 C ATOM 1282 CG2 VAL A 80 -3.809 -15.960 2.951 1.00 0.74 C ATOM 0 H VAL A 80 -3.021 -11.925 4.359 1.00 0.41 H new ATOM 0 HA VAL A 80 -1.634 -14.374 3.752 1.00 0.43 H new ATOM 0 HB VAL A 80 -3.445 -15.367 4.960 1.00 0.48 H new ATOM 0 HG11 VAL A 80 -5.808 -14.943 4.461 1.00 0.78 H new ATOM 0 HG12 VAL A 80 -4.969 -13.493 5.062 1.00 0.78 H new ATOM 0 HG13 VAL A 80 -5.328 -13.658 3.327 1.00 0.78 H new ATOM 0 HG21 VAL A 80 -4.603 -16.660 3.210 1.00 0.74 H new ATOM 0 HG22 VAL A 80 -4.031 -15.499 1.989 1.00 0.74 H new ATOM 0 HG23 VAL A 80 -2.861 -16.494 2.887 1.00 0.74 H new ATOM 1292 N TYR A 81 -1.812 -13.769 1.439 1.00 0.42 N ATOM 1293 CA TYR A 81 -1.775 -13.415 0.044 1.00 0.46 C ATOM 1294 C TYR A 81 -2.575 -14.409 -0.792 1.00 0.51 C ATOM 1295 O TYR A 81 -2.603 -15.605 -0.495 1.00 0.78 O ATOM 1296 CB TYR A 81 -0.314 -13.446 -0.391 1.00 0.74 C ATOM 1297 CG TYR A 81 0.327 -14.827 -0.265 1.00 1.91 C ATOM 1298 CD1 TYR A 81 0.862 -15.263 0.944 1.00 3.05 C ATOM 1299 CD2 TYR A 81 0.407 -15.687 -1.355 1.00 2.02 C ATOM 1300 CE1 TYR A 81 1.452 -16.505 1.061 1.00 4.21 C ATOM 1301 CE2 TYR A 81 0.995 -16.934 -1.242 1.00 3.15 C ATOM 1302 CZ TYR A 81 1.475 -17.356 -0.034 1.00 4.24 C ATOM 1303 OH TYR A 81 2.105 -18.577 0.080 1.00 5.40 O ATOM 0 H TYR A 81 -1.052 -14.388 1.722 1.00 0.42 H new ATOM 0 HA TYR A 81 -2.214 -12.428 -0.102 1.00 0.46 H new ATOM 0 HB2 TYR A 81 -0.244 -13.114 -1.427 1.00 0.74 H new ATOM 0 HB3 TYR A 81 0.252 -12.735 0.211 1.00 0.74 H new ATOM 0 HD1 TYR A 81 0.814 -14.616 1.808 1.00 3.05 H new ATOM 0 HD2 TYR A 81 0.003 -15.376 -2.307 1.00 2.02 H new ATOM 0 HE1 TYR A 81 1.892 -16.812 1.998 1.00 4.21 H new ATOM 0 HE2 TYR A 81 1.075 -17.574 -2.108 1.00 3.15 H new ATOM 0 HH TYR A 81 2.037 -19.061 -0.769 1.00 5.40 H new ATOM 1313 N ASN A 82 -3.233 -13.902 -1.821 1.00 0.42 N ATOM 1314 CA ASN A 82 -3.902 -14.737 -2.812 1.00 0.46 C ATOM 1315 C ASN A 82 -3.901 -14.019 -4.154 1.00 0.44 C ATOM 1316 O ASN A 82 -4.582 -13.013 -4.323 1.00 0.45 O ATOM 1317 CB ASN A 82 -5.353 -15.055 -2.416 1.00 0.50 C ATOM 1318 CG ASN A 82 -5.480 -16.018 -1.249 1.00 0.93 C ATOM 1319 OD1 ASN A 82 -5.483 -17.236 -1.431 1.00 1.69 O ATOM 1320 ND2 ASN A 82 -5.612 -15.480 -0.045 1.00 1.40 N ATOM 0 H ASN A 82 -3.320 -12.901 -1.995 1.00 0.42 H new ATOM 0 HA ASN A 82 -3.357 -15.679 -2.874 1.00 0.46 H new ATOM 0 HB2 ASN A 82 -5.861 -14.125 -2.163 1.00 0.50 H new ATOM 0 HB3 ASN A 82 -5.870 -15.476 -3.278 1.00 0.50 H new ATOM 0 HD21 ASN A 82 -5.721 -16.080 0.773 1.00 1.40 H new ATOM 0 HD22 ASN A 82 -5.604 -14.466 0.064 1.00 1.40 H new ATOM 1327 N MET A 83 -3.125 -14.507 -5.099 1.00 0.47 N ATOM 1328 CA MET A 83 -3.113 -13.912 -6.426 1.00 0.48 C ATOM 1329 C MET A 83 -4.321 -14.416 -7.203 1.00 0.47 C ATOM 1330 O MET A 83 -4.390 -15.588 -7.577 1.00 0.57 O ATOM 1331 CB MET A 83 -1.805 -14.248 -7.144 1.00 0.58 C ATOM 1332 CG MET A 83 -1.561 -13.434 -8.406 1.00 0.63 C ATOM 1333 SD MET A 83 -1.871 -11.672 -8.183 1.00 1.66 S ATOM 1334 CE MET A 83 -0.669 -11.261 -6.918 1.00 2.05 C ATOM 0 H MET A 83 -2.500 -15.304 -4.979 1.00 0.47 H new ATOM 0 HA MET A 83 -3.173 -12.826 -6.350 1.00 0.48 H new ATOM 0 HB2 MET A 83 -0.975 -14.089 -6.456 1.00 0.58 H new ATOM 0 HB3 MET A 83 -1.807 -15.307 -7.402 1.00 0.58 H new ATOM 0 HG2 MET A 83 -0.530 -13.577 -8.730 1.00 0.63 H new ATOM 0 HG3 MET A 83 -2.201 -13.811 -9.204 1.00 0.63 H new ATOM 0 HE1 MET A 83 -0.407 -10.206 -6.994 1.00 2.05 H new ATOM 0 HE2 MET A 83 -1.094 -11.459 -5.934 1.00 2.05 H new ATOM 0 HE3 MET A 83 0.226 -11.868 -7.056 1.00 2.05 H new ATOM 1344 N VAL A 84 -5.277 -13.524 -7.429 1.00 0.38 N ATOM 1345 CA VAL A 84 -6.585 -13.922 -7.944 1.00 0.39 C ATOM 1346 C VAL A 84 -6.550 -14.014 -9.460 1.00 0.42 C ATOM 1347 O VAL A 84 -6.571 -15.102 -10.032 1.00 0.64 O ATOM 1348 CB VAL A 84 -7.713 -12.939 -7.528 1.00 0.38 C ATOM 1349 CG1 VAL A 84 -8.868 -13.676 -6.871 1.00 0.55 C ATOM 1350 CG2 VAL A 84 -7.199 -11.852 -6.600 1.00 0.42 C ATOM 0 H VAL A 84 -5.174 -12.523 -7.265 1.00 0.38 H new ATOM 0 HA VAL A 84 -6.806 -14.896 -7.509 1.00 0.39 H new ATOM 0 HB VAL A 84 -8.072 -12.465 -8.442 1.00 0.38 H new ATOM 0 HG11 VAL A 84 -9.643 -12.962 -6.590 1.00 0.55 H new ATOM 0 HG12 VAL A 84 -9.281 -14.403 -7.570 1.00 0.55 H new ATOM 0 HG13 VAL A 84 -8.510 -14.192 -5.980 1.00 0.55 H new ATOM 0 HG21 VAL A 84 -8.018 -11.185 -6.332 1.00 0.42 H new ATOM 0 HG22 VAL A 84 -6.791 -12.307 -5.697 1.00 0.42 H new ATOM 0 HG23 VAL A 84 -6.418 -11.283 -7.104 1.00 0.42 H new ATOM 1360 N HIS A 85 -6.493 -12.862 -10.104 1.00 0.30 N ATOM 1361 CA HIS A 85 -6.406 -12.794 -11.551 1.00 0.31 C ATOM 1362 C HIS A 85 -5.218 -11.943 -11.953 1.00 0.32 C ATOM 1363 O HIS A 85 -5.113 -10.785 -11.556 1.00 0.38 O ATOM 1364 CB HIS A 85 -7.691 -12.214 -12.157 1.00 0.37 C ATOM 1365 CG HIS A 85 -8.806 -13.209 -12.301 1.00 0.80 C ATOM 1366 ND1 HIS A 85 -9.553 -13.329 -13.450 1.00 1.36 N ATOM 1367 CD2 HIS A 85 -9.309 -14.122 -11.435 1.00 1.71 C ATOM 1368 CE1 HIS A 85 -10.463 -14.269 -13.288 1.00 1.75 C ATOM 1369 NE2 HIS A 85 -10.336 -14.769 -12.073 1.00 1.96 N ATOM 0 H HIS A 85 -6.506 -11.953 -9.642 1.00 0.30 H new ATOM 0 HA HIS A 85 -6.277 -13.807 -11.933 1.00 0.31 H new ATOM 0 HB2 HIS A 85 -8.034 -11.389 -11.533 1.00 0.37 H new ATOM 0 HB3 HIS A 85 -7.461 -11.798 -13.138 1.00 0.37 H new ATOM 0 HD2 HIS A 85 -8.965 -14.306 -10.428 1.00 1.71 H new ATOM 0 HE1 HIS A 85 -11.190 -14.578 -14.025 1.00 1.75 H new ATOM 0 HE2 HIS A 85 -10.908 -15.514 -11.674 1.00 1.96 H new ATOM 1378 N ARG A 86 -4.311 -12.529 -12.707 1.00 0.34 N ATOM 1379 CA ARG A 86 -3.175 -11.793 -13.228 1.00 0.36 C ATOM 1380 C ARG A 86 -3.465 -11.438 -14.670 1.00 0.38 C ATOM 1381 O ARG A 86 -3.785 -12.310 -15.479 1.00 0.52 O ATOM 1382 CB ARG A 86 -1.898 -12.620 -13.130 1.00 0.40 C ATOM 1383 CG ARG A 86 -1.768 -13.399 -11.830 1.00 0.45 C ATOM 1384 CD ARG A 86 -0.365 -13.973 -11.666 1.00 0.69 C ATOM 1385 NE ARG A 86 0.068 -14.732 -12.842 1.00 1.15 N ATOM 1386 CZ ARG A 86 0.778 -15.861 -12.786 1.00 1.68 C ATOM 1387 NH1 ARG A 86 1.094 -16.404 -11.615 1.00 1.98 N ATOM 1388 NH2 ARG A 86 1.168 -16.449 -13.907 1.00 2.44 N ATOM 0 H ARG A 86 -4.337 -13.513 -12.973 1.00 0.34 H new ATOM 0 HA ARG A 86 -3.023 -10.888 -12.640 1.00 0.36 H new ATOM 0 HB2 ARG A 86 -1.864 -13.319 -13.966 1.00 0.40 H new ATOM 0 HB3 ARG A 86 -1.039 -11.957 -13.233 1.00 0.40 H new ATOM 0 HG2 ARG A 86 -1.997 -12.746 -10.988 1.00 0.45 H new ATOM 0 HG3 ARG A 86 -2.498 -14.208 -11.814 1.00 0.45 H new ATOM 0 HD2 ARG A 86 0.338 -13.161 -11.482 1.00 0.69 H new ATOM 0 HD3 ARG A 86 -0.340 -14.620 -10.789 1.00 0.69 H new ATOM 0 HE ARG A 86 -0.189 -14.375 -13.762 1.00 1.15 H new ATOM 0 HH11 ARG A 86 0.794 -15.958 -10.748 1.00 1.98 H new ATOM 0 HH12 ARG A 86 1.637 -17.267 -11.583 1.00 1.98 H new ATOM 0 HH21 ARG A 86 0.926 -16.039 -14.809 1.00 2.44 H new ATOM 0 HH22 ARG A 86 1.711 -17.312 -13.868 1.00 2.44 H new ATOM 1402 N ILE A 87 -3.372 -10.164 -14.985 1.00 0.35 N ATOM 1403 CA ILE A 87 -3.889 -9.668 -16.245 1.00 0.36 C ATOM 1404 C ILE A 87 -2.834 -9.684 -17.339 1.00 0.39 C ATOM 1405 O ILE A 87 -3.002 -10.333 -18.372 1.00 0.47 O ATOM 1406 CB ILE A 87 -4.441 -8.225 -16.128 1.00 0.38 C ATOM 1407 CG1 ILE A 87 -4.558 -7.758 -14.670 1.00 0.32 C ATOM 1408 CG2 ILE A 87 -5.791 -8.137 -16.810 1.00 0.44 C ATOM 1409 CD1 ILE A 87 -5.618 -8.474 -13.864 1.00 0.27 C ATOM 0 H ILE A 87 -2.945 -9.454 -14.390 1.00 0.35 H new ATOM 0 HA ILE A 87 -4.702 -10.345 -16.508 1.00 0.36 H new ATOM 0 HB ILE A 87 -3.730 -7.563 -16.621 1.00 0.38 H new ATOM 0 HG12 ILE A 87 -3.594 -7.894 -14.180 1.00 0.32 H new ATOM 0 HG13 ILE A 87 -4.773 -6.689 -14.660 1.00 0.32 H new ATOM 0 HG21 ILE A 87 -6.176 -7.121 -16.725 1.00 0.44 H new ATOM 0 HG22 ILE A 87 -5.684 -8.398 -17.863 1.00 0.44 H new ATOM 0 HG23 ILE A 87 -6.485 -8.829 -16.333 1.00 0.44 H new ATOM 0 HD11 ILE A 87 -5.630 -8.080 -12.848 1.00 0.27 H new ATOM 0 HD12 ILE A 87 -6.593 -8.318 -14.325 1.00 0.27 H new ATOM 0 HD13 ILE A 87 -5.396 -9.541 -13.837 1.00 0.27 H new ATOM 1421 N ASP A 88 -1.735 -8.988 -17.104 1.00 0.42 N ATOM 1422 CA ASP A 88 -0.810 -8.671 -18.188 1.00 0.56 C ATOM 1423 C ASP A 88 0.637 -8.676 -17.726 1.00 0.67 C ATOM 1424 O ASP A 88 1.434 -7.855 -18.182 1.00 1.18 O ATOM 1425 CB ASP A 88 -1.132 -7.296 -18.776 1.00 0.65 C ATOM 1426 CG ASP A 88 -2.487 -7.224 -19.456 1.00 1.16 C ATOM 1427 OD1 ASP A 88 -2.582 -7.602 -20.642 1.00 1.35 O ATOM 1428 OD2 ASP A 88 -3.458 -6.751 -18.823 1.00 1.86 O ATOM 0 H ASP A 88 -1.460 -8.634 -16.188 1.00 0.42 H new ATOM 0 HA ASP A 88 -0.934 -9.446 -18.944 1.00 0.56 H new ATOM 0 HB2 ASP A 88 -1.095 -6.553 -17.980 1.00 0.65 H new ATOM 0 HB3 ASP A 88 -0.359 -7.029 -19.497 1.00 0.65 H new ATOM 1433 N SER A 89 0.961 -9.585 -16.810 1.00 0.65 N ATOM 1434 CA SER A 89 2.329 -9.772 -16.314 1.00 0.70 C ATOM 1435 C SER A 89 2.773 -8.638 -15.379 1.00 0.53 C ATOM 1436 O SER A 89 3.509 -8.876 -14.424 1.00 0.59 O ATOM 1437 CB SER A 89 3.315 -9.933 -17.481 1.00 0.94 C ATOM 1438 OG SER A 89 4.611 -10.288 -17.024 1.00 1.44 O ATOM 0 H SER A 89 0.282 -10.217 -16.387 1.00 0.65 H new ATOM 0 HA SER A 89 2.331 -10.689 -15.725 1.00 0.70 H new ATOM 0 HB2 SER A 89 2.948 -10.698 -18.166 1.00 0.94 H new ATOM 0 HB3 SER A 89 3.369 -9.001 -18.044 1.00 0.94 H new ATOM 0 HG SER A 89 5.213 -10.384 -17.791 1.00 1.44 H new ATOM 1444 N ASP A 90 2.301 -7.420 -15.626 1.00 0.47 N ATOM 1445 CA ASP A 90 2.702 -6.269 -14.831 1.00 0.48 C ATOM 1446 C ASP A 90 1.482 -5.722 -14.132 1.00 0.39 C ATOM 1447 O ASP A 90 1.499 -4.633 -13.558 1.00 0.41 O ATOM 1448 CB ASP A 90 3.318 -5.171 -15.709 1.00 0.73 C ATOM 1449 CG ASP A 90 4.646 -5.561 -16.327 1.00 1.21 C ATOM 1450 OD1 ASP A 90 4.645 -6.141 -17.435 1.00 1.87 O ATOM 1451 OD2 ASP A 90 5.699 -5.262 -15.729 1.00 1.70 O ATOM 0 H ASP A 90 1.639 -7.206 -16.372 1.00 0.47 H new ATOM 0 HA ASP A 90 3.455 -6.585 -14.109 1.00 0.48 H new ATOM 0 HB2 ASP A 90 2.617 -4.918 -16.504 1.00 0.73 H new ATOM 0 HB3 ASP A 90 3.457 -4.272 -15.108 1.00 0.73 H new ATOM 1456 N THR A 91 0.409 -6.491 -14.199 1.00 0.35 N ATOM 1457 CA THR A 91 -0.860 -6.065 -13.691 1.00 0.32 C ATOM 1458 C THR A 91 -1.510 -7.238 -12.982 1.00 0.28 C ATOM 1459 O THR A 91 -1.777 -8.272 -13.598 1.00 0.30 O ATOM 1460 CB THR A 91 -1.754 -5.576 -14.849 1.00 0.36 C ATOM 1461 OG1 THR A 91 -0.928 -5.084 -15.913 1.00 0.46 O ATOM 1462 CG2 THR A 91 -2.682 -4.465 -14.401 1.00 0.35 C ATOM 0 H THR A 91 0.405 -7.425 -14.609 1.00 0.35 H new ATOM 0 HA THR A 91 -0.727 -5.239 -12.992 1.00 0.32 H new ATOM 0 HB THR A 91 -2.357 -6.419 -15.187 1.00 0.36 H new ATOM 0 HG1 THR A 91 -1.486 -4.879 -16.692 1.00 0.46 H new ATOM 0 HG21 THR A 91 -3.298 -4.144 -15.241 1.00 0.35 H new ATOM 0 HG22 THR A 91 -3.324 -4.829 -13.599 1.00 0.35 H new ATOM 0 HG23 THR A 91 -2.093 -3.622 -14.040 1.00 0.35 H new ATOM 1470 N PHE A 92 -1.709 -7.095 -11.690 1.00 0.25 N ATOM 1471 CA PHE A 92 -2.235 -8.178 -10.879 1.00 0.25 C ATOM 1472 C PHE A 92 -3.476 -7.740 -10.143 1.00 0.22 C ATOM 1473 O PHE A 92 -3.887 -6.588 -10.221 1.00 0.21 O ATOM 1474 CB PHE A 92 -1.214 -8.632 -9.836 1.00 0.30 C ATOM 1475 CG PHE A 92 0.126 -8.980 -10.394 1.00 0.32 C ATOM 1476 CD1 PHE A 92 1.073 -8.002 -10.620 1.00 0.33 C ATOM 1477 CD2 PHE A 92 0.426 -10.289 -10.697 1.00 0.39 C ATOM 1478 CE1 PHE A 92 2.305 -8.327 -11.142 1.00 0.38 C ATOM 1479 CE2 PHE A 92 1.650 -10.632 -11.216 1.00 0.43 C ATOM 1480 CZ PHE A 92 2.623 -9.601 -11.413 1.00 0.41 C ATOM 0 H PHE A 92 -1.514 -6.237 -11.174 1.00 0.25 H new ATOM 0 HA PHE A 92 -2.465 -8.999 -11.558 1.00 0.25 H new ATOM 0 HB2 PHE A 92 -1.092 -7.840 -9.097 1.00 0.30 H new ATOM 0 HB3 PHE A 92 -1.612 -9.500 -9.310 1.00 0.30 H new ATOM 0 HD1 PHE A 92 0.846 -6.973 -10.385 1.00 0.33 H new ATOM 0 HD2 PHE A 92 -0.313 -11.058 -10.524 1.00 0.39 H new ATOM 0 HE1 PHE A 92 3.025 -7.545 -11.336 1.00 0.38 H new ATOM 0 HE2 PHE A 92 1.874 -11.658 -11.470 1.00 0.43 H new ATOM 0 HZ PHE A 92 3.609 -9.848 -11.778 1.00 0.41 H new ATOM 1490 N ILE A 93 -4.055 -8.674 -9.423 1.00 0.23 N ATOM 1491 CA ILE A 93 -5.102 -8.380 -8.475 1.00 0.23 C ATOM 1492 C ILE A 93 -4.807 -9.165 -7.211 1.00 0.28 C ATOM 1493 O ILE A 93 -4.735 -10.395 -7.242 1.00 0.33 O ATOM 1494 CB ILE A 93 -6.499 -8.747 -9.014 1.00 0.23 C ATOM 1495 CG1 ILE A 93 -6.713 -8.144 -10.396 1.00 0.24 C ATOM 1496 CG2 ILE A 93 -7.577 -8.254 -8.067 1.00 0.26 C ATOM 1497 CD1 ILE A 93 -8.022 -8.537 -11.019 1.00 0.41 C ATOM 0 H ILE A 93 -3.811 -9.663 -9.480 1.00 0.23 H new ATOM 0 HA ILE A 93 -5.118 -7.307 -8.281 1.00 0.23 H new ATOM 0 HB ILE A 93 -6.561 -9.833 -9.089 1.00 0.23 H new ATOM 0 HG12 ILE A 93 -6.665 -7.058 -10.322 1.00 0.24 H new ATOM 0 HG13 ILE A 93 -5.899 -8.455 -11.051 1.00 0.24 H new ATOM 0 HG21 ILE A 93 -8.558 -8.521 -8.461 1.00 0.26 H new ATOM 0 HG22 ILE A 93 -7.441 -8.716 -7.089 1.00 0.26 H new ATOM 0 HG23 ILE A 93 -7.508 -7.171 -7.969 1.00 0.26 H new ATOM 0 HD11 ILE A 93 -8.111 -8.074 -12.002 1.00 0.41 H new ATOM 0 HD12 ILE A 93 -8.064 -9.621 -11.124 1.00 0.41 H new ATOM 0 HD13 ILE A 93 -8.842 -8.202 -10.384 1.00 0.41 H new ATOM 1509 N CYS A 94 -4.592 -8.463 -6.119 1.00 0.36 N ATOM 1510 CA CYS A 94 -4.125 -9.098 -4.901 1.00 0.48 C ATOM 1511 C CYS A 94 -5.256 -9.330 -3.912 1.00 0.39 C ATOM 1512 O CYS A 94 -5.787 -8.388 -3.329 1.00 0.47 O ATOM 1513 CB CYS A 94 -3.023 -8.256 -4.256 1.00 0.74 C ATOM 1514 SG CYS A 94 -1.537 -8.080 -5.270 1.00 2.01 S ATOM 0 H CYS A 94 -4.732 -7.455 -6.047 1.00 0.36 H new ATOM 0 HA CYS A 94 -3.722 -10.074 -5.173 1.00 0.48 H new ATOM 0 HB2 CYS A 94 -3.420 -7.265 -4.037 1.00 0.74 H new ATOM 0 HB3 CYS A 94 -2.748 -8.707 -3.303 1.00 0.74 H new ATOM 0 HG CYS A 94 -0.665 -7.350 -4.640 1.00 2.01 H new ATOM 1520 N HIS A 95 -5.621 -10.594 -3.737 1.00 0.37 N ATOM 1521 CA HIS A 95 -6.546 -10.996 -2.689 1.00 0.36 C ATOM 1522 C HIS A 95 -5.777 -11.085 -1.368 1.00 0.39 C ATOM 1523 O HIS A 95 -5.524 -12.165 -0.832 1.00 0.56 O ATOM 1524 CB HIS A 95 -7.216 -12.335 -3.047 1.00 0.41 C ATOM 1525 CG HIS A 95 -8.238 -12.809 -2.054 1.00 0.50 C ATOM 1526 ND1 HIS A 95 -8.876 -14.029 -2.152 1.00 1.20 N ATOM 1527 CD2 HIS A 95 -8.729 -12.223 -0.942 1.00 1.23 C ATOM 1528 CE1 HIS A 95 -9.714 -14.166 -1.139 1.00 0.99 C ATOM 1529 NE2 HIS A 95 -9.639 -13.082 -0.392 1.00 0.95 N ATOM 0 H HIS A 95 -5.285 -11.364 -4.315 1.00 0.37 H new ATOM 0 HA HIS A 95 -7.342 -10.258 -2.587 1.00 0.36 H new ATOM 0 HB2 HIS A 95 -7.694 -12.238 -4.022 1.00 0.41 H new ATOM 0 HB3 HIS A 95 -6.444 -13.098 -3.145 1.00 0.41 H new ATOM 0 HD2 HIS A 95 -8.453 -11.252 -0.557 1.00 1.23 H new ATOM 0 HE1 HIS A 95 -10.350 -15.019 -0.955 1.00 0.99 H new ATOM 0 HE2 HIS A 95 -10.174 -12.912 0.460 1.00 0.95 H new ATOM 1538 N THR A 96 -5.392 -9.926 -0.882 1.00 0.35 N ATOM 1539 CA THR A 96 -4.580 -9.787 0.307 1.00 0.38 C ATOM 1540 C THR A 96 -5.437 -9.532 1.539 1.00 0.36 C ATOM 1541 O THR A 96 -6.085 -8.497 1.638 1.00 0.41 O ATOM 1542 CB THR A 96 -3.625 -8.597 0.120 1.00 0.43 C ATOM 1543 OG1 THR A 96 -2.777 -8.837 -1.009 1.00 0.50 O ATOM 1544 CG2 THR A 96 -2.775 -8.356 1.362 1.00 0.47 C ATOM 0 H THR A 96 -5.640 -9.035 -1.311 1.00 0.35 H new ATOM 0 HA THR A 96 -4.028 -10.715 0.454 1.00 0.38 H new ATOM 0 HB THR A 96 -4.227 -7.704 -0.049 1.00 0.43 H new ATOM 0 HG1 THR A 96 -2.169 -8.077 -1.129 1.00 0.50 H new ATOM 0 HG21 THR A 96 -2.113 -7.507 1.191 1.00 0.47 H new ATOM 0 HG22 THR A 96 -3.424 -8.144 2.212 1.00 0.47 H new ATOM 0 HG23 THR A 96 -2.179 -9.244 1.573 1.00 0.47 H new ATOM 1552 N ILE A 97 -5.448 -10.458 2.482 1.00 0.38 N ATOM 1553 CA ILE A 97 -6.118 -10.193 3.740 1.00 0.40 C ATOM 1554 C ILE A 97 -5.154 -9.460 4.658 1.00 0.41 C ATOM 1555 O ILE A 97 -4.008 -9.881 4.838 1.00 0.42 O ATOM 1556 CB ILE A 97 -6.652 -11.473 4.429 1.00 0.47 C ATOM 1557 CG1 ILE A 97 -7.856 -12.050 3.669 1.00 0.56 C ATOM 1558 CG2 ILE A 97 -7.034 -11.194 5.878 1.00 0.51 C ATOM 1559 CD1 ILE A 97 -7.507 -12.715 2.353 1.00 1.03 C ATOM 0 H ILE A 97 -5.012 -11.377 2.404 1.00 0.38 H new ATOM 0 HA ILE A 97 -6.994 -9.579 3.529 1.00 0.40 H new ATOM 0 HB ILE A 97 -5.850 -12.211 4.416 1.00 0.47 H new ATOM 0 HG12 ILE A 97 -8.358 -12.777 4.307 1.00 0.56 H new ATOM 0 HG13 ILE A 97 -8.568 -11.247 3.479 1.00 0.56 H new ATOM 0 HG21 ILE A 97 -7.406 -12.109 6.339 1.00 0.51 H new ATOM 0 HG22 ILE A 97 -6.158 -10.843 6.424 1.00 0.51 H new ATOM 0 HG23 ILE A 97 -7.811 -10.430 5.909 1.00 0.51 H new ATOM 0 HD11 ILE A 97 -8.415 -13.094 1.884 1.00 1.03 H new ATOM 0 HD12 ILE A 97 -7.034 -11.989 1.692 1.00 1.03 H new ATOM 0 HD13 ILE A 97 -6.820 -13.542 2.534 1.00 1.03 H new ATOM 1571 N THR A 98 -5.600 -8.338 5.184 1.00 0.49 N ATOM 1572 CA THR A 98 -4.784 -7.526 6.061 1.00 0.56 C ATOM 1573 C THR A 98 -5.329 -7.575 7.483 1.00 0.63 C ATOM 1574 O THR A 98 -6.456 -8.005 7.720 1.00 0.77 O ATOM 1575 CB THR A 98 -4.738 -6.062 5.560 1.00 0.71 C ATOM 1576 OG1 THR A 98 -3.831 -5.273 6.337 1.00 1.38 O ATOM 1577 CG2 THR A 98 -6.111 -5.432 5.620 1.00 0.86 C ATOM 0 H THR A 98 -6.534 -7.965 5.016 1.00 0.49 H new ATOM 0 HA THR A 98 -3.770 -7.927 6.057 1.00 0.56 H new ATOM 0 HB THR A 98 -4.391 -6.087 4.527 1.00 0.71 H new ATOM 0 HG1 THR A 98 -3.061 -5.821 6.597 1.00 1.38 H new ATOM 0 HG21 THR A 98 -6.055 -4.403 5.263 1.00 0.86 H new ATOM 0 HG22 THR A 98 -6.799 -5.997 4.991 1.00 0.86 H new ATOM 0 HG23 THR A 98 -6.470 -5.440 6.649 1.00 0.86 H new ATOM 1585 N GLN A 99 -4.521 -7.132 8.417 1.00 0.59 N ATOM 1586 CA GLN A 99 -4.912 -7.029 9.805 1.00 0.72 C ATOM 1587 C GLN A 99 -4.905 -5.569 10.225 1.00 0.99 C ATOM 1588 O GLN A 99 -4.001 -5.123 10.929 1.00 1.32 O ATOM 1589 CB GLN A 99 -3.974 -7.825 10.713 1.00 0.61 C ATOM 1590 CG GLN A 99 -4.359 -9.281 10.866 1.00 0.80 C ATOM 1591 CD GLN A 99 -3.507 -10.001 11.891 1.00 1.04 C ATOM 1592 OE1 GLN A 99 -2.338 -9.672 12.088 1.00 1.62 O ATOM 1593 NE2 GLN A 99 -4.091 -10.981 12.559 1.00 1.82 N ATOM 0 H GLN A 99 -3.564 -6.830 8.234 1.00 0.59 H new ATOM 0 HA GLN A 99 -5.914 -7.445 9.906 1.00 0.72 H new ATOM 0 HB2 GLN A 99 -2.962 -7.767 10.314 1.00 0.61 H new ATOM 0 HB3 GLN A 99 -3.955 -7.359 11.698 1.00 0.61 H new ATOM 0 HG2 GLN A 99 -5.407 -9.348 11.158 1.00 0.80 H new ATOM 0 HG3 GLN A 99 -4.264 -9.782 9.903 1.00 0.80 H new ATOM 0 HE21 GLN A 99 -5.063 -11.222 12.365 1.00 1.82 H new ATOM 0 HE22 GLN A 99 -3.570 -11.496 13.269 1.00 1.82 H new ATOM 1677 N ILE A 106 -11.488 -2.869 14.034 1.00 1.05 N ATOM 1678 CA ILE A 106 -11.369 -3.244 12.648 1.00 0.96 C ATOM 1679 C ILE A 106 -10.961 -4.699 12.538 1.00 0.94 C ATOM 1680 O ILE A 106 -9.887 -5.088 13.007 1.00 1.12 O ATOM 1681 CB ILE A 106 -10.308 -2.375 11.955 1.00 0.93 C ATOM 1682 CG1 ILE A 106 -10.463 -0.914 12.384 1.00 1.01 C ATOM 1683 CG2 ILE A 106 -10.418 -2.507 10.443 1.00 0.98 C ATOM 1684 CD1 ILE A 106 -9.239 -0.071 12.116 1.00 0.94 C ATOM 0 HA ILE A 106 -12.335 -3.096 12.165 1.00 0.96 H new ATOM 0 HB ILE A 106 -9.319 -2.721 12.255 1.00 0.93 H new ATOM 0 HG12 ILE A 106 -11.315 -0.479 11.861 1.00 1.01 H new ATOM 0 HG13 ILE A 106 -10.691 -0.879 13.449 1.00 1.01 H new ATOM 0 HG21 ILE A 106 -9.660 -1.885 9.967 1.00 0.98 H new ATOM 0 HG22 ILE A 106 -10.266 -3.548 10.157 1.00 0.98 H new ATOM 0 HG23 ILE A 106 -11.407 -2.183 10.120 1.00 0.98 H new ATOM 0 HD11 ILE A 106 -9.422 0.952 12.446 1.00 0.94 H new ATOM 0 HD12 ILE A 106 -8.388 -0.481 12.661 1.00 0.94 H new ATOM 0 HD13 ILE A 106 -9.022 -0.074 11.048 1.00 0.94 H new ATOM 1696 N SER A 107 -11.827 -5.498 11.950 1.00 0.84 N ATOM 1697 CA SER A 107 -11.530 -6.893 11.701 1.00 0.86 C ATOM 1698 C SER A 107 -10.493 -7.005 10.587 1.00 0.79 C ATOM 1699 O SER A 107 -10.244 -6.026 9.874 1.00 0.77 O ATOM 1700 CB SER A 107 -12.816 -7.615 11.302 1.00 0.97 C ATOM 1701 OG SER A 107 -13.854 -7.345 12.227 1.00 1.35 O ATOM 0 H SER A 107 -12.750 -5.202 11.633 1.00 0.84 H new ATOM 0 HA SER A 107 -11.126 -7.353 12.603 1.00 0.86 H new ATOM 0 HB2 SER A 107 -13.121 -7.299 10.304 1.00 0.97 H new ATOM 0 HB3 SER A 107 -12.635 -8.689 11.255 1.00 0.97 H new ATOM 0 HG SER A 107 -14.668 -7.816 11.951 1.00 1.35 H new ATOM 1707 N PRO A 108 -9.853 -8.177 10.434 1.00 0.82 N ATOM 1708 CA PRO A 108 -8.964 -8.433 9.305 1.00 0.82 C ATOM 1709 C PRO A 108 -9.658 -8.094 7.993 1.00 0.73 C ATOM 1710 O PRO A 108 -10.638 -8.735 7.614 1.00 0.81 O ATOM 1711 CB PRO A 108 -8.665 -9.939 9.397 1.00 0.91 C ATOM 1712 CG PRO A 108 -9.606 -10.480 10.426 1.00 1.07 C ATOM 1713 CD PRO A 108 -9.938 -9.332 11.334 1.00 0.92 C ATOM 0 HA PRO A 108 -8.058 -7.828 9.335 1.00 0.82 H new ATOM 0 HB2 PRO A 108 -8.816 -10.427 8.434 1.00 0.91 H new ATOM 0 HB3 PRO A 108 -7.628 -10.115 9.684 1.00 0.91 H new ATOM 0 HG2 PRO A 108 -10.506 -10.880 9.959 1.00 1.07 H new ATOM 0 HG3 PRO A 108 -9.146 -11.297 10.983 1.00 1.07 H new ATOM 0 HD2 PRO A 108 -10.932 -9.434 11.770 1.00 0.92 H new ATOM 0 HD3 PRO A 108 -9.234 -9.253 12.162 1.00 0.92 H new ATOM 1721 N ARG A 109 -9.164 -7.074 7.308 1.00 0.61 N ATOM 1722 CA ARG A 109 -9.848 -6.586 6.126 1.00 0.56 C ATOM 1723 C ARG A 109 -9.332 -7.304 4.908 1.00 0.52 C ATOM 1724 O ARG A 109 -8.135 -7.530 4.765 1.00 0.66 O ATOM 1725 CB ARG A 109 -9.708 -5.066 5.960 1.00 0.64 C ATOM 1726 CG ARG A 109 -10.531 -4.274 6.962 1.00 1.05 C ATOM 1727 CD ARG A 109 -10.619 -2.796 6.599 1.00 0.88 C ATOM 1728 NE ARG A 109 -9.304 -2.150 6.548 1.00 1.89 N ATOM 1729 CZ ARG A 109 -9.029 -0.960 7.094 1.00 2.34 C ATOM 1730 NH1 ARG A 109 -9.963 -0.300 7.769 1.00 2.06 N ATOM 1731 NH2 ARG A 109 -7.810 -0.443 6.985 1.00 3.45 N ATOM 0 H ARG A 109 -8.306 -6.577 7.547 1.00 0.61 H new ATOM 0 HA ARG A 109 -10.911 -6.793 6.246 1.00 0.56 H new ATOM 0 HB2 ARG A 109 -8.658 -4.791 6.064 1.00 0.64 H new ATOM 0 HB3 ARG A 109 -10.011 -4.788 4.951 1.00 0.64 H new ATOM 0 HG2 ARG A 109 -11.536 -4.693 7.016 1.00 1.05 H new ATOM 0 HG3 ARG A 109 -10.090 -4.377 7.953 1.00 1.05 H new ATOM 0 HD2 ARG A 109 -11.109 -2.692 5.631 1.00 0.88 H new ATOM 0 HD3 ARG A 109 -11.244 -2.283 7.330 1.00 0.88 H new ATOM 0 HE ARG A 109 -8.550 -2.639 6.065 1.00 1.89 H new ATOM 0 HH11 ARG A 109 -10.895 -0.700 7.873 1.00 2.06 H new ATOM 0 HH12 ARG A 109 -9.748 0.607 8.183 1.00 2.06 H new ATOM 0 HH21 ARG A 109 -7.082 -0.953 6.485 1.00 3.45 H new ATOM 0 HH22 ARG A 109 -7.602 0.464 7.402 1.00 3.45 H new ATOM 1745 N ASP A 110 -10.237 -7.675 4.040 1.00 0.46 N ATOM 1746 CA ASP A 110 -9.870 -8.418 2.866 1.00 0.47 C ATOM 1747 C ASP A 110 -9.665 -7.451 1.717 1.00 0.44 C ATOM 1748 O ASP A 110 -10.518 -6.612 1.452 1.00 0.64 O ATOM 1749 CB ASP A 110 -10.960 -9.433 2.533 1.00 0.62 C ATOM 1750 CG ASP A 110 -10.510 -10.458 1.522 1.00 0.83 C ATOM 1751 OD1 ASP A 110 -10.088 -10.064 0.420 1.00 1.32 O ATOM 1752 OD2 ASP A 110 -10.588 -11.670 1.819 1.00 1.37 O ATOM 0 H ASP A 110 -11.233 -7.474 4.125 1.00 0.46 H new ATOM 0 HA ASP A 110 -8.943 -8.963 3.043 1.00 0.47 H new ATOM 0 HB2 ASP A 110 -11.269 -9.941 3.446 1.00 0.62 H new ATOM 0 HB3 ASP A 110 -11.834 -8.908 2.148 1.00 0.62 H new ATOM 1757 N PHE A 111 -8.523 -7.523 1.069 1.00 0.39 N ATOM 1758 CA PHE A 111 -8.243 -6.628 -0.034 1.00 0.43 C ATOM 1759 C PHE A 111 -8.305 -7.348 -1.365 1.00 0.41 C ATOM 1760 O PHE A 111 -7.960 -8.524 -1.479 1.00 0.54 O ATOM 1761 CB PHE A 111 -6.877 -5.957 0.115 1.00 0.61 C ATOM 1762 CG PHE A 111 -6.855 -4.820 1.096 1.00 0.94 C ATOM 1763 CD1 PHE A 111 -7.950 -3.984 1.230 1.00 1.36 C ATOM 1764 CD2 PHE A 111 -5.742 -4.593 1.891 1.00 1.60 C ATOM 1765 CE1 PHE A 111 -7.936 -2.943 2.138 1.00 2.01 C ATOM 1766 CE2 PHE A 111 -5.721 -3.552 2.798 1.00 2.30 C ATOM 1767 CZ PHE A 111 -6.812 -2.707 2.901 1.00 2.41 C ATOM 0 H PHE A 111 -7.778 -8.186 1.284 1.00 0.39 H new ATOM 0 HA PHE A 111 -9.016 -5.860 -0.011 1.00 0.43 H new ATOM 0 HB2 PHE A 111 -6.149 -6.706 0.427 1.00 0.61 H new ATOM 0 HB3 PHE A 111 -6.557 -5.588 -0.860 1.00 0.61 H new ATOM 0 HD1 PHE A 111 -8.825 -4.147 0.618 1.00 1.36 H new ATOM 0 HD2 PHE A 111 -4.881 -5.238 1.800 1.00 1.60 H new ATOM 0 HE1 PHE A 111 -8.806 -2.313 2.250 1.00 2.01 H new ATOM 0 HE2 PHE A 111 -4.855 -3.398 3.425 1.00 2.30 H new ATOM 0 HZ PHE A 111 -6.783 -1.865 3.577 1.00 2.41 H new ATOM 1777 N ILE A 112 -8.751 -6.610 -2.360 1.00 0.34 N ATOM 1778 CA ILE A 112 -8.749 -7.052 -3.742 1.00 0.33 C ATOM 1779 C ILE A 112 -8.294 -5.888 -4.594 1.00 0.35 C ATOM 1780 O ILE A 112 -9.069 -5.278 -5.339 1.00 0.43 O ATOM 1781 CB ILE A 112 -10.122 -7.551 -4.255 1.00 0.34 C ATOM 1782 CG1 ILE A 112 -10.640 -8.708 -3.408 1.00 0.40 C ATOM 1783 CG2 ILE A 112 -9.979 -8.008 -5.684 1.00 0.36 C ATOM 1784 CD1 ILE A 112 -9.855 -9.981 -3.608 1.00 0.42 C ATOM 0 H ILE A 112 -9.131 -5.672 -2.231 1.00 0.34 H new ATOM 0 HA ILE A 112 -8.079 -7.909 -3.808 1.00 0.33 H new ATOM 0 HB ILE A 112 -10.835 -6.729 -4.187 1.00 0.34 H new ATOM 0 HG12 ILE A 112 -10.603 -8.426 -2.356 1.00 0.40 H new ATOM 0 HG13 ILE A 112 -11.686 -8.890 -3.653 1.00 0.40 H new ATOM 0 HG21 ILE A 112 -10.943 -8.361 -6.051 1.00 0.36 H new ATOM 0 HG22 ILE A 112 -9.639 -7.176 -6.300 1.00 0.36 H new ATOM 0 HG23 ILE A 112 -9.252 -8.819 -5.736 1.00 0.36 H new ATOM 0 HD11 ILE A 112 -10.271 -10.768 -2.979 1.00 0.42 H new ATOM 0 HD12 ILE A 112 -9.913 -10.284 -4.653 1.00 0.42 H new ATOM 0 HD13 ILE A 112 -8.813 -9.812 -3.337 1.00 0.42 H new ATOM 1796 N ASP A 113 -7.037 -5.558 -4.440 1.00 0.36 N ATOM 1797 CA ASP A 113 -6.477 -4.422 -5.125 1.00 0.42 C ATOM 1798 C ASP A 113 -5.912 -4.847 -6.456 1.00 0.33 C ATOM 1799 O ASP A 113 -4.992 -5.661 -6.520 1.00 0.35 O ATOM 1800 CB ASP A 113 -5.396 -3.749 -4.274 1.00 0.58 C ATOM 1801 CG ASP A 113 -5.976 -2.940 -3.129 1.00 1.23 C ATOM 