USER MOD reduce.3.24.130724 H: found=0, std=0, add=1312, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1305 hydrogens (45 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 101 GLN : amide:sc= -7.01! C(o=-6.7!,f=-7.5!) USER MOD Set 1.2: A 168 NDP O3B : rot -119:sc= 0.282 USER MOD Set 2.1: A 153 HIS : no HE2:sc= -3.93! C(o=-2.8!,f=-13!) USER MOD Set 2.2: A 155 TYR OH : rot 102:sc= 1.17 USER MOD Set 3.1: A 138 LYS NZ :NH3+ -150:sc= -0.0032 (180deg=-2.16!) USER MOD Set 3.2: A 141 SER OG : rot -33:sc= -0.583 USER MOD Set 4.1: A 85 TYR OH : rot -125:sc= 0.71 USER MOD Set 4.2: A 89 HIS : no HE2:sc= -2.26 K(o=-1.5,f=-4.9!) USER MOD Set 5.1: A 63 THR OG1 : rot 66:sc= -0.285 USER MOD Set 5.2: A 65 GLN : amide:sc= -2.5 K(o=-2.8,f=-3.7) USER MOD Set 6.1: A 58 THR OG1 : rot -120:sc=-0.00566 USER MOD Set 6.2: A 92 GLN : amide:sc= -0.453 X(o=-0.46,f=-0.13) USER MOD Set 7.1: A 34 THR OG1 : rot -82:sc= 0.673 USER MOD Set 7.2: A 39 MET CE :methyl -147:sc= -1.22 (180deg=-4.43!) USER MOD Single : A 1 THR N :NH3+ -125:sc= 0.0668 (180deg=-0.0331) USER MOD Single : A 1 THR OG1 : rot 120:sc= -0.186 USER MOD Single : A 7 GLN : amide:sc= -3.92! C(o=-3.9!,f=-6.2!) USER MOD Single : A 15 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0738) USER MOD Single : A 18 HIS : no HE2:sc= 0.42 K(o=0.42,f=-4.1!) USER MOD Single : A 22 HIS : no HD1:sc= -0.0311 X(o=-0.031,f=0) USER MOD Single : A 28 HIS : no HD1:sc= -0.0629 X(o=-0.063,f=-0.11) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 GLN :FLIP amide:sc= -1.08 F(o=-3.9!,f=-1.1) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 THR OG1 : rot 63:sc= 0.388 USER MOD Single : A 46 TYR OH : rot 180:sc= -0.732 USER MOD Single : A 48 SER OG : rot 160:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 ASN :FLIP amide:sc= -1.84! C(o=-3!,f=-1.8!) USER MOD Single : A 64 HIS : no HD1:sc= -0.338 X(o=-0.34,f=0.068) USER MOD Single : A 68 TYR OH : rot 180:sc= -0.0781 USER MOD Single : A 69 GLN : amide:sc= -0.0283 X(o=-0.028,f=-0.21) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 HIS : no HE2:sc= -4.85 K(o=-4.8,f=-8.9!) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 GLN :FLIP amide:sc= -0.469 F(o=-1.1,f=-0.47) USER MOD Single : A 104 THR OG1 : rot 180:sc=-0.00062 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= -0.0647 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 SER OG : rot 2:sc= 0.71! USER MOD Single : A 126 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 LYS NZ :NH3+ -163:sc=-0.00999 (180deg=-0.303) USER MOD Single : A 128 MET CE :methyl -132:sc= -8.25! (180deg=-12.8!) USER MOD Single : A 132 ASN : amide:sc=-0.00221 X(o=-0.0022,f=0) USER MOD Single : A 137 THR OG1 : rot -170:sc= 0 USER MOD Single : A 140 SER OG : rot 180:sc=-0.00665 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0.00953 USER MOD Single : A 148 ASN : amide:sc= -0.579 X(o=-0.58,f=-0.42) USER MOD Single : A 152 THR OG1 : rot 94:sc= 0.157 USER MOD Single : A 154 THR OG1 : rot -179:sc= -3.14! USER MOD Single : A 159 GLN : amide:sc= -1.86 K(o=-1.9,f=-7.2!) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 168 NDP O2D : rot -90:sc= -1.19! USER MOD Single : A 168 NDP O3D : rot -140:sc= -0.653 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -5.512 10.090 4.111 1.00 0.00 N ATOM 2 CA THR A 1 -5.043 9.156 3.048 1.00 0.00 C ATOM 3 C THR A 1 -3.530 8.955 3.171 1.00 0.00 C ATOM 4 O THR A 1 -2.759 9.886 3.045 1.00 0.00 O ATOM 5 CB THR A 1 -5.370 9.738 1.672 1.00 0.00 C ATOM 6 OG1 THR A 1 -6.656 10.341 1.710 1.00 0.00 O ATOM 7 CG2 THR A 1 -5.358 8.618 0.629 1.00 0.00 C ATOM 0 H1 THR A 1 -6.271 9.638 4.660 1.00 0.00 H new ATOM 0 H2 THR A 1 -4.719 10.323 4.742 1.00 0.00 H new ATOM 0 H3 THR A 1 -5.874 10.961 3.673 1.00 0.00 H new ATOM 0 HA THR A 1 -5.547 8.196 3.164 1.00 0.00 H new ATOM 0 HB THR A 1 -4.625 10.488 1.405 1.00 0.00 H new ATOM 0 HG1 THR A 1 -6.578 11.293 1.491 1.00 0.00 H new ATOM 0 HG21 THR A 1 -5.591 9.032 -0.352 1.00 0.00 H new ATOM 0 HG22 THR A 1 -4.371 8.156 0.603 1.00 0.00 H new ATOM 0 HG23 THR A 1 -6.103 7.867 0.892 1.00 0.00 H new ATOM 17 N ALA A 2 -3.099 7.743 3.407 1.00 0.00 N ATOM 18 CA ALA A 2 -1.635 7.484 3.533 1.00 0.00 C ATOM 19 C ALA A 2 -1.225 6.361 2.577 1.00 0.00 C ATOM 20 O ALA A 2 -2.009 5.496 2.248 1.00 0.00 O ATOM 21 CB ALA A 2 -1.311 7.075 4.972 1.00 0.00 C ATOM 0 H ALA A 2 -3.696 6.924 3.518 1.00 0.00 H new ATOM 0 HA ALA A 2 -1.085 8.391 3.280 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -0.242 6.886 5.064 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -1.598 7.878 5.652 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -1.863 6.170 5.226 1.00 0.00 H new ATOM 27 N PHE A 3 0.008 6.363 2.141 1.00 0.00 N ATOM 28 CA PHE A 3 0.486 5.296 1.212 1.00 0.00 C ATOM 29 C PHE A 3 1.373 4.321 1.985 1.00 0.00 C ATOM 30 O PHE A 3 2.240 4.731 2.729 1.00 0.00 O ATOM 31 CB PHE A 3 1.335 5.929 0.105 1.00 0.00 C ATOM 32 CG PHE A 3 0.473 6.454 -1.022 1.00 0.00 C ATOM 33 CD1 PHE A 3 -0.801 6.974 -0.772 1.00 0.00 C ATOM 34 CD2 PHE A 3 0.970 6.431 -2.327 1.00 0.00 C ATOM 35 CE1 PHE A 3 -1.572 7.468 -1.830 1.00 0.00 C ATOM 36 CE2 PHE A 3 0.199 6.922 -3.383 1.00 0.00 C ATOM 37 CZ PHE A 3 -1.072 7.441 -3.134 1.00 0.00 C ATOM 0 H PHE A 3 0.708 7.062 2.390 1.00 0.00 H new ATOM 0 HA PHE A 3 -0.373 4.779 0.784 1.00 0.00 H new ATOM 0 HB2 PHE A 3 1.928 6.743 0.521 1.00 0.00 H new ATOM 0 HB3 PHE A 3 2.036 