1802 OD1 ASP A 113 -6.528 -3.544 -2.188 1.00 1.32 O ATOM 1803 OD2 ASP A 113 -5.883 -1.694 -3.173 1.00 1.86 O ATOM 0 H ASP A 113 -6.380 -6.062 -3.844 1.00 0.36 H new ATOM 0 HA ASP A 113 -7.272 -3.696 -5.295 1.00 0.42 H new ATOM 0 HB2 ASP A 113 -4.727 -4.511 -3.874 1.00 0.58 H new ATOM 0 HB3 ASP A 113 -4.794 -3.097 -4.907 1.00 0.58 H new ATOM 1808 N LEU A 114 -6.503 -4.337 -7.517 1.00 0.28 N ATOM 1809 CA LEU A 114 -5.931 -4.488 -8.834 1.00 0.23 C ATOM 1810 C LEU A 114 -4.758 -3.565 -8.958 1.00 0.22 C ATOM 1811 O LEU A 114 -4.891 -2.352 -8.875 1.00 0.24 O ATOM 1812 CB LEU A 114 -6.927 -4.185 -9.928 1.00 0.23 C ATOM 1813 CG LEU A 114 -6.293 -3.839 -11.274 1.00 0.22 C ATOM 1814 CD1 LEU A 114 -5.878 -5.104 -12.007 1.00 0.21 C ATOM 1815 CD2 LEU A 114 -7.235 -2.986 -12.107 1.00 0.26 C ATOM 0 H LEU A 114 -7.379 -3.815 -7.491 1.00 0.28 H new ATOM 0 HA LEU A 114 -5.624 -5.527 -8.952 1.00 0.23 H new ATOM 0 HB2 LEU A 114 -7.581 -5.048 -10.058 1.00 0.23 H new ATOM 0 HB3 LEU A 114 -7.556 -3.353 -9.611 1.00 0.23 H new ATOM 0 HG LEU A 114 -5.392 -3.251 -11.097 1.00 0.22 H new ATOM 0 HD11 LEU A 114 -5.428 -4.839 -12.964 1.00 0.21 H new ATOM 0 HD12 LEU A 114 -5.154 -5.652 -11.405 1.00 0.21 H new ATOM 0 HD13 LEU A 114 -6.754 -5.729 -12.179 1.00 0.21 H new ATOM 0 HD21 LEU A 114 -6.765 -2.751 -13.062 1.00 0.26 H new ATOM 0 HD22 LEU A 114 -8.161 -3.533 -12.284 1.00 0.26 H new ATOM 0 HD23 LEU A 114 -7.456 -2.061 -11.574 1.00 0.26 H new ATOM 1827 N VAL A 115 -3.627 -4.146 -9.185 1.00 0.23 N ATOM 1828 CA VAL A 115 -2.389 -3.461 -9.001 1.00 0.23 C ATOM 1829 C VAL A 115 -1.566 -3.454 -10.259 1.00 0.23 C ATOM 1830 O VAL A 115 -1.282 -4.500 -10.851 1.00 0.24 O ATOM 1831 CB VAL A 115 -1.633 -4.108 -7.840 1.00 0.24 C ATOM 1832 CG1 VAL A 115 -2.113 -5.548 -7.666 1.00 0.25 C ATOM 1833 CG2 VAL A 115 -0.126 -4.035 -8.027 1.00 0.26 C ATOM 0 H VAL A 115 -3.534 -5.110 -9.504 1.00 0.23 H new ATOM 0 HA VAL A 115 -2.591 -2.417 -8.761 1.00 0.23 H new ATOM 0 HB VAL A 115 -1.849 -3.549 -6.929 1.00 0.24 H new ATOM 0 HG11 VAL A 115 -1.576 -6.013 -6.839 1.00 0.25 H new ATOM 0 HG12 VAL A 115 -3.182 -5.552 -7.453 1.00 0.25 H new ATOM 0 HG13 VAL A 115 -1.924 -6.108 -8.582 1.00 0.25 H new ATOM 0 HG21 VAL A 115 0.369 -4.507 -7.178 1.00 0.26 H new ATOM 0 HG22 VAL A 115 0.152 -4.554 -8.944 1.00 0.26 H new ATOM 0 HG23 VAL A 115 0.182 -2.992 -8.093 1.00 0.26 H new ATOM 1843 N TYR A 116 -1.212 -2.267 -10.681 1.00 0.25 N ATOM 1844 CA TYR A 116 -0.361 -2.128 -11.828 1.00 0.25 C ATOM 1845 C TYR A 116 1.031 -1.684 -11.415 1.00 0.26 C ATOM 1846 O TYR A 116 1.205 -0.621 -10.819 1.00 0.28 O ATOM 1847 CB TYR A 116 -0.966 -1.152 -12.836 1.00 0.31 C ATOM 1848 CG TYR A 116 -0.153 -0.983 -14.098 1.00 0.83 C ATOM 1849 CD1 TYR A 116 -0.073 -2.001 -15.038 1.00 1.31 C ATOM 1850 CD2 TYR A 116 0.529 0.198 -14.350 1.00 1.10 C ATOM 1851 CE1 TYR A 116 0.666 -1.846 -16.193 1.00 1.87 C ATOM 1852 CE2 TYR A 116 1.266 0.362 -15.504 1.00 1.65 C ATOM 1853 CZ TYR A 116 1.333 -0.661 -16.420 1.00 1.99 C ATOM 1854 OH TYR A 116 2.053 -0.491 -17.578 1.00 2.57 O ATOM 0 H TYR A 116 -1.499 -1.389 -10.248 1.00 0.25 H new ATOM 0 HA TYR A 116 -0.277 -3.103 -12.309 1.00 0.25 H new ATOM 0 HB2 TYR A 116 -1.965 -1.496 -13.104 1.00 0.31 H new ATOM 0 HB3 TYR A 116 -1.082 -0.179 -12.358 1.00 0.31 H new ATOM 0 HD1 TYR A 116 -0.597 -2.929 -14.863 1.00 1.31 H new ATOM 0 HD2 TYR A 116 0.482 1.002 -13.631 1.00 1.10 H new ATOM 0 HE1 TYR A 116 0.722 -2.648 -16.914 1.00 1.87 H new ATOM 0 HE2 TYR A 116 1.788 1.290 -15.687 1.00 1.65 H new ATOM 0 HH TYR A 116 1.438 -0.370 -18.331 1.00 2.57 H new ATOM 1864 N ILE A 117 2.014 -2.508 -11.731 1.00 0.30 N ATOM 1865 CA ILE A 117 3.391 -2.211 -11.396 1.00 0.33 C ATOM 1866 C ILE A 117 4.036 -1.430 -12.532 1.00 0.38 C ATOM 1867 O ILE A 117 4.448 -1.997 -13.546 1.00 0.46 O ATOM 1868 CB ILE A 117 4.207 -3.503 -11.103 1.00 0.42 C ATOM 1869 CG1 ILE A 117 3.677 -4.219 -9.855 1.00 0.45 C ATOM 1870 CG2 ILE A 117 5.687 -3.200 -10.931 1.00 0.52 C ATOM 1871 CD1 ILE A 117 2.424 -5.025 -10.094 1.00 0.89 C ATOM 0 H ILE A 117 1.881 -3.392 -12.222 1.00 0.30 H new ATOM 0 HA ILE A 117 3.394 -1.610 -10.487 1.00 0.33 H new ATOM 0 HB ILE A 117 4.086 -4.159 -11.965 1.00 0.42 H new ATOM 0 HG12 ILE A 117 4.454 -4.880 -9.471 1.00 0.45 H new ATOM 0 HG13 ILE A 117 3.478 -3.478 -9.081 1.00 0.45 H new ATOM 0 HG21 ILE A 117 6.227 -4.125 -10.728 1.00 0.52 H new ATOM 0 HG22 ILE A 117 6.074 -2.747 -11.844 1.00 0.52 H new ATOM 0 HG23 ILE A 117 5.823 -2.510 -10.098 1.00 0.52 H new ATOM 0 HD11 ILE A 117 2.114 -5.500 -9.163 1.00 0.89 H new ATOM 0 HD12 ILE A 117 1.630 -4.367 -10.448 1.00 0.89 H new ATOM 0 HD13 ILE A 117 2.622 -5.791 -10.844 1.00 0.89 H new ATOM 1883 N LYS A 118 4.097 -0.121 -12.365 1.00 0.42 N ATOM 1884 CA LYS A 118 4.726 0.736 -13.348 1.00 0.52 C ATOM 1885 C LYS A 118 6.054 1.226 -12.815 1.00 0.39 C ATOM 1886 O LYS A 118 6.188 1.540 -11.633 1.00 0.34 O ATOM 1887 CB LYS A 118 3.834 1.926 -13.716 1.00 0.70 C ATOM 1888 CG LYS A 118 4.464 2.829 -14.764 1.00 0.93 C ATOM 1889 CD LYS A 118 3.579 4.006 -15.134 1.00 0.94 C ATOM 1890 CE LYS A 118 2.376 3.583 -15.955 1.00 0.72 C ATOM 1891 NZ LYS A 118 1.636 4.757 -16.487 1.00 1.20 N ATOM 0 H LYS A 118 3.717 0.370 -11.556 1.00 0.42 H new ATOM 0 HA LYS A 118 4.885 0.153 -14.255 1.00 0.52 H new ATOM 0 HB2 LYS A 118 2.878 1.557 -14.087 1.00 0.70 H new ATOM 0 HB3 LYS A 118 3.624 2.509 -12.819 1.00 0.70 H new ATOM 0 HG2 LYS A 118 5.418 3.201 -14.391 1.00 0.93 H new ATOM 0 HG3 LYS A 118 4.678 2.245 -15.659 1.00 0.93 H new ATOM 0 HD2 LYS A 118 3.240 4.503 -14.225 1.00 0.94 H new ATOM 0 HD3 LYS A 118 4.163 4.734 -15.697 1.00 0.94 H new ATOM 0 HE2 LYS A 118 2.703 2.953 -16.782 1.00 0.72 H new ATOM 0 HE3 LYS A 118 1.709 2.980 -15.339 1.00 0.72 H new ATOM 0 HZ1 LYS A 118 0.820 4.430 -17.043 1.00 1.20 H new ATOM 0 HZ2 LYS A 118 1.303 5.345 -15.696 1.00 1.20 H new ATOM 0 HZ3 LYS A 118 2.266 5.319 -17.094 1.00 1.20 H new ATOM 1905 N ARG A 119 7.032 1.301 -13.685 1.00 0.52 N ATOM 1906 CA ARG A 119 8.345 1.702 -13.282 1.00 0.52 C ATOM 1907 C ARG A 119 8.849 2.759 -14.232 1.00 0.49 C ATOM 1908 O ARG A 119 9.177 2.481 -15.384 1.00 0.58 O ATOM 1909 CB ARG A 119 9.277 0.481 -13.227 1.00 0.79 C ATOM 1910 CG ARG A 119 10.714 0.792 -12.821 1.00 1.00 C ATOM 1911 CD ARG A 119 11.542 1.254 -14.009 1.00 1.25 C ATOM 1912 NE ARG A 119 11.620 0.222 -15.043 1.00 1.68 N ATOM 1913 CZ ARG A 119 12.731 -0.114 -15.692 1.00 2.18 C ATOM 1914 NH1 ARG A 119 13.895 0.425 -15.361 1.00 2.57 N ATOM 1915 NH2 ARG A 119 12.682 -1.018 -16.658 1.00 2.80 N ATOM 0 H ARG A 119 6.936 1.088 -14.678 1.00 0.52 H new ATOM 0 HA ARG A 119 8.319 2.130 -12.280 1.00 0.52 H new ATOM 0 HB2 ARG A 119 8.864 -0.242 -12.524 1.00 0.79 H new ATOM 0 HB3 ARG A 119 9.286 0.004 -14.207 1.00 0.79 H new ATOM 0 HG2 ARG A 119 10.717 1.565 -12.052 1.00 1.00 H new ATOM 0 HG3 ARG A 119 11.169 -0.096 -12.382 1.00 1.00 H new ATOM 0 HD2 ARG A 119 11.103 2.159 -14.429 1.00 1.25 H new ATOM 0 HD3 ARG A 119 12.547 1.512 -13.675 1.00 1.25 H new ATOM 0 HE ARG A 119 10.762 -0.275 -15.283 1.00 1.68 H new ATOM 0 HH11 ARG A 119 13.945 1.105 -14.602 1.00 2.57 H new ATOM 0 HH12 ARG A 119 14.741 0.160 -15.865 1.00 2.57 H new ATOM 0 HH21 ARG A 119 11.793 -1.455 -16.903 1.00 2.80 H new ATOM 0 HH22 ARG A 119 13.533 -1.277 -17.157 1.00 2.80 H new ATOM 1929 N TYR A 120 8.828 3.983 -13.762 1.00 0.43 N ATOM 1930 CA TYR A 120 9.520 5.051 -14.435 1.00 0.46 C ATOM 1931 C TYR A 120 11.002 4.818 -14.226 1.00 0.50 C ATOM 1932 O TYR A 120 11.458 4.795 -13.085 1.00 0.48 O ATOM 1933 CB TYR A 120 9.091 6.409 -13.875 1.00 0.46 C ATOM 1934 CG TYR A 120 7.648 6.766 -14.159 1.00 0.51 C ATOM 1935 CD1 TYR A 120 6.609 6.151 -13.473 1.00 0.58 C ATOM 1936 CD2 TYR A 120 7.326 7.716 -15.118 1.00 0.76 C ATOM 1937 CE1 TYR A 120 5.293 6.475 -13.733 1.00 0.66 C ATOM 1938 CE2 TYR A 120 6.011 8.046 -15.385 1.00 0.83 C ATOM 1939 CZ TYR A 120 4.999 7.424 -14.690 1.00 0.70 C ATOM 1940 OH TYR A 120 3.686 7.743 -14.959 1.00 0.81 O ATOM 0 H TYR A 120 8.337 4.263 -12.913 1.00 0.43 H new ATOM 0 HA TYR A 120 9.282 5.060 -15.499 1.00 0.46 H new ATOM 0 HB2 TYR A 120 9.249 6.412 -12.797 1.00 0.46 H new ATOM 0 HB3 TYR A 120 9.735 7.183 -14.294 1.00 0.46 H new ATOM 0 HD1 TYR A 120 6.835 5.407 -12.724 1.00 0.58 H new ATOM 0 HD2 TYR A 120 8.117 8.206 -15.665 1.00 0.76 H new ATOM 0 HE1 TYR A 120 4.497 5.988 -13.190 1.00 0.66 H new ATOM 0 HE2 TYR A 120 5.779 8.788 -16.135 1.00 0.83 H new ATOM 0 HH TYR A 120 3.653 8.430 -15.658 1.00 0.81 H new ATOM 1950 N GLU A 121 11.701 4.545 -15.321 1.00 0.61 N ATOM 1951 CA GLU A 121 13.127 4.206 -15.317 1.00 0.73 C ATOM 1952 C GLU A 121 13.924 5.075 -14.356 1.00 0.70 C ATOM 1953 O GLU A 121 14.310 6.199 -14.678 1.00 0.79 O ATOM 1954 CB GLU A 121 13.721 4.317 -16.724 1.00 0.96 C ATOM 1955 CG GLU A 121 12.958 3.535 -17.783 1.00 1.06 C ATOM 1956 CD GLU A 121 11.911 4.376 -18.485 1.00 1.69 C ATOM 1957 OE1 GLU A 121 10.820 4.591 -17.911 1.00 2.27 O ATOM 1958 OE2 GLU A 121 12.184 4.843 -19.611 1.00 2.28 O ATOM 0 H GLU A 121 11.290 4.552 -16.255 1.00 0.61 H new ATOM 0 HA GLU A 121 13.199 3.174 -14.975 1.00 0.73 H new ATOM 0 HB2 GLU A 121 13.749 5.368 -17.013 1.00 0.96 H new ATOM 0 HB3 GLU A 121 14.752 3.965 -16.700 1.00 0.96 H new ATOM 0 HG2 GLU A 121 13.661 3.147 -18.520 1.00 1.06 H new ATOM 0 HG3 GLU A 121 12.476 2.675 -17.318 1.00 1.06 H new ATOM 1965 N GLY A 122 14.141 4.527 -13.173 1.00 0.67 N ATOM 1966 CA GLY A 122 14.890 5.213 -12.135 1.00 0.71 C ATOM 1967 C GLY A 122 14.230 6.501 -11.710 1.00 0.66 C ATOM 1968 O GLY A 122 14.900 7.489 -11.405 1.00 0.76 O ATOM 0 H GLY A 122 13.806 3.601 -12.906 1.00 0.67 H new ATOM 0 HA2 GLY A 122 14.993 4.557 -11.270 1.00 0.71 H new ATOM 0 HA3 GLY A 122 15.897 5.425 -12.496 1.00 0.71 H new ATOM 1972 N ASN A 123 12.910 6.482 -11.683 1.00 0.57 N ATOM 1973 CA ASN A 123 12.133 7.651 -11.324 1.00 0.54 C ATOM 1974 C ASN A 123 11.037 7.276 -10.331 1.00 0.45 C ATOM 1975 O ASN A 123 10.850 7.962 -9.331 1.00 0.45 O ATOM 1976 CB ASN A 123 11.517 8.261 -12.583 1.00 0.60 C ATOM 1977 CG ASN A 123 11.055 9.705 -12.408 1.00 1.01 C ATOM 1978 OD1 ASN A 123 10.720 10.102 -11.190 1.00 1.65 O flip ATOM 1979 ND2 ASN A 123 11.007 10.468 -13.373 1.00 1.61 N flip ATOM 0 H ASN A 123 12.350 5.660 -11.908 1.00 0.57 H new ATOM 0 HA ASN A 123 12.789 8.383 -10.853 1.00 0.54 H new ATOM 0 HB2 ASN A 123 12.248 8.219 -13.390 1.00 0.60 H new ATOM 0 HB3 ASN A 123 10.667 7.653 -12.891 1.00 0.60 H new ATOM 0 HD21 ASN A 123 11.271 10.135 -14.300 1.00 1.61 H new ATOM 0 HD22 ASN A 123 10.703 11.433 -13.245 1.00 1.61 H new ATOM 1986 N MET A 124 10.322 6.184 -10.601 1.00 0.39 N ATOM 1987 CA MET A 124 9.216 5.765 -9.733 1.00 0.34 C ATOM 1988 C MET A 124 8.915 4.280 -9.894 1.00 0.33 C ATOM 1989 O MET A 124 8.625 3.811 -10.993 1.00 0.40 O ATOM 1990 CB MET A 124 7.938 6.569 -10.018 1.00 0.34 C ATOM 1991 CG MET A 124 7.500 7.477 -8.875 1.00 0.56 C ATOM 1992 SD MET A 124 8.145 9.158 -9.009 1.00 1.09 S ATOM 1993 CE MET A 124 7.328 9.718 -10.502 1.00 1.12 C ATOM 0 H MET A 124 10.484 5.577 -11.405 1.00 0.39 H new ATOM 0 HA MET A 124 9.536 5.957 -8.709 1.00 0.34 H new ATOM 0 HB2 MET A 124 8.096 7.177 -10.909 1.00 0.34 H new ATOM 0 HB3 MET A 124 7.129 5.875 -10.245 1.00 0.34 H new ATOM 0 HG2 MET A 124 6.411 7.515 -8.847 1.00 0.56 H new ATOM 0 HG3 MET A 124 7.828 7.044 -7.930 1.00 0.56 H new ATOM 0 HE1 MET A 124 7.966 10.435 -11.019 1.00 1.12 H new ATOM 0 HE2 MET A 124 7.138 8.866 -11.154 1.00 1.12 H new ATOM 0 HE3 MET A 124 6.383 10.195 -10.243 1.00 1.12 H new ATOM 2003 N ASN A 125 8.985 3.558 -8.789 1.00 0.34 N ATOM 2004 CA ASN A 125 8.624 2.147 -8.744 1.00 0.37 C ATOM 2005 C ASN A 125 7.267 2.011 -8.074 1.00 0.32 C ATOM 2006 O ASN A 125 7.168 1.612 -6.915 1.00 0.37 O ATOM 2007 CB ASN A 125 9.675 1.347 -7.966 1.00 0.50 C ATOM 2008 CG ASN A 125 10.989 1.215 -8.710 1.00 0.95 C ATOM 2009 OD1 ASN A 125 11.842 2.099 -8.651 1.00 1.58 O ATOM 2010 ND2 ASN A 125 11.172 0.098 -9.397 1.00 1.62 N ATOM 0 H ASN A 125 9.295 3.933 -7.893 1.00 0.34 H new ATOM 0 HA ASN A 125 8.579 1.752 -9.759 1.00 0.37 H new ATOM 0 HB2 ASN A 125 9.854 1.831 -7.006 1.00 0.50 H new ATOM 0 HB3 ASN A 125 9.283 0.353 -7.753 1.00 0.50 H new ATOM 0 HD21 ASN A 125 12.045 -0.053 -9.902 1.00 1.62 H new ATOM 0 HD22 ASN A 125 10.440 -0.612 -9.421 1.00 1.62 H new ATOM 2017 N ILE A 126 6.229 2.387 -8.799 1.00 0.26 N ATOM 2018 CA ILE A 126 4.892 2.466 -8.240 1.00 0.23 C ATOM 2019 C ILE A 126 4.049 1.217 -8.511 1.00 0.27 C ATOM 2020 O ILE A 126 4.033 0.691 -9.626 1.00 0.30 O ATOM 2021 CB ILE A 126 4.140 3.691 -8.807 1.00 0.22 C ATOM 2022 CG1 ILE A 126 2.645 3.587 -8.499 1.00 0.24 C ATOM 2023 CG2 ILE A 126 4.395 3.847 -10.297 1.00 0.24 C ATOM 2024 CD1 ILE A 126 1.790 4.653 -9.153 1.00 0.26 C ATOM 0 H ILE A 126 6.288 2.644 -9.784 1.00 0.26 H new ATOM 0 HA ILE A 126 5.027 2.556 -7.162 1.00 0.23 H new ATOM 0 HB ILE A 126 4.522 4.588 -8.319 1.00 0.22 H new ATOM 0 HG12 ILE A 126 2.289 2.608 -8.819 1.00 0.24 H new ATOM 0 HG13 ILE A 126 2.505 3.640 -7.419 1.00 0.24 H new ATOM 0 HG21 ILE A 126 3.854 4.717 -10.670 1.00 0.24 H new ATOM 0 HG22 ILE A 126 5.462 3.982 -10.471 1.00 0.24 H new ATOM 0 HG23 ILE A 126 4.052 2.954 -10.820 1.00 0.24 H new ATOM 0 HD11 ILE A 126 0.746 4.501 -8.879 1.00 0.26 H new ATOM 0 HD12 ILE A 126 2.114 5.637 -8.815 1.00 0.26 H new ATOM 0 HD13 ILE A 126 1.894 4.589 -10.236 1.00 0.26 H new ATOM 2036 N ILE A 127 3.341 0.754 -7.482 1.00 0.30 N ATOM 2037 CA ILE A 127 2.252 -0.188 -7.682 1.00 0.34 C ATOM 2038 C ILE A 127 0.921 0.548 -7.522 1.00 0.38 C ATOM 2039 O ILE A 127 0.566 1.025 -6.446 1.00 0.45 O ATOM 2040 CB ILE A 127 2.300 -1.419 -6.738 1.00 0.41 C ATOM 2041 CG1 ILE A 127 2.117 -1.024 -5.270 1.00 0.42 C ATOM 2042 CG2 ILE A 127 3.611 -2.168 -6.922 1.00 0.50 C ATOM 2043 CD1 ILE A 127 1.692 -2.178 -4.387 1.00 0.59 C ATOM 0 H ILE A 127 3.504 1.016 -6.510 1.00 0.30 H new ATOM 0 HA ILE A 127 2.359 -0.587 -8.691 1.00 0.34 H new ATOM 0 HB ILE A 127 1.469 -2.072 -7.006 1.00 0.41 H new ATOM 0 HG12 ILE A 127 3.053 -0.612 -4.892 1.00 0.42 H new ATOM 0 HG13 ILE A 127 1.371 -0.232 -5.205 1.00 0.42 H new ATOM 0 HG21 ILE A 127 3.634 -3.030 -6.255 1.00 0.50 H new ATOM 0 HG22 ILE A 127 3.695 -2.506 -7.955 1.00 0.50 H new ATOM 0 HG23 ILE A 127 4.444 -1.506 -6.688 1.00 0.50 H new ATOM 0 HD11 ILE A 127 1.581 -1.829 -3.360 1.00 0.59 H new ATOM 0 HD12 ILE A 127 0.741 -2.575 -4.740 1.00 0.59 H new ATOM 0 HD13 ILE A 127 2.449 -2.962 -4.423 1.00 0.59 H new ATOM 2055 N SER A 128 0.230 0.711 -8.627 1.00 0.39 N ATOM 2056 CA SER A 128 -1.057 1.385 -8.644 1.00 0.50 C ATOM 2057 C SER A 128 -2.186 0.393 -8.421 1.00 0.55 C ATOM 2058 O SER A 128 -2.430 -0.469 -9.255 1.00 1.00 O ATOM 2059 CB SER A 128 -1.214 2.060 -9.991 1.00 0.68 C ATOM 2060 OG SER A 128 0.047 2.514 -10.443 1.00 1.18 O ATOM 0 H SER A 128 0.540 0.382 -9.541 1.00 0.39 H new ATOM 0 HA SER A 128 -1.100 2.122 -7.842 1.00 0.50 H new ATOM 0 HB2 SER A 128 -1.640 1.362 -10.712 1.00 0.68 H new ATOM 0 HB3 SER A 128 -1.906 2.898 -9.911 1.00 0.68 H new ATOM 0 HG SER A 128 0.336 1.970 -11.205 1.00 1.18 H new ATOM 2066 N SER A 129 -2.879 0.526 -7.313 1.00 0.30 N ATOM 2067 CA SER A 129 -3.871 -0.457 -6.924 1.00 0.31 C ATOM 2068 C SER A 129 -5.281 0.126 -6.939 1.00 0.31 C ATOM 2069 O SER A 129 -5.495 1.301 -6.646 1.00 0.43 O ATOM 2070 CB SER A 129 -3.539 -1.024 -5.541 1.00 0.40 C ATOM 2071 OG SER A 129 -3.508 -0.010 -4.552 1.00 1.24 O ATOM 0 H SER A 129 -2.776 1.305 -6.663 1.00 0.30 H new ATOM 0 HA SER A 129 -3.844 -1.264 -7.656 1.00 0.31 H new ATOM 0 HB2 SER A 129 -4.280 -1.775 -5.268 1.00 0.40 H new ATOM 0 HB3 SER A 129 -2.573 -1.527 -5.576 1.00 0.40 H new ATOM 0 HG SER A 129 -4.162 -0.216 -3.852 1.00 1.24 H new ATOM 2077 N LYS A 130 -6.241 -0.703 -7.311 1.00 0.27 N ATOM 2078 CA LYS A 130 -7.630 -0.329 -7.267 1.00 0.32 C ATOM 2079 C LYS A 130 -8.384 -1.456 -6.636 1.00 0.37 C ATOM 2080 O LYS A 130 -8.302 -2.575 -7.119 1.00 0.41 O ATOM 2081 CB LYS A 130 -8.219 -0.125 -8.662 1.00 0.40 C ATOM 2082 CG LYS A 130 -7.443 0.800 -9.572 1.00 0.90 C ATOM 2083 CD LYS A 130 -8.158 0.976 -10.907 1.00 0.80 C ATOM 2084 CE LYS A 130 -9.417 1.831 -10.772 1.00 1.42 C ATOM 2085 NZ LYS A 130 -10.559 1.093 -10.154 1.00 2.26 N ATOM 0 H LYS A 130 -6.073 -1.650 -7.650 1.00 0.27 H new ATOM 0 HA LYS A 130 -7.710 0.606 -6.713 1.00 0.32 H new ATOM 0 HB2 LYS A 130 -8.301 -1.097 -9.147 1.00 0.40 H new ATOM 0 HB3 LYS A 130 -9.231 0.265 -8.556 1.00 0.40 H new ATOM 0 HG2 LYS A 130 -7.319 1.770 -9.091 1.00 0.90 H new ATOM 0 HG3 LYS A 130 -6.444 0.397 -9.740 1.00 0.90 H new ATOM 0 HD2 LYS A 130 -7.480 1.439 -11.623 1.00 0.80 H new ATOM 0 HD3 LYS A 130 -8.425 -0.002 -11.307 1.00 0.80 H new ATOM 0 HE2 LYS A 130 -9.190 2.710 -10.168 1.00 1.42 H new ATOM 0 HE3 LYS A 130 -9.714 2.189 -11.758 1.00 1.42 H new ATOM 0 HZ1 LYS A 130 -11.434 1.309 -10.674 1.00 2.26 H new ATOM 0 HZ2 LYS A 130 -10.375 0.070 -10.196 1.00 2.26 H new ATOM 0 HZ3 LYS A 130 -10.665 1.385 -9.162 1.00 2.26 H new ATOM 2099 N SER A 131 -9.105 -1.195 -5.580 1.00 0.41 N ATOM 2100 CA SER A 131 -9.995 -2.199 -5.075 1.00 0.44 C ATOM 2101 C SER A 131 -11.027 -2.419 -6.155 1.00 0.41 C ATOM 2102 O SER A 131 -11.962 -1.635 -6.314 1.00 0.47 O ATOM 2103 CB SER A 131 -10.626 -1.755 -3.766 1.00 0.56 C ATOM 2104 OG SER A 131 -11.439 -2.767 -3.198 1.00 1.39 O ATOM 0 H SER A 131 -9.095 -0.316 -5.063 1.00 0.41 H new ATOM 0 HA SER A 131 -9.471 -3.128 -4.849 1.00 0.44 H new ATOM 0 HB2 SER A 131 -9.842 -1.481 -3.060 1.00 0.56 H new ATOM 0 HB3 SER A 131 -11.226 -0.862 -3.938 1.00 0.56 H new ATOM 0 HG SER A 131 -11.297 -2.795 -2.229 1.00 1.39 H new ATOM 2110 N VAL A 132 -10.828 -3.460 -6.932 1.00 0.35 N ATOM 2111 CA VAL A 132 -11.521 -3.579 -8.172 1.00 0.36 C ATOM 2112 C VAL A 132 -12.601 -4.614 -8.032 1.00 0.37 C ATOM 2113 O VAL A 132 -12.394 -5.705 -7.499 1.00 0.46 O ATOM 2114 CB VAL A 132 -10.567 -3.892 -9.356 1.00 0.40 C ATOM 2115 CG1 VAL A 132 -10.545 -5.355 -9.734 1.00 0.88 C ATOM 2116 CG2 VAL A 132 -10.907 -3.025 -10.554 1.00 1.05 C ATOM 0 H VAL A 132 -10.192 -4.228 -6.719 1.00 0.35 H new ATOM 0 HA VAL A 132 -11.976 -2.618 -8.411 1.00 0.36 H new ATOM 0 HB VAL A 132 -9.559 -3.653 -9.017 1.00 0.40 H new ATOM 0 HG11 VAL A 132 -9.859 -5.505 -10.568 1.00 0.88 H new ATOM 0 HG12 VAL A 132 -10.214 -5.946 -8.880 1.00 0.88 H new ATOM 0 HG13 VAL A 132 -11.546 -5.670 -10.027 1.00 0.88 H new ATOM 0 HG21 VAL A 132 -10.229 -3.257 -11.375 1.00 1.05 H new ATOM 0 HG22 VAL A 132 -11.933 -3.220 -10.865 1.00 1.05 H new ATOM 0 HG23 VAL A 132 -10.803 -1.974 -10.284 1.00 1.05 H new ATOM 2126 N ASP A 133 -13.756 -4.239 -8.494 1.00 0.39 N ATOM 2127 CA ASP A 133 -14.968 -4.952 -8.200 1.00 0.43 C ATOM 2128 C ASP A 133 -15.173 -6.037 -9.236 1.00 0.43 C ATOM 2129 O ASP A 133 -16.062 -5.960 -10.085 1.00 0.59 O ATOM 2130 CB ASP A 133 -16.093 -3.934 -8.190 1.00 0.54 C ATOM 2131 CG ASP A 133 -17.301 -4.356 -7.378 1.00 1.27 C ATOM 2132 OD1 ASP A 133 -18.091 -5.191 -7.860 1.00 1.39 O ATOM 2133 OD2 ASP A 133 -17.487 -3.814 -6.264 1.00 2.17 O ATOM 0 H ASP A 133 -13.887 -3.423 -9.091 1.00 0.39 H new ATOM 0 HA ASP A 133 -14.932 -5.448 -7.230 1.00 0.43 H new ATOM 0 HB2 ASP A 133 -15.713 -2.992 -7.794 1.00 0.54 H new ATOM 0 HB3 ASP A 133 -16.407 -3.745 -9.217 1.00 0.54 H new ATOM 2138 N PHE A 134 -14.305 -7.037 -9.179 1.00 0.35 N ATOM 2139 CA PHE A 134 -14.262 -8.067 -10.200 1.00 0.40 C ATOM 2140 C PHE A 134 -14.845 -9.383 -9.631 1.00 0.46 C ATOM 2141 O PHE A 134 -15.162 -9.435 -8.450 1.00 0.50 O ATOM 2142 CB PHE A 134 -12.802 -8.211 -10.676 1.00 0.39 C ATOM 2143 CG PHE A 134 -12.002 -9.154 -9.846 1.00 0.38 C ATOM 2144 CD1 PHE A 134 -11.945 -8.995 -8.482 1.00 0.36 C ATOM 2145 CD2 PHE A 134 -11.335 -10.217 -10.425 1.00 0.51 C ATOM 2146 CE1 PHE A 134 -11.246 -9.872 -7.706 1.00 0.42 C ATOM 2147 CE2 PHE A 134 -10.620 -11.095 -9.646 1.00 0.53 C ATOM 2148 CZ PHE A 134 -10.586 -10.917 -8.280 1.00 0.45 C ATOM 0 H PHE A 134 -13.620 -7.155 -8.433 1.00 0.35 H new ATOM 0 HA PHE A 134 -14.873 -7.803 -11.063 1.00 0.40 H new ATOM 0 HB2 PHE A 134 -12.797 -8.554 -11.711 1.00 0.39 H new ATOM 0 HB3 PHE A 134 -12.324 -7.231 -10.663 1.00 0.39 H new ATOM 0 HD1 PHE A 134 -12.460 -8.166 -8.019 1.00 0.36 H new ATOM 0 HD2 PHE A 134 -11.376 -10.358 -11.495 1.00 0.51 H new ATOM 0 HE1 PHE A 134 -11.215 -9.738 -6.635 1.00 0.42 H new ATOM 0 HE2 PHE A 134 -10.089 -11.918 -10.101 1.00 0.53 H new ATOM 0 HZ PHE A 134 -10.034 -11.609 -7.661 1.00 0.45 H new ATOM 2158 N PRO A 135 -14.992 -10.450 -10.453 1.00 0.61 N ATOM 2159 CA PRO A 135 -15.616 -11.737 -10.065 1.00 0.75 C ATOM 2160 C PRO A 135 -15.364 -12.221 -8.619 1.00 0.92 C ATOM 2161 O PRO A 135 -16.310 -12.566 -7.910 1.00 1.13 O ATOM 2162 CB PRO A 135 -15.007 -12.739 -11.062 1.00 1.28 C ATOM 2163 CG PRO A 135 -14.184 -11.937 -12.026 1.00 1.19 C ATOM 2164 CD PRO A 135 -14.598 -10.504 -11.861 1.00 0.76 C ATOM 0 HA PRO A 135 -16.700 -11.631 -10.094 1.00 0.75 H new ATOM 0 HB2 PRO A 135 -14.391 -13.474 -10.545 1.00 1.28 H new ATOM 0 HB3 PRO A 135 -15.789 -13.290 -11.585 1.00 1.28 H new ATOM 0 HG2 PRO A 135 -13.120 -12.058 -11.821 1.00 1.19 H new ATOM 0 HG3 PRO A 135 -14.351 -12.272 -13.050 1.00 1.19 H new ATOM 0 HD2 PRO A 135 -13.780 -9.817 -12.081 1.00 0.76 H new ATOM 0 HD3 PRO A 135 -15.422 -10.241 -12.524 1.00 0.76 H new ATOM 2172 N GLU A 136 -14.108 -12.266 -8.185 1.00 1.10 N ATOM 2173 CA GLU A 136 -13.760 -12.861 -6.881 1.00 1.59 C ATOM 2174 C GLU A 136 -13.969 -11.872 -5.744 1.00 1.68 C ATOM 2175 O GLU A 136 -14.115 -12.250 -4.581 1.00 2.17 O ATOM 2176 CB GLU A 136 -12.308 -13.307 -6.890 1.00 1.78 C ATOM 2177 CG GLU A 136 -11.911 -13.946 -8.195 1.00 2.38 C ATOM 2178 CD GLU A 136 -12.703 -15.201 -8.478 1.00 3.03 C ATOM 2179 OE1 GLU A 136 -12.609 -16.154 -7.675 1.00 3.30 O ATOM 2180 OE2 GLU A 136 -13.424 -15.233 -9.495 1.00 3.50 O ATOM 0 H GLU A 136 -13.312 -11.902 -8.708 1.00 1.10 H new ATOM 0 HA GLU A 136 -14.416 -13.717 -6.720 1.00 1.59 H new ATOM 0 HB2 GLU A 136 -11.666 -12.447 -6.699 1.00 1.78 H new ATOM 0 HB3 GLU A 136 -12.143 -14.014 -6.077 1.00 1.78 H new ATOM 0 HG2 GLU A 136 -12.059 -13.234 -9.007 1.00 2.38 H new ATOM 0 HG3 GLU A 136 -10.848 -14.186 -8.172 1.00 2.38 H new ATOM 2187 N TYR A 137 -13.971 -10.613 -6.116 1.00 1.38 N ATOM 2188 CA TYR A 137 -14.031 -9.492 -5.187 1.00 1.79 C ATOM 2189 C TYR A 137 -15.239 -9.502 -4.217 1.00 1.42 C ATOM 2190 O TYR A 137 -15.077 -9.086 -3.073 1.00 1.58 O ATOM 2191 CB TYR A 137 -13.990 -8.210 -6.001 1.00 2.49 C ATOM 2192 CG TYR A 137 -14.154 -6.943 -5.188 1.00 3.43 C ATOM 2193 CD1 TYR A 137 -15.412 -6.409 -4.958 1.00 3.49 C ATOM 2194 CD2 TYR A 137 -13.054 -6.277 -4.659 1.00 4.47 C ATOM 2195 CE1 TYR A 137 -15.574 -5.256 -4.225 1.00 4.37 C ATOM 2196 CE2 TYR A 137 -13.210 -5.119 -3.926 1.00 5.35 C ATOM 2197 CZ TYR A 137 -14.436 -4.627 -3.684 1.00 5.22 C ATOM 2198 OH TYR A 137 -14.639 -3.458 -2.987 1.00 6.12 O ATOM 0 H TYR A 137 -13.930 -10.326 -7.094 1.00 1.38 H new ATOM 0 HA TYR A 137 -13.169 -9.574 -4.524 1.00 1.79 H new ATOM 0 HB2 TYR A 137 -13.041 -8.164 -6.534 1.00 2.49 H new ATOM 0 HB3 TYR A 137 -14.777 -8.248 -6.754 1.00 2.49 H new ATOM 0 HD1 TYR A 137 -16.281 -6.907 -5.362 1.00 3.49 H new ATOM 0 HD2 TYR A 137 -12.063 -6.672 -4.825 1.00 4.47 H new ATOM 0 HE1 TYR A 137 -16.558 -4.840 -4.067 1.00 4.37 H new ATOM 0 HE2 TYR A 137 -12.341 -4.605 -3.544 1.00 5.35 H new ATOM 0 HH TYR A 137 -15.543 -3.124 -3.165 1.00 6.12 H new ATOM 2208 N PRO A 138 -16.468 -9.906 -4.637 1.00 1.33 N ATOM 2209 CA PRO A 138 -17.603 -10.053 -3.708 1.00 1.10 C ATOM 2210 C PRO A 138 -17.192 -10.699 -2.380 1.00 0.99 C ATOM 2211 O PRO A 138 -16.757 -11.851 -2.353 1.00 0.99 O ATOM 2212 CB PRO A 138 -18.550 -10.965 -4.479 1.00 0.97 C ATOM 2213 CG PRO A 138 -18.325 -10.607 -5.907 1.00 1.56 C ATOM 2214 CD PRO A 138 -16.879 -10.187 -6.025 1.00 1.77 C ATOM 0 HA PRO A 138 -18.038 -9.094 -3.427 1.00 1.10 H new ATOM 0 HB2 PRO A 138 -18.329 -12.016 -4.293 1.00 0.97 H new ATOM 0 HB3 PRO A 138 -19.587 -10.800 -4.186 1.00 0.97 H new ATOM 0 HG2 PRO A 138 -18.536 -11.456 -6.557 1.00 1.56 H new ATOM 0 HG3 PRO A 138 -18.989 -9.799 -6.213 1.00 1.56 H new ATOM 0 HD2 PRO A 138 -16.271 -10.975 -6.468 1.00 1.77 H new ATOM 0 HD3 PRO A 138 -16.771 -9.306 -6.658 1.00 1.77 H new ATOM 2222 N PRO A 139 -17.290 -9.947 -1.269 1.00 0.96 N ATOM 2223 CA PRO A 139 -16.808 -10.372 0.048 1.00 0.91 C ATOM 2224 C PRO A 139 -17.810 -11.217 0.833 1.00 1.00 C ATOM 2225 O PRO A 139 -18.662 -11.906 0.264 1.00 1.25 O ATOM 2226 CB PRO A 139 -16.572 -9.043 0.787 1.00 0.82 C ATOM 2227 CG PRO A 139 -16.999 -7.954 -0.156 1.00 0.89 C ATOM 2228 CD PRO A 139 -17.863 -8.605 -1.198 1.00 1.06 C ATOM 0 HA PRO A 139 -15.928 -11.008 -0.053 1.00 0.91 H new ATOM 0 HB2 PRO A 139 -17.148 -9.005 1.711 1.00 0.82 H new ATOM 0 HB3 PRO A 139 -15.523 -8.931 1.060 1.00 0.82 H new ATOM 0 HG2 PRO A 139 -17.550 -7.176 0.374 1.00 0.89 H new ATOM 0 HG3 PRO A 139 -16.133 -7.476 -0.614 1.00 0.89 H new ATOM 0 HD2 PRO A 139 -18.913 -8.624 -0.905 1.00 1.06 H new ATOM 0 HD3 PRO A 139 -17.809 -8.087 -2.155 1.00 1.06 H new ATOM 2236 N SER A 140 -17.684 -11.152 2.151 1.00 0.90 N ATOM 2237 CA SER A 140 -18.528 -11.892 3.058 1.00 1.01 C ATOM 2238 C SER A 140 -18.935 -10.973 4.200 1.00 1.01 C ATOM 2239 O SER A 140 -18.886 -9.750 4.050 1.00 1.13 O ATOM 2240 CB SER A 140 -17.775 -13.116 3.584 1.00 1.09 