5.191 -0.285 1.00 0.00 H new ATOM 0 HD1 PHE A 3 -1.189 6.994 0.236 1.00 0.00 H new ATOM 0 HD2 PHE A 3 1.955 6.032 -2.520 1.00 0.00 H new ATOM 0 HE1 PHE A 3 -2.555 7.871 -1.638 1.00 0.00 H new ATOM 0 HE2 PHE A 3 0.586 6.900 -4.391 1.00 0.00 H new ATOM 0 HZ PHE A 3 -1.669 7.822 -3.949 1.00 0.00 H new ATOM 47 N LEU A 4 1.185 3.039 1.819 1.00 0.00 N ATOM 48 CA LEU A 4 2.052 2.071 2.553 1.00 0.00 C ATOM 49 C LEU A 4 2.532 0.990 1.578 1.00 0.00 C ATOM 50 O LEU A 4 1.891 -0.024 1.409 1.00 0.00 O ATOM 51 CB LEU A 4 1.243 1.438 3.693 1.00 0.00 C ATOM 52 CG LEU A 4 2.000 0.249 4.295 1.00 0.00 C ATOM 53 CD1 LEU A 4 3.382 0.699 4.780 1.00 0.00 C ATOM 54 CD2 LEU A 4 1.206 -0.300 5.481 1.00 0.00 C ATOM 0 H LEU A 4 0.477 2.623 1.214 1.00 0.00 H new ATOM 0 HA LEU A 4 2.918 2.582 2.973 1.00 0.00 H new ATOM 0 HB2 LEU A 4 1.050 2.182 4.466 1.00 0.00 H new ATOM 0 HB3 LEU A 4 0.274 1.108 3.319 1.00 0.00 H new ATOM 0 HG LEU A 4 2.121 -0.523 3.535 1.00 0.00 H new ATOM 0 HD11 LEU A 4 3.913 -0.152 5.206 1.00 0.00 H new ATOM 0 HD12 LEU A 4 3.951 1.097 3.940 1.00 0.00 H new ATOM 0 HD13 LEU A 4 3.267 1.472 5.540 1.00 0.00 H new ATOM 0 HD21 LEU A 4 1.738 -1.146 5.915 1.00 0.00 H new ATOM 0 HD22 LEU A 4 1.090 0.480 6.234 1.00 0.00 H new ATOM 0 HD23 LEU A 4 0.223 -0.625 5.141 1.00 0.00 H new ATOM 66 N TRP A 5 3.649 1.199 0.926 1.00 0.00 N ATOM 67 CA TRP A 5 4.144 0.173 -0.042 1.00 0.00 C ATOM 68 C TRP A 5 5.641 -0.079 0.152 1.00 0.00 C ATOM 69 O TRP A 5 6.410 0.832 0.385 1.00 0.00 O ATOM 70 CB TRP A 5 3.882 0.656 -1.475 1.00 0.00 C ATOM 71 CG TRP A 5 4.904 1.675 -1.888 1.00 0.00 C ATOM 72 CD1 TRP A 5 5.971 1.426 -2.685 1.00 0.00 C ATOM 73 CD2 TRP A 5 4.966 3.091 -1.552 1.00 0.00 C ATOM 74 NE1 TRP A 5 6.681 2.602 -2.862 1.00 0.00 N ATOM 75 CE2 TRP A 5 6.101 3.656 -2.183 1.00 0.00 C ATOM 76 CE3 TRP A 5 4.154 3.932 -0.770 1.00 0.00 C ATOM 77 CZ2 TRP A 5 6.417 5.009 -2.042 1.00 0.00 C ATOM 78 CZ3 TRP A 5 4.470 5.292 -0.627 1.00 0.00 C ATOM 79 CH2 TRP A 5 5.599 5.829 -1.261 1.00 0.00 C ATOM 0 H TRP A 5 4.235 2.028 1.021 1.00 0.00 H new ATOM 0 HA TRP A 5 3.612 -0.761 0.136 1.00 0.00 H new ATOM 0 HB2 TRP A 5 3.909 -0.191 -2.160 1.00 0.00 H new ATOM 0 HB3 TRP A 5 2.883 1.088 -1.541 1.00 0.00 H new ATOM 0 HD1 TRP A 5 6.226 0.468 -3.112 1.00 0.00 H new ATOM 0 HE1 TRP A 5 7.528 2.680 -3.425 1.00 0.00 H new ATOM 0 HE3 TRP A 5 3.282 3.529 -0.277 1.00 0.00 H new ATOM 0 HZ2 TRP A 5 7.287 5.418 -2.533 1.00 0.00 H new ATOM 0 HZ3 TRP A 5 3.839 5.929 -0.025 1.00 0.00 H new ATOM 0 HH2 TRP A 5 5.836 6.876 -1.146 1.00 0.00 H new ATOM 90 N ALA A 6 6.058 -1.312 0.041 1.00 0.00 N ATOM 91 CA ALA A 6 7.502 -1.635 0.195 1.00 0.00 C ATOM 92 C ALA A 6 8.120 -1.758 -1.200 1.00 0.00 C