C ATOM 2241 OG SER A 140 -16.500 -12.747 4.090 1.00 1.60 O ATOM 0 H SER A 140 -16.984 -10.576 2.618 1.00 0.90 H new ATOM 0 HA SER A 140 -19.423 -12.242 2.543 1.00 1.01 H new ATOM 0 HB2 SER A 140 -18.358 -13.596 4.370 1.00 1.09 H new ATOM 0 HB3 SER A 140 -17.656 -13.846 2.784 1.00 1.09 H new ATOM 0 HG SER A 140 -16.037 -13.544 4.422 1.00 1.60 H new ATOM 2247 N SER A 141 -19.332 -11.528 5.327 1.00 1.07 N ATOM 2248 CA SER A 141 -19.697 -10.701 6.457 1.00 1.19 C ATOM 2249 C SER A 141 -18.494 -10.419 7.356 1.00 1.07 C ATOM 2250 O SER A 141 -18.349 -9.315 7.888 1.00 1.22 O ATOM 2251 CB SER A 141 -20.832 -11.356 7.241 1.00 1.47 C ATOM 2252 OG SER A 141 -20.639 -12.761 7.336 1.00 1.97 O ATOM 0 H SER A 141 -19.409 -12.533 5.484 1.00 1.07 H new ATOM 0 HA SER A 141 -20.046 -9.740 6.079 1.00 1.19 H new ATOM 0 HB2 SER A 141 -20.885 -10.924 8.240 1.00 1.47 H new ATOM 0 HB3 SER A 141 -21.784 -11.148 6.752 1.00 1.47 H new ATOM 0 HG SER A 141 -21.377 -13.159 7.844 1.00 1.97 H new ATOM 2258 N ASN A 142 -17.623 -11.412 7.505 1.00 0.97 N ATOM 2259 CA ASN A 142 -16.448 -11.279 8.365 1.00 0.95 C ATOM 2260 C ASN A 142 -15.368 -10.427 7.713 1.00 0.86 C ATOM 2261 O ASN A 142 -14.823 -9.513 8.336 1.00 1.07 O ATOM 2262 CB ASN A 142 -15.868 -12.652 8.714 1.00 1.01 C ATOM 2263 CG ASN A 142 -16.665 -13.376 9.780 1.00 1.37 C ATOM 2264 OD1 ASN A 142 -17.880 -13.223 9.885 1.00 2.18 O ATOM 2265 ND2 ASN A 142 -15.979 -14.160 10.595 1.00 1.73 N ATOM 0 H ASN A 142 -17.707 -12.317 7.043 1.00 0.97 H new ATOM 0 HA ASN A 142 -16.778 -10.783 9.278 1.00 0.95 H new ATOM 0 HB2 ASN A 142 -15.834 -13.266 7.814 1.00 1.01 H new ATOM 0 HB3 ASN A 142 -14.840 -12.530 9.056 1.00 1.01 H new ATOM 0 HD21 ASN A 142 -16.458 -14.663 11.342 1.00 1.73 H new ATOM 0 HD22 ASN A 142 -14.971 -14.262 10.476 1.00 1.73 H new ATOM 2272 N TYR A 143 -15.062 -10.727 6.460 1.00 0.71 N ATOM 2273 CA TYR A 143 -14.017 -10.020 5.742 1.00 0.67 C ATOM 2274 C TYR A 143 -14.610 -8.880 4.954 1.00 0.61 C ATOM 2275 O TYR A 143 -15.517 -9.073 4.142 1.00 0.67 O ATOM 2276 CB TYR A 143 -13.259 -10.966 4.810 1.00 0.76 C ATOM 2277 CG TYR A 143 -12.467 -12.023 5.546 1.00 0.84 C ATOM 2278 CD1 TYR A 143 -11.223 -11.725 6.085 1.00 0.91 C ATOM 2279 CD2 TYR A 143 -12.960 -13.313 5.710 1.00 0.97 C ATOM 2280 CE1 TYR A 143 -10.492 -12.677 6.767 1.00 1.02 C ATOM 2281 CE2 TYR A 143 -12.233 -14.272 6.392 1.00 1.09 C ATOM 2282 CZ TYR A 143 -11.001 -13.948 6.917 1.00 1.09 C ATOM 2283 OH TYR A 143 -10.274 -14.896 7.601 1.00 1.23 O ATOM 0 H TYR A 143 -15.525 -11.458 5.920 1.00 0.71 H new ATOM 0 HA TYR A 143 -13.311 -9.621 6.471 1.00 0.67 H new ATOM 0 HB2 TYR A 143 -13.969 -11.453 4.142 1.00 0.76 H new ATOM 0 HB3 TYR A 143 -12.582 -10.384 4.185 1.00 0.76 H new ATOM 0 HD1 TYR A 143 -10.820 -10.730 5.969 1.00 0.91 H new ATOM 0 HD2 TYR A 143 -13.925 -13.570 5.299 1.00 0.97 H new ATOM 0 HE1 TYR A 143 -9.526 -12.427 7.181 1.00 1.02 H new ATOM 0 HE2 TYR A 143 -12.629 -15.270 6.512 1.00 1.09 H new ATOM 0 HH TYR A 143 -10.772 -15.740 7.619 1.00 1.23 H new ATOM 2293 N ILE A 144 -14.090 -7.691 5.188 1.00 0.56 N ATOM 2294 CA ILE A 144 -14.606 -6.519 4.533 1.00 0.53 C ATOM 2295 C ILE A 144 -13.622 -6.062 3.479 1.00 0.46 C ATOM 2296 O ILE A 144 -12.543 -5.555 3.793 1.00 0.47 O ATOM 2297 CB ILE A 144 -14.916 -5.389 5.539 1.00 0.61 C ATOM 2298 CG1 ILE A 144 -15.024 -4.034 4.832 1.00 0.62 C ATOM 2299 CG2 ILE A 144 -13.874 -5.354 6.638 1.00 0.68 C ATOM 2300 CD1 ILE A 144 -16.203 -3.929 3.887 1.00 0.82 C ATOM 0 H ILE A 144 -13.313 -7.518 5.826 1.00 0.56 H new ATOM 0 HA ILE A 144 -15.551 -6.775 4.054 1.00 0.53 H new ATOM 0 HB ILE A 144 -15.883 -5.597 5.997 1.00 0.61 H new ATOM 0 HG12 ILE A 144 -15.102 -3.248 5.583 1.00 0.62 H new ATOM 0 HG13 ILE A 144 -14.106 -3.852 4.274 1.00 0.62 H new ATOM 0 HG21 ILE A 144 -14.109 -4.551 7.337 1.00 0.68 H new ATOM 0 HG22 ILE A 144 -13.871 -6.307 7.167 1.00 0.68 H new ATOM 0 HG23 ILE A 144 -12.891 -5.178 6.202 1.00 0.68 H new ATOM 0 HD11 ILE A 144 -16.212 -2.942 3.425 1.00 0.82 H new ATOM 0 HD12 ILE A 144 -16.118 -4.691 3.113 1.00 0.82 H new ATOM 0 HD13 ILE A 144 -17.129 -4.078 4.442 1.00 0.82 H new ATOM 2312 N ARG A 145 -13.983 -6.311 2.232 1.00 0.43 N ATOM 2313 CA ARG A 145 -13.170 -5.893 1.109 1.00 0.41 C ATOM 2314 C ARG A 145 -12.989 -4.381 1.137 1.00 0.45 C ATOM 2315 O ARG A 145 -13.897 -3.630 0.781 1.00 0.48 O ATOM 2316 CB ARG A 145 -13.799 -6.334 -0.216 1.00 0.44 C ATOM 2317 CG ARG A 145 -12.803 -6.980 -1.168 1.00 0.81 C ATOM 2318 CD ARG A 145 -12.403 -8.373 -0.705 1.00 2.08 C ATOM 2319 NE ARG A 145 -13.419 -9.375 -1.038 1.00 2.70 N ATOM 2320 CZ ARG A 145 -13.176 -10.684 -1.162 1.00 3.63 C ATOM 2321 NH1 ARG A 145 -11.972 -11.169 -0.942 1.00 4.14 N ATOM 2322 NH2 ARG A 145 -14.147 -11.514 -1.511 1.00 4.42 N ATOM 0 H ARG A 145 -14.838 -6.803 1.974 1.00 0.43 H new ATOM 0 HA ARG A 145 -12.193 -6.369 1.191 1.00 0.41 H new ATOM 0 HB2 ARG A 145 -14.605 -7.039 -0.011 1.00 0.44 H new ATOM 0 HB3 ARG A 145 -14.248 -5.469 -0.703 1.00 0.44 H new ATOM 0 HG2 ARG A 145 -13.239 -7.039 -2.165 1.00 0.81 H new ATOM 0 HG3 ARG A 145 -11.915 -6.353 -1.245 1.00 0.81 H new ATOM 0 HD2 ARG A 145 -11.455 -8.650 -1.167 1.00 2.08 H new ATOM 0 HD3 ARG A 145 -12.242 -8.364 0.373 1.00 2.08 H new ATOM 0 HE ARG A 145 -14.375 -9.052 -1.185 1.00 2.70 H new ATOM 0 HH11 ARG A 145 -11.212 -10.544 -0.674 1.00 4.14 H new ATOM 0 HH12 ARG A 145 -11.799 -12.170 -1.040 1.00 4.14 H new ATOM 0 HH21 ARG A 145 -15.086 -11.156 -1.687 1.00 4.42 H new ATOM 0 HH22 ARG A 145 -13.956 -12.512 -1.604 1.00 4.42 H new ATOM 2336 N GLY A 146 -11.830 -3.944 1.611 1.00 0.62 N ATOM 2337 CA GLY A 146 -11.536 -2.529 1.669 1.00 0.79 C ATOM 2338 C GLY A 146 -11.501 -1.908 0.293 1.00 0.57 C ATOM 2339 O GLY A 146 -10.681 -2.287 -0.541 1.00 0.62 O ATOM 0 H GLY A 146 -11.086 -4.549 1.958 1.00 0.62 H new ATOM 0 HA2 GLY A 146 -12.288 -2.026 2.276 1.00 0.79 H new ATOM 0 HA3 GLY A 146 -10.575 -2.377 2.161 1.00 0.79 H new ATOM 2343 N TYR A 147 -12.398 -0.966 0.038 1.00 0.58 N ATOM 2344 CA TYR A 147 -12.480 -0.362 -1.276 1.00 0.56 C ATOM 2345 C TYR A 147 -11.502 0.793 -1.392 1.00 0.54 C ATOM 2346 O TYR A 147 -11.851 1.954 -1.185 1.00 0.67 O ATOM 2347 CB TYR A 147 -13.905 0.098 -1.593 1.00 0.86 C ATOM 2348 CG TYR A 147 -14.132 0.385 -3.061 1.00 1.69 C ATOM 2349 CD1 TYR A 147 -14.400 -0.646 -3.950 1.00 2.19 C ATOM 2350 CD2 TYR A 147 -14.076 1.680 -3.557 1.00 2.23 C ATOM 2351 CE1 TYR A 147 -14.606 -0.396 -5.293 1.00 3.07 C ATOM 2352 CE2 TYR A 147 -14.280 1.939 -4.899 1.00 3.13 C ATOM 2353 CZ TYR A 147 -14.545 0.898 -5.763 1.00 3.51 C ATOM 2354 OH TYR A 147 -14.749 1.151 -7.102 1.00 4.44 O ATOM 0 H TYR A 147 -13.070 -0.609 0.717 1.00 0.58 H new ATOM 0 HA TYR A 147 -12.209 -1.121 -2.010 1.00 0.56 H new ATOM 0 HB2 TYR A 147 -14.607 -0.670 -1.268 1.00 0.86 H new ATOM 0 HB3 TYR A 147 -14.125 0.996 -1.017 1.00 0.86 H new ATOM 0 HD1 TYR A 147 -14.448 -1.662 -3.586 1.00 2.19 H new ATOM 0 HD2 TYR A 147 -13.870 2.499 -2.883 1.00 2.23 H new ATOM 0 HE1 TYR A 147 -14.814 -1.211 -5.971 1.00 3.07 H new ATOM 0 HE2 TYR A 147 -14.232 2.952 -5.269 1.00 3.13 H new ATOM 0 HH TYR A 147 -14.673 2.114 -7.268 1.00 4.44 H new ATOM 2364 N ASN A 148 -10.263 0.454 -1.686 1.00 0.46 N ATOM 2365 CA ASN A 148 -9.238 1.441 -1.959 1.00 0.47 C ATOM 2366 C ASN A 148 -9.504 2.104 -3.302 1.00 0.45 C ATOM 2367 O ASN A 148 -9.327 1.489 -4.356 1.00 0.58 O ATOM 2368 CB ASN A 148 -7.856 0.785 -1.970 1.00 0.49 C ATOM 2369 CG ASN A 148 -7.465 0.204 -0.625 1.00 1.08 C ATOM 2370 OD1 ASN A 148 -7.847 0.720 0.428 1.00 1.45 O ATOM 2371 ND2 ASN A 148 -6.711 -0.882 -0.650 1.00 1.62 N ATOM 0 H ASN A 148 -9.939 -0.511 -1.742 1.00 0.46 H new ATOM 0 HA ASN A 148 -9.262 2.196 -1.173 1.00 0.47 H new ATOM 0 HB2 ASN A 148 -7.842 -0.006 -2.719 1.00 0.49 H new ATOM 0 HB3 ASN A 148 -7.112 1.523 -2.271 1.00 0.49 H new ATOM 0 HD21 ASN A 148 -6.424 -1.324 0.223 1.00 1.62 H new ATOM 0 HD22 ASN A 148 -6.416 -1.278 -1.543 1.00 1.62 H new ATOM 2378 N HIS A 149 -9.968 3.344 -3.258 1.00 0.43 N ATOM 2379 CA HIS A 149 -10.148 4.136 -4.466 1.00 0.45 C ATOM 2380 C HIS A 149 -8.783 4.446 -5.040 1.00 0.40 C ATOM 2381 O HIS A 149 -7.931 4.939 -4.310 1.00 0.69 O ATOM 2382 CB HIS A 149 -10.854 5.452 -4.159 1.00 0.60 C ATOM 2383 CG HIS A 149 -12.284 5.318 -3.726 1.00 1.08 C ATOM 2384 ND1 HIS A 149 -13.342 5.764 -4.491 1.00 1.67 N ATOM 2385 CD2 HIS A 149 -12.832 4.810 -2.596 1.00 1.88 C ATOM 2386 CE1 HIS A 149 -14.473 5.537 -3.851 1.00 2.14 C ATOM 2387 NE2 HIS A 149 -14.194 4.958 -2.700 1.00 2.32 N ATOM 0 H HIS A 149 -10.227 3.825 -2.397 1.00 0.43 H new ATOM 0 HA HIS A 149 -10.757 3.569 -5.171 1.00 0.45 H new ATOM 0 HB2 HIS A 149 -10.300 5.970 -3.376 1.00 0.60 H new ATOM 0 HB3 HIS A 149 -10.817 6.083 -5.047 1.00 0.60 H new ATOM 0 HD2 HIS A 149 -12.297 4.370 -1.767 1.00 1.88 H new ATOM 0 HE1 HIS A 149 -15.461 5.784 -4.210 1.00 2.14 H new ATOM 0 HE2 HIS A 149 -14.878 4.667 -2.001 1.00 2.32 H new ATOM 2396 N PRO A 150 -8.615 4.214 -6.365 1.00 0.32 N ATOM 2397 CA PRO A 150 -7.344 4.226 -7.106 1.00 0.32 C ATOM 2398 C PRO A 150 -6.178 4.921 -6.414 1.00 0.36 C ATOM 2399 O PRO A 150 -5.714 5.977 -6.848 1.00 0.47 O ATOM 2400 CB PRO A 150 -7.750 4.977 -8.369 1.00 0.41 C ATOM 2401 CG PRO A 150 -9.212 4.675 -8.564 1.00 0.53 C ATOM 2402 CD PRO A 150 -9.702 3.975 -7.315 1.00 0.46 C ATOM 0 HA PRO A 150 -6.953 3.218 -7.245 1.00 0.32 H new ATOM 0 HB2 PRO A 150 -7.582 6.048 -8.260 1.00 0.41 H new ATOM 0 HB3 PRO A 150 -7.163 4.648 -9.227 1.00 0.41 H new ATOM 0 HG2 PRO A 150 -9.774 5.593 -8.734 1.00 0.53 H new ATOM 0 HG3 PRO A 150 -9.360 4.044 -9.440 1.00 0.53 H new ATOM 0 HD2 PRO A 150 -10.646 4.390 -6.962 1.00 0.46 H new ATOM 0 HD3 PRO A 150 -9.865 2.911 -7.485 1.00 0.46 H new ATOM 2410 N CYS A 151 -5.724 4.312 -5.339 1.00 0.38 N ATOM 2411 CA CYS A 151 -4.548 4.751 -4.634 1.00 0.48 C ATOM 2412 C CYS A 151 -3.374 3.886 -5.052 1.00 0.43 C ATOM 2413 O CYS A 151 -3.494 3.073 -5.965 1.00 0.77 O ATOM 2414 CB CYS A 151 -4.790 4.668 -3.128 1.00 0.84 C ATOM 2415 SG CYS A 151 -5.402 3.065 -2.563 1.00 1.58 S ATOM 0 H CYS A 151 -6.169 3.490 -4.929 1.00 0.38 H new ATOM 0 HA CYS A 151 -4.323 5.789 -4.880 1.00 0.48 H new ATOM 0 HB2 CYS A 151 -3.858 4.892 -2.609 1.00 0.84 H new ATOM 0 HB3 CYS A 151 -5.507 5.439 -2.844 1.00 0.84 H new ATOM 0 HG CYS A 151 -5.505 2.258 -3.577 1.00 1.58 H new ATOM 2421 N GLY A 152 -2.232 4.071 -4.427 1.00 0.34 N ATOM 2422 CA GLY A 152 -1.084 3.311 -4.830 1.00 0.39 C ATOM 2423 C GLY A 152 0.094 3.523 -3.930 1.00 0.36 C ATOM 2424 O GLY A 152 -0.055 3.866 -2.758 1.00 0.43 O ATOM 0 H GLY A 152 -2.081 4.724 -3.659 1.00 0.34 H new ATOM 0 HA2 GLY A 152 -1.341 2.252 -4.842 1.00 0.39 H new ATOM 0 HA3 GLY A 152 -0.811 3.585 -5.849 1.00 0.39 H new ATOM 2428 N PHE A 153 1.264 3.383 -4.501 1.00 0.32 N ATOM 2429 CA PHE A 153 2.475 3.230 -3.730 1.00 0.31 C ATOM 2430 C PHE A 153 3.641 3.530 -4.634 1.00 0.30 C ATOM 2431 O PHE A 153 4.110 2.655 -5.359 1.00 0.38 O ATOM 2432 CB PHE A 153 2.561 1.795 -3.191 1.00 0.36 C ATOM 2433 CG PHE A 153 3.703 1.531 -2.247 1.00 0.38 C ATOM 2434 CD1 PHE A 153 4.998 1.384 -2.718 1.00 0.49 C ATOM 2435 CD2 PHE A 153 3.473 1.406 -0.890 1.00 0.54 C ATOM 2436 CE1 PHE A 153 6.038 1.119 -1.852 1.00 0.55 C ATOM 2437 CE2 PHE A 153 4.511 1.144 -0.017 1.00 0.60 C ATOM 2438 CZ PHE A 153 5.794 0.998 -0.499 1.00 0.52 C ATOM 0 H PHE A 153 1.405 3.372 -5.511 1.00 0.32 H new ATOM 0 HA PHE A 153 2.484 3.913 -2.880 1.00 0.31 H new ATOM 0 HB2 PHE A 153 1.627 1.559 -2.681 1.00 0.36 H new ATOM 0 HB3 PHE A 153 2.644 1.111 -4.036 1.00 0.36 H new ATOM 0 HD1 PHE A 153 5.195 1.478 -3.776 1.00 0.49 H new ATOM 0 HD2 PHE A 153 2.469 1.515 -0.507 1.00 0.54 H new ATOM 0 HE1 PHE A 153 7.043 1.006 -2.232 1.00 0.55 H new ATOM 0 HE2 PHE A 153 4.317 1.054 1.042 1.00 0.60 H new ATOM 0 HZ PHE A 153 6.607 0.789 0.181 1.00 0.52 H new ATOM 2448 N VAL A 154 4.088 4.763 -4.638 1.00 0.25 N ATOM 2449 CA VAL A 154 5.157 5.129 -5.522 1.00 0.25 C ATOM 2450 C VAL A 154 6.475 5.199 -4.768 1.00 0.24 C ATOM 2451 O VAL A 154 6.564 5.728 -3.661 1.00 0.31 O ATOM 2452 CB VAL A 154 4.895 6.451 -6.277 1.00 0.25 C ATOM 2453 CG1 VAL A 154 3.527 6.470 -6.937 1.00 0.27 C ATOM 2454 CG2 VAL A 154 5.064 7.668 -5.394 1.00 0.26 C ATOM 0 H VAL A 154 3.732 5.515 -4.048 1.00 0.25 H new ATOM 0 HA VAL A 154 5.215 4.345 -6.277 1.00 0.25 H new ATOM 0 HB VAL A 154 5.654 6.499 -7.058 1.00 0.25 H new ATOM 0 HG11 VAL A 154 3.387 7.418 -7.456 1.00 0.27 H new ATOM 0 HG12 VAL A 154 3.457 5.651 -7.653 1.00 0.27 H new ATOM 0 HG13 VAL A 154 2.755 6.355 -6.177 1.00 0.27 H new ATOM 0 HG21 VAL A 154 4.868 8.569 -5.975 1.00 0.26 H new ATOM 0 HG22 VAL A 154 4.363 7.614 -4.561 1.00 0.26 