ATOM 93 O ALA A 6 7.724 -2.598 -1.985 1.00 0.00 O ATOM 94 CB ALA A 6 7.645 -2.966 0.940 1.00 0.00 C ATOM 0 H ALA A 6 5.455 -2.112 -0.151 1.00 0.00 H new ATOM 0 HA ALA A 6 8.008 -0.852 0.760 1.00 0.00 H new ATOM 0 HB1 ALA A 6 8.702 -3.207 1.055 1.00 0.00 H new ATOM 0 HB2 ALA A 6 7.182 -2.884 1.923 1.00 0.00 H new ATOM 0 HB3 ALA A 6 7.153 -3.756 0.372 1.00 0.00 H new ATOM 100 N GLN A 7 9.078 -0.929 -1.525 1.00 0.00 N ATOM 101 CA GLN A 7 9.702 -1.010 -2.878 1.00 0.00 C ATOM 102 C GLN A 7 11.192 -1.318 -2.735 1.00 0.00 C ATOM 103 O GLN A 7 11.781 -1.092 -1.697 1.00 0.00 O ATOM 104 CB GLN A 7 9.522 0.321 -3.612 1.00 0.00 C ATOM 105 CG GLN A 7 10.053 1.465 -2.743 1.00 0.00 C ATOM 106 CD GLN A 7 11.023 2.324 -3.558 1.00 0.00 C ATOM 107 OE1 GLN A 7 12.223 2.194 -3.429 1.00 0.00 O ATOM 108 NE2 GLN A 7 10.549 3.203 -4.398 1.00 0.00 N ATOM 0 H GLN A 7 9.453 -0.203 -0.915 1.00 0.00 H new ATOM 0 HA GLN A 7 9.220 -1.803 -3.450 1.00 0.00 H new ATOM 0 HB2 GLN A 7 10.053 0.297 -4.564 1.00 0.00 H new ATOM 0 HB3 GLN A 7 8.468 0.483 -3.839 1.00 0.00 H new ATOM 0 HG2 GLN A 7 9.225 2.076 -2.383 1.00 0.00 H new ATOM 0 HG3 GLN A 7 10.558 1.063 -1.864 1.00 0.00 H new ATOM 0 HE21 GLN A 7 9.541 3.313 -4.507 1.00 0.00 H new ATOM 0 HE22 GLN A 7 11.187 3.780 -4.946 1.00 0.00 H new ATOM 117 N ASP A 8 11.810 -1.831 -3.767 1.00 0.00 N ATOM 118 CA ASP A 8 13.261 -2.153 -3.676 1.00 0.00 C ATOM 119 C ASP A 8 14.093 -0.917 -4.029 1.00 0.00 C ATOM 120 O ASP A 8 13.589 0.188 -4.078 1.00 0.00 O ATOM 121 CB ASP A 8 13.595 -3.308 -4.629 1.00 0.00 C ATOM 122 CG ASP A 8 13.255 -2.926 -6.073 1.00 0.00 C ATOM 123 OD1 ASP A 8 13.284 -1.748 -6.382 1.00 0.00 O ATOM 124 OD2 ASP A 8 12.976 -3.825 -6.849 1.00 0.00 O ATOM 0 H ASP A 8 11.373 -2.039 -4.665 1.00 0.00 H new ATOM 0 HA ASP A 8 13.499 -2.455 -2.656 1.00 0.00 H new ATOM 0 HB2 ASP A 8 14.653 -3.557 -4.552 1.00 0.00 H new ATOM 0 HB3 ASP A 8 13.036 -4.199 -4.341 1.00 0.00 H new ATOM 129 N ARG A 9 15.367 -1.094 -4.257 1.00 0.00 N ATOM 130 CA ARG A 9 16.238 0.070 -4.587 1.00 0.00 C ATOM 131 C ARG A 9 15.748 0.759 -5.867 1.00 0.00 C ATOM 132 O ARG A 9 15.701 1.971 -5.942 1.00 0.00 O ATOM 133 CB ARG A 9 17.683 -0.404 -4.774 1.00 0.00 C ATOM 134 CG ARG A 9 17.741 -1.507 -5.835 1.00 0.00 C ATOM 135 CD ARG A 9 18.140 -0.905 -7.186 1.00 0.00 C ATOM 136 NE ARG A 9 19.391 -1.561 -7.674 1.00 0.00 N ATOM 137 CZ ARG A 9 20.574 -1.122 -7.308 1.00 0.00 C ATOM 138 NH1 ARG A 9 20.693 -0.094 -6.507 1.00 0.00 N ATOM 139 NH2 ARG A 9 21.646 -1.721 -7.748 1.00 0.00 N ATOM 0 H ARG A 9 15.842 -1.996 -4.229 1.00 0.00 H new ATOM 0 HA ARG A 9 16.194 0.786 -3.766 1.00 0.00 H new ATOM 0 HB2 ARG A 9 18.313 0.433 -5.074 1.00 0.00 H new ATOM 0 HB3 ARG A 