H new ATOM 0 HG23 VAL A 154 6.083 7.699 -5.009 1.00 0.26 H new ATOM 2464 N CYS A 155 7.483 4.613 -5.360 1.00 0.21 N ATOM 2465 CA CYS A 155 8.815 4.638 -4.791 1.00 0.23 C ATOM 2466 C CYS A 155 9.730 5.453 -5.687 1.00 0.27 C ATOM 2467 O CYS A 155 9.871 5.158 -6.869 1.00 0.42 O ATOM 2468 CB CYS A 155 9.332 3.213 -4.623 1.00 0.27 C ATOM 2469 SG CYS A 155 11.097 3.093 -4.270 1.00 1.55 S ATOM 0 H CYS A 155 7.410 4.108 -6.243 1.00 0.21 H new ATOM 0 HA CYS A 155 8.790 5.106 -3.807 1.00 0.23 H new ATOM 0 HB2 CYS A 155 8.780 2.733 -3.815 1.00 0.27 H new ATOM 0 HB3 CYS A 155 9.118 2.653 -5.533 1.00 0.27 H new ATOM 0 HG CYS A 155 11.518 4.218 -3.774 1.00 1.55 H new ATOM 2475 N SER A 156 10.340 6.483 -5.134 1.00 0.25 N ATOM 2476 CA SER A 156 11.079 7.433 -5.951 1.00 0.29 C ATOM 2477 C SER A 156 12.558 7.463 -5.594 1.00 0.30 C ATOM 2478 O SER A 156 12.925 7.827 -4.483 1.00 0.29 O ATOM 2479 CB SER A 156 10.476 8.830 -5.794 1.00 0.32 C ATOM 2480 OG SER A 156 9.088 8.823 -6.084 1.00 1.06 O ATOM 0 H SER A 156 10.341 6.685 -4.134 1.00 0.25 H new ATOM 0 HA SER A 156 10.999 7.110 -6.989 1.00 0.29 H new ATOM 0 HB2 SER A 156 10.636 9.186 -4.776 1.00 0.32 H new ATOM 0 HB3 SER A 156 10.986 9.526 -6.459 1.00 0.32 H new ATOM 0 HG SER A 156 8.949 9.066 -7.023 1.00 1.06 H new ATOM 2486 N PRO A 157 13.428 7.050 -6.528 1.00 0.36 N ATOM 2487 CA PRO A 157 14.878 7.198 -6.377 1.00 0.39 C ATOM 2488 C PRO A 157 15.258 8.623 -5.981 1.00 0.40 C ATOM 2489 O PRO A 157 14.936 9.579 -6.688 1.00 0.49 O ATOM 2490 CB PRO A 157 15.405 6.871 -7.775 1.00 0.51 C ATOM 2491 CG PRO A 157 14.395 5.939 -8.346 1.00 0.56 C ATOM 2492 CD PRO A 157 13.066 6.371 -7.785 1.00 0.45 C ATOM 0 HA PRO A 157 15.287 6.559 -5.594 1.00 0.39 H new ATOM 0 HB2 PRO A 157 15.503 7.771 -8.383 1.00 0.51 H new ATOM 0 HB3 PRO A 157 16.391 6.408 -7.729 1.00 0.51 H new ATOM 0 HG2 PRO A 157 14.393 5.986 -9.435 1.00 0.56 H new ATOM 0 HG3 PRO A 157 14.617 4.908 -8.072 1.00 0.56 H new ATOM 0 HD2 PRO A 157 12.541 7.041 -8.466 1.00 0.45 H new ATOM 0 HD3 PRO A 157 12.410 5.519 -7.607 1.00 0.45 H new ATOM 2500 N MET A 158 15.934 8.758 -4.848 1.00 0.37 N ATOM 2501 CA MET A 158 16.231 10.077 -4.298 1.00 0.43 C ATOM 2502 C MET A 158 17.411 10.733 -4.985 1.00 0.48 C ATOM 2503 O MET A 158 17.882 10.269 -6.024 1.00 0.49 O ATOM 2504 CB MET A 158 16.547 9.985 -2.811 1.00 0.43 C ATOM 2505 CG MET A 158 15.440 10.490 -1.918 1.00 0.50 C ATOM 2506 SD MET A 158 15.037 12.215 -2.245 1.00 0.95 S ATOM 2507 CE MET A 158 13.761 12.506 -1.026 1.00 1.16 C ATOM 0 H MET A 158 16.286 7.977 -4.294 1.00 0.37 H new ATOM 0 HA MET A 158 15.339 10.682 -4.464 1.00 0.43 H new ATOM 0 HB2 MET A 158 16.759 8.946 -2.558 1.00 0.43 H new ATOM 0 HB3 MET A 158 17.454 10.554 -2.606 1.00 0.43 H new ATOM 0 HG2 MET A 158 14.550 9.877 -2.063 1.00 0.50 H new ATOM 0 HG3 MET A 158 15.737 10.379 -0.875 1.00 0.50 H new ATOM 0 HE1 MET A 158 12.896 12.962 -1.507 1.00 1.16 H new ATOM 0 HE2 MET A 158 13.467 11.559 -0.574 1.00 1.16 H new ATOM 0 HE3 MET A 158 14.141 13.174 -0.254 1.00 1.16 H new ATOM 2517 N GLU A 159 17.893 11.808 -4.377 1.00 0.57 N ATOM 2518 CA GLU A 159 19.110 12.456 -4.822 1.00 0.62 C ATOM 2519 C GLU A 159 20.273 11.483 -4.646 1.00 0.54 C ATOM 2520 O GLU A 159 21.237 11.475 -5.413 1.00 0.59 O ATOM 2521 CB GLU A 159 19.367 13.719 -3.996 1.00 0.76 C ATOM 2522 CG GLU A 159 18.122 14.553 -3.723 1.00 1.38 C ATOM 2523 CD GLU A 159 17.568 15.234 -4.959 1.00 1.87 C ATOM 2524 OE1 GLU A 159 18.107 16.287 -5.362 1.00 2.63 O ATOM 2525 OE2 GLU A 159 16.616 14.693 -5.558 1.00 2.09 O ATOM 0 H GLU A 159 17.453 12.249 -3.569 1.00 0.57 H new ATOM 0 HA GLU A 159 19.012 12.739 -5.870 1.00 0.62 H new ATOM 0 HB2 GLU A 159 19.814 13.432 -3.044 1.00 0.76 H new ATOM 0 HB3 GLU A 159 20.097 14.338 -4.517 1.00 0.76 H new ATOM 0 HG2 GLU A 159 17.351 13.912 -3.295 1.00 1.38 H new ATOM 0 HG3 GLU A 159 18.358 15.310 -2.976 1.00 1.38 H new ATOM 2532 N GLU A 160 20.134 10.636 -3.636 1.00 0.52 N ATOM 2533 CA GLU A 160 21.131 9.630 -3.305 1.00 0.55 C ATOM 2534 C GLU A 160 20.652 8.273 -3.789 1.00 0.58 C ATOM 2535 O GLU A 160 21.000 7.255 -3.214 1.00 0.76 O ATOM 2536 CB GLU A 160 21.341 9.581 -1.795 1.00 0.63 C ATOM 2537 CG GLU A 160 21.723 10.915 -1.177 1.00 0.77 C ATOM 2538 CD GLU A 160 23.095 11.395 -1.603 1.00 1.32 C ATOM 2539 OE1 GLU A 160 24.093 10.989 -0.973 1.00 1.61 O ATOM 2540 OE2 GLU A 160 23.182 12.203 -2.548 1.00 2.05 O ATOM 0 H GLU A 160 19.321 10.628 -3.020 1.00 0.52 H new ATOM 0 HA GLU A 160 22.073 9.886 -3.789 1.00 0.55 H new ATOM 0 HB2 GLU A 160 20.426 9.223 -1.323 1.00 0.63 H new ATOM 0 HB3 GLU A 160 22.121 8.853 -1.571 1.00 0.63 H new ATOM 0 HG2 GLU A 160 20.980 11.663 -1.454 1.00 0.77 H new ATOM 0 HG3 GLU A 160 21.696 10.827 -0.091 1.00 0.77 H new ATOM 2547 N ASN A 161 19.818 8.323 -4.828 1.00 0.51 N ATOM 2548 CA ASN A 161 19.155 7.169 -5.473 1.00 0.65 C ATOM 2549 C ASN A 161 19.392 5.798 -4.787 1.00 0.53 C ATOM 2550 O ASN A 161 18.501 5.317 -4.091 1.00 0.53 O ATOM 2551 CB ASN A 161 19.507 7.131 -6.977 1.00 0.92 C ATOM 2552 CG ASN A 161 18.752 6.065 -7.768 1.00 1.07 C ATOM 2553 OD1 ASN A 161 18.390 5.008 -7.253 1.00 1.93 O ATOM 2554 ND2 ASN A 161 18.505 6.341 -9.038 1.00 1.62 N ATOM 0 H ASN A 161 19.569 9.208 -5.270 1.00 0.51 H new ATOM 0 HA ASN A 161 18.085 7.334 -5.350 1.00 0.65 H new ATOM 0 HB2 ASN A 161 19.297 8.108 -7.413 1.00 0.92 H new ATOM 0 HB3 ASN A 161 20.578 6.957 -7.084 1.00 0.92 H new ATOM 0 HD21 ASN A 161 18.002 5.669 -9.617 1.00 1.62 H new ATOM 0 HD22 ASN A 161 18.817 7.226 -9.438 1.00 1.62 H new ATOM 2561 N PRO A 162 20.561 5.129 -4.961 1.00 0.55 N ATOM 2562 CA PRO A 162 20.745 3.765 -4.450 1.00 0.57 C ATOM 2563 C PRO A 162 20.914 3.689 -2.927 1.00 0.55 C ATOM 2564 O PRO A 162 20.845 2.610 -2.339 1.00 0.63 O ATOM 2565 CB PRO A 162 22.028 3.304 -5.140 1.00 0.71 C ATOM 2566 CG PRO A 162 22.798 4.556 -5.344 1.00 0.73 C ATOM 2567 CD PRO A 162 21.770 5.602 -5.666 1.00 0.67 C ATOM 0 HA PRO A 162 19.868 3.151 -4.655 1.00 0.57 H new ATOM 0 HB2 PRO A 162 22.579 2.593 -4.524 1.00 0.71 H new ATOM 0 HB3 PRO A 162 21.815 2.808 -6.087 1.00 0.71 H new ATOM 0 HG2 PRO A 162 23.363 4.821 -4.450 1.00 0.73 H new ATOM 0 HG3 PRO A 162 23.518 4.448 -6.156 1.00 0.73 H new ATOM 0 HD2 PRO A 162 22.078 6.588 -5.317 1.00 0.67 H new ATOM 0 HD3 PRO A 162 21.602 5.682 -6.740 1.00 0.67 H new ATOM 2575 N ALA A 163 21.147 4.832 -2.300 1.00 0.53 N ATOM 2576 CA ALA A 163 21.401 4.889 -0.867 1.00 0.59 C ATOM 2577 C ALA A 163 20.196 5.441 -0.112 1.00 0.53 C ATOM 2578 O ALA A 163 20.006 5.142 1.064 1.00 0.58 O ATOM 2579 CB ALA A 163 22.635 5.734 -0.581 1.00 0.68 C ATOM 0 H ALA A 163 21.166 5.740 -2.765 1.00 0.53 H new ATOM 0 HA ALA A 163 21.579 3.872 -0.518 1.00 0.59 H new ATOM 0 HB1 ALA A 163 22.812 5.767 0.494 1.00 0.68 H new ATOM 0 HB2 ALA A 163 23.500 5.295 -1.078 1.00 0.68 H new ATOM 0 HB3 ALA A 163 22.478 6.746 -0.954 1.00 0.68 H new ATOM 2585 N TYR A 164 19.399 6.260 -0.787 1.00 0.45 N ATOM 2586 CA TYR A 164 18.180 6.800 -0.207 1.00 0.40 C ATOM 2587 C TYR A 164 17.067 6.755 -1.235 1.00 0.32 C ATOM 2588 O TYR A 164 17.266 7.149 -2.383 1.00 0.38 O ATOM 2589 CB TYR A 164 18.375 8.250 0.250 1.00 0.46 C ATOM 2590 CG TYR A 164 19.178 8.412 1.523 1.00 0.56 C ATOM 2591 CD1 TYR A 164 18.556 8.363 2.765 1.00 0.61 C ATOM 2592 CD2 TYR A 164 20.550 8.629 1.486 1.00 0.67 C ATOM 2593 CE1 TYR A 164 19.278 8.524 3.931 1.00 0.73 C ATOM 2594 CE2 TYR A 164 21.277 8.794 2.648 1.00 0.78 C ATOM 2595 CZ TYR A 164 20.636 8.740 3.868 1.00 0.79 C ATOM 2596 OH TYR A 164 21.353 8.911 5.027 1.00 0.93 O ATOM 0 H TYR A 164 19.579 6.565 -1.743 1.00 0.45 H new ATOM 0 HA TYR A 164 17.922 6.193 0.661 1.00 0.40 H new ATOM 0 HB2 TYR A 164 18.869 8.804 -0.548 1.00 0.46 H new ATOM 0 HB3 TYR A 164 17.395 8.705 0.395 1.00 0.46 H new ATOM 0 HD1 TYR A 164 17.490 8.196 2.819 1.00 0.61 H new ATOM 0 HD2 TYR A 164 21.056 8.669 0.533 1.00 0.67 H new ATOM 0 HE1 TYR A 164 18.779 8.481 4.888 1.00 0.73 H new ATOM 0 HE2 TYR A 164 22.342 8.965 2.602 1.00 0.78 H new ATOM 0 HH TYR A 164 22.298 9.052 4.809 1.00 0.93 H new ATOM 2606 N SER A 165 15.904 6.281 -0.842 1.00 0.26 N ATOM 2607 CA SER A 165 14.778 6.263 -1.748 1.00 0.24 C ATOM 2608 C SER A 165 13.553 6.891 -1.103 1.00 0.23 C ATOM 2609 O SER A 165 13.358 6.810 0.110 1.00 0.26 O ATOM 2610 CB SER A 165 14.473 4.840 -2.197 1.00 0.30 C ATOM 2611 OG SER A 165 13.434 4.823 -3.162 1.00 1.41 O ATOM 0 H SER A 165 15.715 5.907 0.088 1.00 0.26 H new ATOM 0 HA SER A 165 15.041 6.853 -2.626 1.00 0.24 H new ATOM 0 HB2 SER A 165 15.371 4.387 -2.617 1.00 0.30 H new ATOM 0 HB3 SER A 165 14.184 4.237 -1.336 1.00 0.30 H new ATOM 0 HG SER A 165 13.365 5.705 -3.584 1.00 1.41 H new ATOM 2617 N LYS A 166 12.741 7.525 -1.928 1.00 0.24 N ATOM 2618 CA LYS A 166 11.555 8.209 -1.472 1.00 0.26 C ATOM 2619 C LYS A 166 10.334 7.305 -1.566 1.00 0.28 C ATOM 2620 O LYS A 166 9.787 7.061 -2.634 1.00 0.43 O ATOM 2621 CB LYS A 166 11.364 9.519 -2.259 1.00 0.36 C ATOM 2622 CG LYS A 166 9.993 10.166 -2.099 1.00 0.32 C ATOM 2623 CD LYS A 166 9.538 10.207 -0.648 1.00 0.37 C ATOM 2624 CE LYS A 166 10.446 11.059 0.226 1.00 0.47 C ATOM 2625 NZ LYS A 166 10.414 12.498 -0.153 1.00 0.74 N ATOM 0 H LYS A 166 12.890 7.578 -2.936 1.00 0.24 H new ATOM 0 HA LYS A 166 11.678 8.466 -0.420 1.00 0.26 H new ATOM 0 HB2 LYS A 166 12.126 10.231 -1.942 1.00 0.36 H new ATOM 0 HB3 LYS A 166 11.535 9.319 -3.317 1.00 0.36 H new ATOM 0 HG2 LYS A 166 10.024 11.181 -2.496 1.00 0.32 H new ATOM 0 HG3 LYS A 166 9.262 9.614 -2.691 1.00 0.32 H new ATOM 0 HD2 LYS A 166 8.522 10.599 -0.601 1.00 0.37 H new ATOM 0 HD3 LYS A 166 9.507 9.192 -0.252 1.00 0.37 H new ATOM 0 HE2 LYS A 166 10.145 10.954 1.268 1.00 0.47 H new ATOM 0 HE3 LYS A 166 11.469 10.689 0.151 1.00 0.47 H new ATOM 0 HZ1 LYS A 166 11.009 13.043 0.503 1.00 0.74 H new ATOM 0 HZ2 LYS A 166 10.775 12.610 -1.122 1.00 0.74 H new ATOM 0 HZ3 LYS A 166 9.436 12.848 -0.105 1.00 0.74 H new ATOM 2639 N LEU A 167 9.937 6.809 -0.415 1.00 0.20 N ATOM 2640 CA LEU A 167 8.765 5.969 -0.273 1.00 0.21 C ATOM 2641 C LEU A 167 7.532 6.846 -0.067 1.00 0.20 C ATOM 2642 O LEU A 167 7.331 7.391 1.020 1.00 0.24 O ATOM 2643 CB LEU A 167 8.972 5.059 0.943 1.00 0.23 C ATOM 2644 CG LEU A 167 8.215 3.731 0.944 1.00 0.24 C ATOM 2645 CD1 LEU A 167 6.715 3.948 0.947 1.00 0.27 C ATOM 2646 CD2 LEU A 167 8.647 2.888 -0.247 1.00 0.25 C ATOM 0 H LEU A 167 10.426 6.980 0.464 1.00 0.20 H new ATOM 0 HA LEU A 167 8.618 5.365 -1.168 1.00 0.21 H new ATOM 0 HB2 LEU A 167 10.037 4.844 1.029 1.00 0.23 H new ATOM 0 HB3 LEU A 167 8.686 5.614 1.836 1.00 0.23 H new ATOM 0 HG LEU A 167 8.462 3.194 1.860 1.00 0.24 H new ATOM 0 HD11 LEU A 167 6.208 2.983 0.948 1.00 0.27 H new ATOM 0 HD12 LEU A 167 6.430 4.508 1.838 1.00 0.27 H new ATOM 0 HD13 LEU A 167 6.427 4.509 0.058 1.00 0.27 H new ATOM 0 HD21 LEU A 167 8.104 1.943 -0.240 1.00 0.25 H new ATOM 0 HD22 LEU A 167 8.430 3.425 -1.171 1.00 0.25 H new ATOM 0 HD23 LEU A 167 9.717 2.692 -0.185 1.00 0.25 H new ATOM 2658 N VAL A 168 6.720 7.008 -1.103 1.00 0.19 N ATOM 2659 CA VAL A 168 5.499 7.805 -0.980 1.00 0.20 C ATOM 2660 C VAL A 168 4.265 7.005 -1.413 1.00 0.23 C ATOM 2661 O VAL A 168 4.125 6.602 -2.567 1.00 0.28 O ATOM 2662 CB VAL A 168 5.622 9.158 -1.744 1.00 0.20 C ATOM 2663 CG1 VAL A 168 6.669 9.072 -2.842 1.00 0.21 C ATOM 2664 CG2 VAL A 168 4.287 9.622 -2.318 1.00 0.26 C ATOM 0 H VAL A 168 6.878 6.606 -2.027 1.00 0.19 H new ATOM 0 HA VAL A 168 5.366 8.049 0.074 1.00 0.20 H new ATOM 0 HB VAL A 168 5.940 9.902 -1.014 1.00 0.20 H new ATOM 0 HG11 VAL A 168 6.734 10.030 -3.359 1.00 0.21 H new ATOM 0 HG12 VAL A 168 7.637 8.830 -2.403 1.00 0.21 H new ATOM 0 HG13 VAL A 168 6.388 8.295 -3.553 1.00 0.21 H new ATOM 0 HG21 VAL A 168 4.425 10.569 -2.841 1.00 0.26 H new ATOM 0 HG22 VAL A 168 3.911 8.874 -3.016 1.00 0.26 H new ATOM 0 HG23 VAL A 168 3.570 9.756 -1.508 1.00 0.26 H new ATOM 2674 N MET A 169 3.372 6.779 -0.460 1.00 0.29 N ATOM 2675 CA MET A 169 2.197 5.955 -0.669 1.00 0.32 C ATOM 2676 C MET A 169 0.940 6.761 -0.380 1.00 0.34 C ATOM 2677 O MET A 169 0.931 7.617 0.504 1.00 0.45 O ATOM 2678 CB MET A 169 2.256 4.719 0.240 1.00 0.35 C ATOM 2679 CG MET A 169 0.997 3.860 0.213 1.00 0.40 C ATOM 2680 SD MET A 169 1.107 2.425 1.300 1.00 0.74 S ATOM 2681 CE MET A 169 1.411 3.215 2.876 1.00 1.24 C ATOM 0 H MET A 169 3.445 7.164 0.482 1.00 0.29 H new ATOM 0 HA MET A 169 2.172 5.626 -1.708 1.00 0.32 H new ATOM 0 HB2 MET A 169 3.107 4.105 -0.056 1.00 0.35 H new ATOM 0 HB3 MET A 169 2.438 5.044 1.264 1.00 0.35 H new ATOM 0 HG2 MET A 169 0.141 4.468 0.507 1.00 0.40 H new ATOM 0 HG3 MET A 169 0.814 3.524 -0.808 1.00 0.40 H new ATOM 0 HE1 MET A 169 0.832 2.714 3.652 1.00 1.24 H new ATOM 0 HE2 MET A 169 2.472 3.150 3.117 1.00 1.24 H new ATOM 0 HE3 MET A 169 1.115 4.263 2.821 1.00 1.24 H new ATOM 2691 N PHE A 170 -0.110 6.483 -1.128 1.00 0.36 N ATOM 2692 CA PHE A 170 -1.380 7.172 -0.961 1.00 0.42 C ATOM 2693 C PHE A 170 -2.441 6.168 -0.599 1.00 0.37 C ATOM 2694 O PHE A 170 -2.528 5.105 -1.219 1.00 0.38 O ATOM 2695 CB PHE A 170 -1.821 7.888 -2.238 1.00 0.69 C ATOM 2696 CG PHE A 170 -0.818 8.857 -2.783 1.00 1.26 C ATOM 2697 CD1 PHE A 170 0.306 8.408 -3.456 1.00 1.74 C ATOM 2698 CD2 PHE A 170 -1.005 10.217 -2.627 1.00 2.02 C ATOM 2699 CE1 PHE A 170 1.227 9.300 -3.961 1.00 2.73 C ATOM 2700 CE2 PHE A 170 -0.086 11.114 -3.129 1.00 3.07 C ATOM 2701 CZ PHE A 170 1.031 10.654 -3.795 1.00 3.37 C ATOM 0 H PHE A 170 -0.110 5.778 -1.865 1.00 0.36 H new ATOM 0 HA PHE A 170 -1.247 7.916 -0.176 1.00 0.42 H new ATOM 0 HB2 PHE A 170 -2.039 7.141 -3.002 1.00 0.69 H new ATOM 0 HB3 PHE A 170 -2.751 8.420 -2.039 1.00 0.69 H new ATOM 0 HD1 PHE A 170 0.462 7.347 -3.586 1.00 1.74 H new ATOM 0 HD2 PHE A 170 -1.879 10.581 -2.107 1.00 2.02 H new ATOM 0 HE1 PHE A 170 2.100 8.939 -4.485 1.00 2.73 H new ATOM 0 HE2 PHE A 170 -0.240 12.175 -3.001 1.00 3.07 H new ATOM 0 HZ PHE A 170 1.753 11.356 -4.187 1.00 3.37 H new ATOM 2711 N VAL A 171 -3.249 6.503 0.383 1.00 0.43 N ATOM 2712 CA VAL A 171 -4.320 5.631 0.785 1.00 0.50 C ATOM 2713 C VAL A 171 -5.662 6.360 0.637 1.00 0.49 C ATOM 2714 O VAL A 171 -5.887 7.421 1.221 1.00 0.50 O ATOM 2715 CB VAL A 171 -4.083 5.097 2.223 1.00 0.66 C ATOM 2716 CG1 VAL A 171 -4.495 6.091 3.299 1.00 1.28 C ATOM 2717 CG2 VAL A 171 -4.768 3.761 2.412 1.00 1.40 C ATOM 0 H VAL A 171 -3.182 7.371 0.914 1.00 0.43 H new ATOM 0 HA VAL A 171 -4.347 4.758 0.133 1.00 0.50 H new ATOM 0 HB VAL A 171 -3.008 4.957 2.339 1.00 0.66 H new ATOM 0 HG11 VAL A 171 -4.306 5.662 4.283 1.00 1.28 H new ATOM 0 HG12 VAL A 171 -3.918 7.009 3.187 1.00 1.28 H new ATOM 0 HG13 VAL A 171 -5.557 6.316 3.199 1.00 1.28 H new ATOM 0 HG21 VAL A 171 -4.591 3.402 3.426 1.00 1.40 H new ATOM 0 HG22 VAL A 171 -5.840 3.875 2.249 1.00 1.40 H new ATOM 0 HG23 VAL A 171 -4.367 3.042 1.697 1.00 1.40 H new ATOM 2727 N GLN A 172 -6.526 5.812 -0.204 1.00 0.57 N ATOM 2728 CA GLN A 172 -7.812 6.427 -0.495 1.00 0.65 C ATOM 2729 C GLN A 172 -8.892 5.393 -0.262 1.00 0.65 C ATOM 2730 O GLN A 172 -9.743 5.114 -1.111 1.00 0.95 O ATOM 2731 CB GLN A 172 -7.850 6.956 -1.930 1.00 0.80 C ATOM 2732 CG GLN A 172 -9.038 7.866 -2.215 1.00 1.01 C ATOM 2733 CD GLN A 172 -8.985 8.482 -3.601 1.00 1.54 C ATOM 2734 OE1 GLN A 172 -9.482 9.585 -3.819 1.00 2.17 O ATOM 2735 NE2 GLN A 172 -8.385 7.776 -4.549 1.00 2.15 N ATOM 0 H GLN A 172 -6.358 4.937 -0.700 1.00 0.57 H new ATOM 0 HA GLN A 172 -7.975 7.282 0.162 1.00 0.65 H new ATOM 0 HB2 GLN A 172 -6.928 7.502 -2.131 1.00 0.80 H new ATOM 0 HB3 GLN A 172 -7.877 6.112 -2.619 1.00 0.80 H new ATOM 0 HG2 GLN A 172 -9.961 7.295 -2.111 1.00 1.01 H new ATOM 0 HG3 GLN A 172 -9.069 8.661 -1.470 1.00 1.01 H new ATOM 0 HE21 GLN A 172 -7.984 6.864 -4.329 1.00 2.15 H new ATOM 0 HE22 GLN A 172 -8.324 8.145 -5.498 1.00 2.15 H new ATOM 2744 N THR A 173 -8.813 4.808 0.906 1.00 0.59 N ATOM 2745 CA THR A 173 -9.672 3.703 1.278 1.00 0.66 C ATOM 2746 C THR A 173 -11.096 4.188 1.538 1.00 0.75 C ATOM 2747 O THR A 173 -11.313 5.332 1.936 1.00 1.01 O ATOM 2748 CB THR A 173 -9.114 2.993 2.526 1.00 0.93 C ATOM 2749 OG1 THR A 173 -7.712 2.761 2.355 1.00 1.65 O ATOM 2750 CG2 THR A 173 -9.805 1.662 2.754 1.00 1.12 C ATOM 0 H THR A 173 -8.150 5.083 1.631 1.00 0.59 H new ATOM 0 HA THR A 173 -9.698 2.994 0.450 1.00 0.66 H new ATOM 0 HB THR A 173 -9.293 3.634 3.389 1.00 0.93 H new ATOM 0 HG1 THR A 173 -7.576 2.051 1.693 1.00 1.65 H new ATOM 0 HG21 THR A 173 -9.390 1.184 3.642 1.00 1.12 H new ATOM 0 HG22 THR A 173 -10.873 1.826 2.896 1.00 1.12 H new ATOM 0 HG23 THR A 173 -9.649 1.018 1.889 1.00 1.12 H new ATOM 2758 N GLU A 174 -12.065 3.309 1.297 1.00 0.69 N ATOM 2759 CA GLU A 174 -13.470 3.661 1.446 1.00 0.87 C ATOM 2760 C GLU A 174 -13.911 3.556 2.899 1.00 0.99 C ATOM 2761 O GLU A 174 -14.929 4.117 3.298 1.00 1.32 O ATOM 2762 CB GLU A 174 -14.319 2.741 0.575 1.00 0.97 C ATOM 2763 CG GLU A 174 -15.799 3.022 0.662 1.00 1.10 C ATOM 2764 CD GLU A 174 -16.474 2.899 -0.684 1.00 1.80 C ATOM 2765 OE1 GLU A 174 -16.217 3.755 -1.553 1.00 2.30 O ATOM 2766 OE2 GLU A 174 -17.238 1.937 -0.892 1.00 2.45 O ATOM 0 H GLU A 174 -11.901 2.348 0.998 1.00 0.69 H new ATOM 0 HA GLU A 174 -13.604 4.695 1.128 1.00 0.87 H new ATOM 0 HB2 GLU A 174 -13.999 2.840 -0.462 1.00 0.97 H new ATOM 0 HB3 GLU A 174 -14.136 1.707 0.868 1.00 0.97 H new ATOM 0 HG2 GLU A 174 -16.260 2.328 1.364 1.00 1.10 H new ATOM 0 HG3 GLU A 174 -15.956 4.026 1.057 1.00 1.10 H new ATOM 2898 N ILE A 183 -11.163 6.406 15.048 1.00 1.04 N ATOM 2899 CA ILE A 183 -10.594 5.071 14.862 1.00 0.90 C ATOM 2900 C ILE A 183 -9.771 5.077 13.601 1.00 0.79 C ATOM 2901 O ILE A 183 -8.748 4.424 13.480 1.00 0.69 O ATOM 2902 CB ILE A 183 -11.689 4.008 14.675 1.00 0.96 C ATOM 2903 CG1 ILE A 183 -12.790 4.173 15.717 1.00 1.09 C ATOM 2904 CG2 ILE A 183 -11.095 2.608 14.733 1.00 0.92 C ATOM 2905 CD1 ILE A 183 -12.313 4.005 17.143 1.00 1.12 C ATOM 0 HA ILE A 183 -10.004 4.832 15.747 1.00 0.90 H new ATOM 0 HB ILE A 183 -12.134 4.149 13.690 1.00 0.96 H new ATOM 0 HG12 ILE A 183 -13.236 5.162 15.607 1.00 1.09 H new ATOM 0 HG13 ILE A 183 -13.577 3.445 15.519 1.00 1.09 H new ATOM 0 HG21 ILE A 183 -11.887 1.871 14.599 1.00 0.92 H new ATOM 0 HG22 ILE A 183 -10.355 2.494 13.941 1.00 0.92 H new ATOM 0 HG23 ILE A 183 -10.618 2.455 15.701 1.00 0.92 H new ATOM 0 HD11 ILE A 183 -13.153 4.137 17.825 1.00 1.12 H new ATOM 0 HD12 ILE A 183 -11.894 3.007 17.271 1.00 1.12 H new ATOM 0 HD13 ILE A 183 -11.548 4.750 17.361 1.00 1.12 H new ATOM 2917 N ILE A 184 -10.286 5.831 12.670 1.00 0.87 N ATOM 2918 CA ILE A 184 -9.707 6.026 11.376 1.00 0.83 C ATOM 2919 C ILE A 184 -8.416 6.824 11.493 1.00 0.81 C ATOM 2920 O ILE A 184 -7.471 6.623 10.730 1.00 0.75 O ATOM 2921 CB ILE A 184 -10.725 6.731 10.458 1.00 0.96 C ATOM 2922 CG1 ILE A 184 -11.636 5.707 9.788 1.00 0.98 C ATOM 2923 CG2 ILE A 184 -10.050 7.609 9.410 1.00 1.00 C ATOM 2924 CD1 ILE A 184 -12.998 5.611 10.428 1.00 1.13 C ATOM 0 H ILE A 184 -11.157 6.346 12.801 1.00 0.87 H new ATOM 0 HA ILE A 184 -9.459 5.060 10.935 1.00 0.83 H new ATOM 0 HB ILE A 184 -11.326 7.387 11.088 1.00 0.96 H new ATOM 0 HG12 ILE A 184 -11.754 5.969 8.737 1.00 0.98 H new ATOM 0 HG13 ILE A 184 -11.157 4.728 9.821 1.00 0.98 H new ATOM 0 HG21 ILE A 184 -10.810 8.083 8.789 1.00 1.00 H new ATOM 0 HG22 ILE A 184 -9.456 8.376 9.906 1.00 1.00 H new ATOM 0 HG23 ILE A 184 -9.401 6.996 8.785 1.00 1.00 H new ATOM 0 HD11 ILE A 184 -13.595 4.865 9.903 1.00 1.13 H new ATOM 0 HD12 ILE A 184 -12.889 5.319 11.473 1.00 1.13 H new ATOM 0 HD13 ILE A 184 -13.496 6.579 10.371 1.00 1.13 H new ATOM 2936 N GLU A 185 -8.391 7.719 12.468 1.00 0.91 N ATOM 2937 CA GLU A 185 -7.158 8.373 12.886 1.00 0.99 C ATOM 2938 C GLU A 185 -6.114 7.314 13.208 1.00 0.91 C ATOM 2939 O GLU A 185 -4.919 7.500 12.999 1.00 0.99 O ATOM 2940 CB GLU A 185 -7.413 9.213 14.136 1.00 1.17 C ATOM 2941 CG GLU A 185 -8.326 10.404 13.913 1.00 1.58 C ATOM 2942 CD GLU A 185 -7.584 11.609 13.388 1.00 2.26 C ATOM 2943 OE1 GLU A 185 -6.893 12.271 14.188 1.00 2.46 O ATOM 2944 OE2 GLU A 185 -7.700 11.914 12.186 1.00 2.89 O ATOM 0 H GLU A 185 -9.217 8.012 12.989 1.00 0.91 H new ATOM 0 HA GLU A 185 -6.804 9.017 12.081 1.00 0.99 H new ATOM 0 HB2 GLU A 185 -7.849 8.575 14.905 1.00 1.17 H new ATOM 0 HB3 GLU A 185 -6.458 9.570 14.521 1.00 1.17 H new ATOM 0 HG2 GLU A 185 -9.111 10.129 13.209 1.00 1.58 H new ATOM 0 HG3 GLU A 185 -8.816 10.663 14.852 1.00 1.58 H new ATOM 2951 N LYS A 186 -6.595 6.205 13.741 1.00 0.82 N ATOM 2952 CA LYS A 186 -5.749 5.094 14.115 1.00 0.79 C ATOM 2953 C LYS A 186 -5.635 4.061 12.994 1.00 0.70 C ATOM 2954 O LYS A 186 -4.802 3.162 13.064 1.00 0.86 O ATOM 2955 CB LYS A 186 -6.287 4.466 15.398 1.00 0.80 C ATOM 2956 CG LYS A 186 -6.450 5.493 16.502 1.00 1.27 C ATOM 2957 CD LYS A 186 -6.962 4.884 17.795 1.00 1.28 C ATOM 2958 CE LYS A 186 -8.478 4.782 17.812 1.00 0.96 C ATOM 2959 NZ LYS A 186 -8.974 4.339 19.142 1.00 1.09 N ATOM 0 H LYS A 186 -7.586 6.053 13.926 1.00 0.82 H new ATOM 0 HA LYS A 186 -4.740 5.467 14.292 1.00 0.79 H new ATOM 0 HB2 LYS A 186 -7.248 3.994 15.196 1.00 0.80 H new ATOM 0 HB3 LYS A 186 -5.609 3.680 15.730 1.00 0.80 H new ATOM 0 HG2 LYS A 186 -5.491 5.977 16.687 1.00 1.27 H new ATOM 0 HG3 LYS A 186 -7.140 6.269 16.172 1.00 1.27 H new ATOM 0 HD2 LYS A 186 -6.530 3.892 17.925 1.00 1.28 H new ATOM 0 HD3 LYS A 186 -6.629 5.489 18.638 1.00 1.28 H new ATOM 0 HE2 LYS A 186 -8.913 5.750 17.563 1.00 0.96 H new ATOM 0 HE3 LYS A 186 -8.806 4.079 17.046 1.00 0.96 H new ATOM 0 HZ1 LYS A 186 -10.012 4.279 19.123 1.00 1.09 H new ATOM 0 HZ2 LYS A 186 -8.577 3.404 19.367 1.00 1.09 H new ATOM 0 HZ3 LYS A 186 -8.680 5.024 19.868 1.00 1.09 H new ATOM 2973 N THR A 187 -6.480 4.156 11.966 1.00 0.59 N ATOM 2974 CA THR A 187 -6.326 3.246 10.833 1.00 0.54 C ATOM 2975 C THR A 187 -5.452 3.849 9.721 1.00 0.50 C ATOM 2976 O THR A 187 -4.557 3.186 9.221 1.00 0.53 O ATOM 2977 CB THR A 187 -7.684 2.756 10.257 1.00 0.58 C ATOM 2978 OG1 THR A 187 -7.468 1.631 9.392 1.00 0.62 O ATOM 2979 CG2 THR A 187 -8.399 3.845 9.476 1.00 0.60 C ATOM 0 H THR A 187 -7.247 4.824 11.894 1.00 0.59 H new ATOM 0 HA THR A 187 -5.812 2.371 11.231 1.00 0.54 H new ATOM 0 HB THR A 187 -8.311 2.474 11.103 1.00 0.58 H new ATOM 0 HG1 THR A 187 -7.357 0.820 9.931 1.00 0.62 H new ATOM 0 HG21 THR A 187 -9.343 3.458 9.092 1.00 0.60 H new ATOM 0 HG22 THR A 187 -8.595 4.694 10.131 1.00 0.60 H new ATOM 0 HG23 THR A 187 -7.773 4.166 8.643 1.00 0.60 H new ATOM 2987 N MET A 188 -5.669 5.102 9.347 1.00 0.52 N ATOM 2988 CA MET A 188 -4.954 5.651 8.200 1.00 0.53 C ATOM 2989 C MET A 188 -3.545 6.109 8.588 1.00 0.54 C ATOM 2990 O MET A 188 -2.565 5.491 8.172 1.00 0.54 O ATOM 2991 CB MET A 188 -5.741 6.784 7.530 1.00 0.62 C ATOM 2992 CG MET A 188 -7.128 6.392 7.028 1.00 0.80 C ATOM 2993 SD MET A 188 -7.114 5.384 5.526 1.00 1.06 S ATOM 2994 CE MET A 188 -6.657 3.768 6.148 1.00 0.83 C ATOM 0 H MET A 188 -6.316 5.744 9.805 1.00 0.52 H new ATOM 0 HA MET A 188 -4.853 4.849 7.469 1.00 0.53 H new ATOM 0 HB2 MET A 188 -5.846 7.604 8.241 1.00 0.62 H new ATOM 0 HB3 MET A 188 -5.160 7.163 6.689 1.00 0.62 H new ATOM 0 HG2 MET A 188 -7.646 5.844 7.815 1.00 0.80 H new ATOM 0 HG3 MET A 188 -7.703 7.298 6.839 1.00 0.80 H new ATOM 0 HE1 MET A 188 -5.656 3.514 5.800 1.00 0.83 H new ATOM 0 HE2 MET A 188 -6.670 3.781 7.238 1.00 0.83 H new ATOM 0 HE3 MET A 188 -7.367 3.024 5.785 1.00 0.83 H new ATOM 3004 N PRO A 189 -3.403 7.168 9.415 1.00 0.60 N ATOM 3005 CA PRO A 189 -2.086 7.702 9.773 1.00 0.71 C ATOM 3006 C PRO A 189 -1.225 6.671 10.491 1.00 0.74 C ATOM 3007 O PRO A 189 -0.007 6.665 10.348 1.00 0.91 O ATOM 3008 CB PRO A 189 -2.400 8.875 10.707 1.00 0.84 C ATOM 3009 CG PRO A 189 -3.828 9.207 10.450 1.00 0.83 C ATOM 3010 CD PRO A 189 -4.485 7.916 10.074 1.00 0.63 C ATOM 0 HA PRO A 189 -1.518 7.993 8.890 1.00 0.71 H new ATOM 0 HB2 PRO A 189 -2.241 8.601 11.750 1.00 0.84 H new ATOM 0 HB3 PRO A 189 -1.754 9.728 10.499 1.00 0.84 H new ATOM 0 HG2 PRO A 189 -4.294 9.640 11.335 1.00 0.83 H new ATOM 0 HG3 PRO A 189 -3.921 9.941 9.649 1.00 0.83 H new ATOM 0 HD2 PRO A 189 -4.865 7.388 10.948 1.00 0.63 H new ATOM 0 HD3 PRO A 189 -5.331 8.074 9.405 1.00 0.63 H new ATOM 3018 N SER A 190 -1.868 5.786 11.239 1.00 0.66 N ATOM 3019 CA SER A 190 -1.147 4.802 12.030 1.00 0.76 C ATOM 3020 C SER A 190 -0.640 3.646 11.169 1.00 0.72 C ATOM 3021 O SER A 190 0.399 3.053 11.463 1.00 0.90 O ATOM 3022 CB SER A 190 -2.042 4.284 13.159 1.00 0.84 C ATOM 3023 OG SER A 190 -2.473 5.357 13.983 1.00 1.50 O ATOM 0 H SER A 190 -2.884 5.730 11.314 1.00 0.66 H new ATOM 0 HA SER A 190 -0.273 5.290 12.462 1.00 0.76 H new ATOM 0 HB2 SER A 190 -2.907 3.770 12.739 1.00 0.84 H new ATOM 0 HB3 SER A 190 -1.497 3.554 13.758 1.00 0.84 H new ATOM 0 HG SER A 190 -2.611 5.032 14.897 1.00 1.50 H new ATOM 3029 N ASN A 191 -1.353 3.345 10.093 1.00 0.57 N ATOM 3030 CA ASN A 191 -0.984 2.217 9.240 1.00 0.61 C ATOM 3031 C ASN A 191 -0.036 2.646 8.131 1.00 0.51 C ATOM 3032 O ASN A 191 0.791 1.854 7.690 1.00 0.52 O ATOM 3033 CB ASN A 191 -2.214 1.524 8.637 1.00 0.70 C ATOM 3034 CG ASN A 191 -2.960 0.641 9.631 1.00 1.08 C ATOM 3035 OD1 ASN A 191 -2.248 0.103 10.610 1.00 1.88 O flip ATOM 3036 ND2 ASN A 191 -4.172 0.438 9.517 1.00 1.46 N flip ATOM 0 H ASN A 191 -2.181 3.857 9.790 1.00 0.57 H new ATOM 0 HA ASN A 191 -0.472 1.500 9.881 1.00 0.61 H new ATOM 0 HB2 ASN A 191 -2.896 2.282 8.252 1.00 0.70 H new ATOM 0 HB3 ASN A 191 -1.900 0.917 7.788 1.00 0.70 H new ATOM 0 HD21 ASN A 191 -4.691 0.868 8.751 1.00 1.46 H new ATOM 0 HD22 ASN A 191 -4.654 -0.159 10.188 1.00 1.46 H new ATOM 3043 N LEU A 192 -0.135 3.895 7.680 1.00 0.45 N ATOM 3044 CA LEU A 192 0.732 4.376 6.615 1.00 0.42 C ATOM 3045 C LEU A 192 2.190 4.383 7.051 1.00 0.36 C ATOM 3046 O LEU A 192 3.062 3.888 6.338 1.00 0.35 O ATOM 3047 CB LEU A 192 0.320 5.777 6.184 1.00 0.48 C ATOM 3048 CG LEU A 192 -1.080 5.894 5.594 1.00 0.62 C ATOM 3049 CD1 LEU A 192 -1.283 7.280 5.016 1.00 1.04 C ATOM 3050 CD2 LEU A 192 -1.309 4.832 4.531 1.00 1.09 C ATOM 0 H LEU A 192 -0.800 4.583 8.033 1.00 0.45 H new ATOM 0 HA LEU A 192 0.627 3.694 5.771 1.00 0.42 H new ATOM 0 HB2 LEU A 192 0.389 6.439 7.047 1.00 0.48 H new ATOM 0 HB3 LEU A 192 1.038 6.138 5.447 1.00 0.48 H new ATOM 0 HG LEU A 192 -1.808 5.734 6.390 1.00 0.62 H new ATOM 0 HD11 LEU A 192 -2.286 7.356 4.596 1.00 1.04 H new ATOM 0 HD12 LEU A 192 -1.162 8.024 5.803 1.00 1.04 H new ATOM 0 HD13 LEU A 192 -0.547 7.459 4.232 1.00 1.04 H new ATOM 0 HD21 LEU A 192 -2.315 4.935 4.124 1.00 1.09 H new ATOM 0 HD22 LEU A 192 -0.580 4.955 3.731 1.00 1.09 H new ATOM 0 HD23 LEU A 192 -1.197 3.843 4.975 1.00 1.09 H new ATOM 3062 N VAL A 193 2.450 4.933 8.231 1.00 0.36 N ATOM 3063 CA VAL A 193 3.814 4.999 8.747 1.00 0.36 C ATOM 3064 C VAL A 193 4.317 3.598 9.051 1.00 0.39 C ATOM 3065 O VAL A 193 5.485 3.278 8.846 1.00 0.42 O ATOM 3066 CB VAL A 193 3.921 5.880 10.015 1.00 0.44 C ATOM 3067 CG1 VAL A 193 2.956 7.042 9.925 1.00 0.68 C ATOM 3068 CG2 VAL A 193 3.677 5.099 11.301 1.00 0.59 C ATOM 0 H VAL A 193 1.742 5.337 8.845 1.00 0.36 H new ATOM 0 HA VAL A 193 4.432 5.460 7.976 1.00 0.36 H new ATOM 0 HB VAL A 193 4.945 6.251 10.056 1.00 0.44 H new ATOM 0 HG11 VAL A 193 3.040 7.655 10.822 1.00 0.68 H new ATOM 0 HG12 VAL A 193 3.194 7.646 9.049 1.00 0.68 H new ATOM 0 HG13 VAL A 193 1.938 6.663 9.838 1.00 0.68 H new ATOM 0 HG21 VAL A 193 3.765 5.769 12.156 1.00 0.59 H new ATOM 0 HG22 VAL A 193 2.676 4.667 11.280 1.00 0.59 H new ATOM 0 HG23 VAL A 193 4.415 4.301 11.388 1.00 0.59 H new ATOM 3078 N ASN A 194 3.399 2.770 9.517 1.00 0.43 N ATOM 3079 CA ASN A 194 3.682 1.383 9.833 1.00 0.48 C ATOM 3080 C ASN A 194 3.975 0.591 8.577 1.00 0.45 C ATOM 3081 O ASN A 194 4.754 -0.352 8.606 1.00 0.49 O ATOM 3082 CB ASN A 194 2.504 0.768 10.585 1.00 0.58 C ATOM 3083 CG ASN A 194 2.775 0.605 12.070 1.00 1.28 C ATOM 3084 OD1 ASN A 194 3.353 -0.391 12.500 1.00 1.80 O ATOM 3085 ND2 ASN A 194 2.331 1.568 12.863 1.00 2.07 N ATOM 0 H ASN A 194 2.431 3.043 9.687 1.00 0.43 H new ATOM 0 HA ASN A 194 4.567 1.348 10.469 1.00 0.48 H new ATOM 0 HB2 ASN A 194 1.624 1.396 10.448 1.00 0.58 H new ATOM 0 HB3 ASN A 194 2.272 -0.206 10.154 1.00 0.58 H new ATOM 0 HD21 ASN A 194 2.464 1.500 13.872 1.00 2.07 H new ATOM 0 HD22 ASN A 194 1.856 2.378 12.465 1.00 2.07 H new ATOM 3092 N PHE A 195 3.363 0.983 7.469 1.00 0.44 N ATOM 3093 CA PHE A 195 3.633 0.335 6.198 1.00 0.44 C ATOM 3094 C PHE A 195 5.004 0.765 5.690 1.00 0.36 C ATOM 3095 O PHE A 195 5.670 0.032 4.965 1.00 0.36 O ATOM 3096 CB PHE A 195 2.547 0.666 5.172 1.00 0.47 C ATOM 3097 CG PHE A 195 2.389 -0.386 4.111 1.00 0.73 C ATOM 3098 CD1 PHE A 195 3.135 -0.341 2.945 1.00 1.51 C ATOM 3099 CD2 PHE A 195 1.490 -1.427 4.286 1.00 1.06 C ATOM 3100 CE1 PHE A 195 2.987 -1.313 1.974 1.00 2.00 C ATOM 3101 CE2 PHE A 195 1.337 -2.401 3.319 1.00 1.43 C ATOM 3102 CZ PHE A 195 2.087 -2.344 2.161 1.00 1.76 C ATOM 0 H PHE A 195 2.682 1.741 7.426 1.00 0.44 H new ATOM 0 HA PHE A 195 3.628 -0.745 6.345 1.00 0.44 H new ATOM 0 HB2 PHE A 195 1.596 0.796 5.689 1.00 0.47 H new ATOM 0 HB3 PHE A 195 2.784 1.618 4.697 1.00 0.47 H new ATOM 0 HD1 PHE A 195 3.840 0.463 2.793 1.00 1.51 H new ATOM 0 HD2 PHE A 195 0.902 -1.477 5.190 1.00 1.06 H new ATOM 0 HE1 PHE A 195 3.575 -1.267 1.069 1.00 2.00 H new ATOM 0 HE2 PHE A 195 0.632 -3.206 3.468 1.00 1.43 H new ATOM 0 HZ PHE A 195 1.970 -3.104 1.403 1.00 1.76 H new ATOM 3112 N ILE A 196 5.434 1.959 6.087 1.00 0.31 N ATOM 3113 CA ILE A 196 6.773 2.407 5.783 1.00 0.27 C ATOM 3114 C ILE A 196 7.774 1.763 6.734 1.00 0.28 C ATOM 3115 O ILE A 196 8.939 1.570 6.400 1.00 0.28 O ATOM 3116 CB ILE A 196 6.872 3.936 5.856 1.00 0.25 C ATOM 3117 CG1 ILE A 196 6.142 4.557 4.666 1.00 0.25 C ATOM 3118 CG2 ILE A 196 8.321 4.377 5.903 1.00 0.29 C ATOM 3119 CD1 ILE A 196 6.275 6.056 4.596 1.00 0.26 C ATOM 0 H ILE A 196 4.872 2.625 6.617 1.00 0.31 H new ATOM 0 HA ILE A 196 7.010 2.102 4.764 1.00 0.27 H new ATOM 0 HB ILE A 196 6.395 4.281 6.773 1.00 0.25 H new ATOM 0 HG12 ILE A 196 6.530 4.122 3.745 1.00 0.25 H new ATOM 0 HG13 ILE A 196 5.085 4.296 4.722 1.00 0.25 H new ATOM 0 HG21 ILE A 196 8.369 5.465 5.954 1.00 0.29 H new ATOM 0 HG22 ILE A 196 8.803 3.951 6.783 1.00 0.29 H new ATOM 0 HG23 ILE A 196 8.835 4.033 5.005 1.00 0.29 H new ATOM 0 HD11 ILE A 196 5.733 6.429 3.727 1.00 0.26 H new ATOM 0 HD12 ILE A 196 5.861 6.501 5.501 1.00 0.26 H new ATOM 0 HD13 ILE A 196 7.328 6.324 4.509 1.00 0.26 H new ATOM 3131 N LEU A 197 7.314 1.430 7.921 1.00 0.33 N ATOM 3132 CA LEU A 197 8.117 0.671 8.858 1.00 0.37 C ATOM 3133 C LEU A 197 8.243 -0.746 8.380 1.00 0.36 C ATOM 3134 O LEU A 197 9.293 -1.363 8.503 1.00 0.38 O ATOM 3135 CB LEU A 197 7.503 0.697 10.247 1.00 0.50 C ATOM 3136 CG LEU A 197 7.614 2.033 10.950 1.00 0.52 C ATOM 3137 CD1 LEU A 197 6.956 1.946 12.310 1.00 1.00 C ATOM 3138 CD2 LEU A 197 9.081 2.417 11.060 1.00 1.03 C ATOM 0 H LEU A 197 6.384 1.674 8.262 1.00 0.33 H new ATOM 0 HA LEU A 197 9.106 1.127 8.915 1.00 0.37 H new ATOM 0 HB2 LEU A 197 6.450 0.425 10.172 1.00 0.50 H new ATOM 0 HB3 LEU A 197 7.986 -0.064 10.860 1.00 0.50 H new ATOM 0 HG LEU A 197 7.100 2.807 10.380 1.00 0.52 H new ATOM 0 HD11 LEU A 197 7.036 2.908 12.815 1.00 1.00 H new ATOM 0 HD12 LEU A 197 5.904 1.686 12.189 1.00 1.00 H new ATOM 0 HD13 LEU A 197 7.453 1.181 12.906 1.00 1.00 H new ATOM 0 HD21 LEU A 197 9.168 3.379 11.566 1.00 1.03 H new ATOM 0 HD22 LEU A 197 9.614 1.657 11.631 1.00 1.03 H new ATOM 0 HD23 LEU A 197 9.514 2.491 10.062 1.00 1.03 H new ATOM 3150 N ASN A 198 7.148 -1.255 7.855 1.00 0.38 N ATOM 3151 CA ASN A 198 7.177 -2.479 7.077 1.00 0.43 C ATOM 3152 C ASN A 198 8.263 -2.388 6.030 1.00 0.31 C ATOM 3153 O ASN A 198 8.970 -3.343 5.774 1.00 0.32 O ATOM 3154 CB ASN A 198 5.848 -2.728 6.375 1.00 0.65 C ATOM 3155 CG ASN A 198 4.773 -3.227 7.308 1.00 1.05 C ATOM 3156 OD1 ASN A 198 5.067 -3.861 8.313 1.00 1.90 O ATOM 3157 ND2 ASN A 198 3.522 -2.951 6.978 1.00 1.61 N ATOM 0 H ASN A 198 6.222 -0.839 7.953 1.00 0.38 H new ATOM 0 HA ASN A 198 7.370 -3.303 7.764 1.00 0.43 H new ATOM 0 HB2 ASN A 198 5.513 -1.803 5.905 1.00 0.65 H new ATOM 0 HB3 ASN A 198 5.996 -3.456 5.577 1.00 0.65 H new ATOM 0 HD21 ASN A 198 2.756 -3.270 7.571 1.00 1.61 H new ATOM 0 HD22 ASN A 198 3.324 -2.419 6.130 1.00 1.61 H new ATOM 3164 N ALA A 199 8.413 -1.221 5.445 1.00 0.29 N ATOM 3165 CA ALA A 199 9.387 -1.030 4.413 1.00 0.25 C ATOM 3166 C ALA A 199 10.781 -0.929 5.002 1.00 0.23 C ATOM 3167 O ALA A 199 11.717 -1.519 4.484 1.00 0.26 O ATOM 3168 CB ALA A 199 9.021 0.205 3.646 1.00 0.26 C ATOM 0 H ALA A 199 7.866 -0.391 5.673 1.00 0.29 H new ATOM 0 HA ALA A 199 9.393 -1.886 3.738 1.00 0.25 H new ATOM 0 HB1 ALA A 199 9.751 0.371 2.853 1.00 0.26 H new ATOM 0 HB2 ALA A 199 8.031 0.081 3.208 1.00 0.26 H new ATOM 0 HB3 ALA A 199 9.015 1.063 4.319 1.00 0.26 H new ATOM 3174 N LYS A 200 10.909 -0.192 6.096 1.00 0.26 N ATOM 3175 CA LYS A 200 12.178 -0.094 6.808 1.00 0.29 C ATOM 3176 C LYS A 200 12.649 -1.465 7.269 1.00 0.31 C ATOM 3177 O LYS A 200 13.825 -1.809 7.165 1.00 0.36 O ATOM 3178 CB LYS A 200 12.030 0.793 8.035 1.00 0.34 C ATOM 3179 CG LYS A 200 11.731 2.254 7.731 1.00 0.57 C ATOM 3180 CD LYS A 200 12.725 2.832 6.736 1.00 0.54 C ATOM 3181 CE LYS A 200 12.836 4.342 6.857 1.00 0.64 C ATOM 3182 NZ LYS A 200 11.520 5.016 6.737 1.00 0.97 N ATOM 0 H LYS A 200 10.150 0.348 6.511 1.00 0.26 H new ATOM 0 HA LYS A 200 12.907 0.333 6.119 1.00 0.29 H new ATOM 0 HB2 LYS A 200 11.231 0.395 8.660 1.00 0.34 H new ATOM 0 HB3 LYS A 200 12.949 0.738 8.619 1.00 0.34 H new ATOM 0 HG2 LYS A 200 10.721 2.344 7.331 1.00 0.57 H new ATOM 0 HG3 LYS A 200 11.761 2.832 8.654 1.00 0.57 H new ATOM 0 HD2 LYS A 200 13.704 2.382 6.899 1.00 0.54 H new ATOM 0 HD3 LYS A 200 12.418 2.571 5.723 1.00 0.54 H new ATOM 0 HE2 LYS A 200 13.285 4.595 7.818 1.00 0.64 H new ATOM 0 HE3 LYS A 200 13.506 4.718 6.083 1.00 0.64 H new ATOM 0 HZ1 LYS A 200 11.659 5.992 6.405 1.00 0.97 H new ATOM 0 HZ2 LYS A 200 10.926 4.500 6.057 1.00 0.97 H new ATOM 0 HZ3 LYS A 200 11.051 5.030 7.665 1.00 0.97 H new ATOM 3196 N ASP A 201 11.711 -2.240 7.774 1.00 0.30 N ATOM 3197 CA ASP A 201 12.029 -3.534 8.367 1.00 0.33 C ATOM 3198 C ASP A 201 12.058 -4.614 7.307 1.00 0.31 C ATOM 3199 O ASP A 201 12.897 -5.507 7.348 1.00 0.36 O ATOM 3200 CB ASP A 201 11.022 -3.897 9.461 1.00 0.40 C ATOM 3201 CG ASP A 201 11.362 -5.208 10.144 1.00 1.10 C ATOM 3202 OD1 ASP A 201 12.205 -5.204 11.066 1.00 1.18 O ATOM 3203 OD2 ASP A 201 10.783 -6.248 9.771 1.00 1.94 O ATOM 0 H ASP A 201 10.720 -2.001 7.788 1.00 0.30 H new ATOM 0 HA ASP A 201 13.018 -3.461 8.820 1.00 0.33 H new ATOM 0 HB2 ASP A 201 10.993 -3.100 10.204 1.00 0.40 H new ATOM 0 HB3 ASP A 201 10.025 -3.964 9.026 1.00 0.40 H new ATOM 3208 N GLY A 202 11.157 -4.513 6.344 1.00 0.31 N ATOM 3209 CA GLY A 202 11.113 -5.475 5.258 1.00 0.37 C ATOM 3210 C GLY A 202 12.287 -5.312 4.333 1.00 0.37 C ATOM 3211 O GLY A 202 12.734 -6.273 3.717 1.00 0.47 O ATOM 0 H GLY A 202 10.451 -3.779 6.293 1.00 0.31 H new ATOM 0 HA2 GLY A 202 11.107 -6.486 5.665 1.00 0.37 H new ATOM 0 HA3 GLY A 202 10.186 -5.351 4.698 1.00 0.37 H new ATOM 3215 N ILE A 203 12.785 -4.088 4.233 1.00 0.30 N ATOM 3216 CA ILE A 203 13.953 -3.813 3.425 1.00 0.37 C ATOM 3217 C ILE A 203 15.182 -4.407 4.087 1.00 0.47 C ATOM 3218 O ILE A 203 16.088 -4.867 3.410 1.00 0.61 O ATOM 3219 CB ILE A 203 14.169 -2.298 3.197 1.00 0.32 C ATOM 3220 CG1 ILE A 203 14.783 -2.046 1.841 1.00 0.41 C ATOM 3221 CG2 ILE A 203 15.071 -1.689 4.240 1.00 0.38 C ATOM 3222 CD1 ILE A 203 13.804 -2.135 0.724 1.00 0.52 C ATOM 0 H ILE A 203 12.394 -3.272 4.704 1.00 0.30 H new ATOM 0 HA ILE A 203 13.789 -4.271 2.449 1.00 0.37 H new ATOM 0 HB ILE A 203 13.185 -1.834 3.264 1.00 0.32 H new ATOM 0 HG12 ILE A 203 15.240 -1.057 1.836 1.00 0.41 H new ATOM 0 HG13 ILE A 203 15.582 -2.768 1.672 1.00 0.41 H new ATOM 0 HG21 ILE A 203 15.193 -0.625 4.039 1.00 0.38 H new ATOM 0 HG22 ILE A 203 14.628 -1.823 5.227 1.00 0.38 H new ATOM 0 HG23 ILE A 203 16.045 -2.178 4.209 1.00 0.38 H new ATOM 0 HD11 ILE A 203 14.312 -1.943 -0.221 1.00 0.52 H new ATOM 0 HD12 ILE A 203 13.364 -3.132 0.704 1.00 0.52 H new ATOM 0 HD13 ILE A 203 13.017 -1.395 0.870 1.00 0.52 H new ATOM 3234 N LYS A 204 15.193 -4.417 5.417 1.00 0.47 N ATOM 3235 CA LYS A 204 16.309 -4.973 6.156 1.00 0.63 C ATOM 3236 C LYS A 204 16.110 -6.459 6.316 1.00 0.64 C ATOM 3237 O LYS A 204 17.054 -7.205 6.495 1.00 0.78 O ATOM 3238 CB LYS A 204 16.472 -4.320 7.514 1.00 0.74 C ATOM 3239 CG LYS A 204 16.901 -2.867 7.445 1.00 1.21 C ATOM 3240 CD LYS A 204 17.134 -2.321 8.834 1.00 1.55 C ATOM 3241 CE LYS A 204 18.180 -1.219 8.843 1.00 2.41 C ATOM 3242 NZ LYS A 204 17.804 -0.052 7.998 1.00 3.37 N ATOM 0 H LYS A 204 14.441 -4.046 5.998 1.00 0.47 H new ATOM 0 HA LYS A 204 17.220 -4.777 5.591 1.00 0.63 H new ATOM 0 HB2 LYS A 204 15.528 -4.385 8.054 1.00 0.74 H new ATOM 0 HB3 LYS A 204 17.208 -4.880 8.090 1.00 0.74 H new ATOM 0 HG2 LYS A 204 17.813 -2.778 6.855 1.00 1.21 H new ATOM 0 HG3 LYS A 204 16.135 -2.279 6.940 1.00 1.21 H new ATOM 0 HD2 LYS A 204 16.197 -1.935 9.234 1.00 1.55 H new ATOM 0 HD3 LYS A 204 17.453 -3.129 9.493 1.00 1.55 H new ATOM 0 HE2 LYS A 204 18.337 -0.883 9.868 1.00 2.41 H new ATOM 0 HE3 LYS A 204 19.129 -1.624 8.492 1.00 2.41 H new ATOM 0 HZ1 LYS A 204 18.555 0.666 8.044 1.00 3.37 H new ATOM 0 HZ2 LYS A 204 17.681 -0.362 7.013 1.00 3.37 H new ATOM 0 HZ3 LYS A 204 16.913 0.356 8.346 1.00 3.37 H new ATOM 3256 N ALA A 205 14.865 -6.880 6.267 1.00 0.57 N ATOM 3257 CA ALA A 205 14.553 -8.284 6.129 1.00 0.69 C ATOM 3258 C ALA A 205 15.042 -8.761 4.771 1.00 0.87 C ATOM 3259 O ALA A 205 15.464 -9.904 4.603 1.00 1.02 O ATOM 3260 CB ALA A 205 13.058 -8.504 6.269 1.00 0.68 C ATOM 0 H ALA A 205 14.051 -6.268 6.321 1.00 0.57 H new ATOM 0 HA ALA A 205 15.051 -8.854 6.913 1.00 0.69 H new ATOM 0 HB1 ALA A 205 12.835 -9.566 6.163 1.00 0.68 H new ATOM 0 HB2 ALA A 205 12.730 -8.160 7.250 1.00 0.68 H new ATOM 0 HB3 ALA A 205 12.534 -7.944 5.494 1.00 0.68 H new