9 18.077 -0.777 -3.829 1.00 0.00 H new ATOM 0 HG2 ARG A 9 18.460 -2.271 -5.540 1.00 0.00 H new ATOM 0 HG3 ARG A 9 16.771 -1.997 -5.917 1.00 0.00 H new ATOM 0 HD2 ARG A 9 17.337 -1.045 -7.910 1.00 0.00 H new ATOM 0 HD3 ARG A 9 18.295 0.169 -7.086 1.00 0.00 H new ATOM 0 HE ARG A 9 19.325 -2.363 -8.301 1.00 0.00 H new ATOM 0 HH11 ARG A 9 19.860 0.379 -6.157 1.00 0.00 H new ATOM 0 HH12 ARG A 9 21.619 0.234 -6.233 1.00 0.00 H new ATOM 0 HH21 ARG A 9 21.562 -2.524 -8.371 1.00 0.00 H new ATOM 0 HH22 ARG A 9 22.568 -1.386 -7.469 1.00 0.00 H new ATOM 153 N ASP A 10 15.395 0.007 -6.878 1.00 0.00 N ATOM 154 CA ASP A 10 14.924 0.635 -8.149 1.00 0.00 C ATOM 155 C ASP A 10 13.523 1.223 -7.959 1.00 0.00 C ATOM 156 O ASP A 10 13.157 2.193 -8.594 1.00 0.00 O ATOM 157 CB ASP A 10 14.884 -0.424 -9.253 1.00 0.00 C ATOM 158 CG ASP A 10 16.191 -0.386 -10.046 1.00 0.00 C ATOM 159 OD1 ASP A 10 16.493 0.657 -10.602 1.00 0.00 O ATOM 160 OD2 ASP A 10 16.868 -1.400 -10.083 1.00 0.00 O ATOM 0 H ASP A 10 15.412 -1.013 -6.878 1.00 0.00 H new ATOM 0 HA ASP A 10 15.611 1.434 -8.427 1.00 0.00 H new ATOM 0 HB2 ASP A 10 14.739 -1.413 -8.818 1.00 0.00 H new ATOM 0 HB3 ASP A 10 14.039 -0.241 -9.916 1.00 0.00 H new ATOM 165 N GLY A 11 12.737 0.647 -7.090 1.00 0.00 N ATOM 166 CA GLY A 11 11.362 1.176 -6.861 1.00 0.00 C ATOM 167 C GLY A 11 10.327 0.197 -7.423 1.00 0.00 C ATOM 168 O GLY A 11 9.342 0.594 -8.014 1.00 0.00 O ATOM 0 H GLY A 11 12.988 -0.167 -6.529 1.00 0.00 H new ATOM 0 HA2 GLY A 11 11.193 1.325 -5.795 1.00 0.00 H new ATOM 0 HA3 GLY A 11 11.253 2.149 -7.340 1.00 0.00 H new ATOM 172 N LEU A 12 10.537 -1.078 -7.230 1.00 0.00 N ATOM 173 CA LEU A 12 9.562 -2.086 -7.739 1.00 0.00 C ATOM 174 C LEU A 12 8.561 -2.404 -6.628 1.00 0.00 C ATOM 175 O LEU A 12 8.878 -2.309 -5.461 1.00 0.00 O ATOM 176 CB LEU A 12 10.315 -3.361 -8.133 1.00 0.00 C ATOM 177 CG LEU A 12 9.328 -4.434 -8.600 1.00 0.00 C ATOM 178 CD1 LEU A 12 8.754 -4.049 -9.965 1.00 0.00 C ATOM 179 CD2 LEU A 12 10.057 -5.774 -8.710 1.00 0.00 C ATOM 0 H LEU A 12 11.344 -1.466 -6.741 1.00 0.00 H new ATOM 0 HA LEU A 12 9.036 -1.695 -8.610 1.00 0.00 H new ATOM 0 HB2 LEU A 12 11.027 -3.141 -8.928 1.00 0.00 H new ATOM 0 HB3 LEU A 12 10.890 -3.730 -7.284 1.00 0.00 H new ATOM 0 HG LEU A 12 8.513 -4.517 -7.881 1.00 0.00 H new ATOM 0 HD11 LEU A 12 8.052 -4.815 -10.294 1.00 0.00 H new ATOM 0 HD12 LEU A 12 8.237 -3.093 -9.886 1.00 0.00 H new ATOM 0 HD13 LEU A 12 9.564 -3.964 -10.689 1.00 0.00 H new ATOM 0 HD21 LEU A 12 9.359 -6.542 -9.042 1.00 0.00 H new ATOM 0 HD22 LEU A 12 10.871 -5.687 -9.430 1.00 0.00 H new ATOM 0 HD23 LEU A 12 10.462 -6.049 -7.736 1.00 0.00 H new ATOM 191 N ILE A 13 7.359 -2.785 -6.973 1.00 0.00 N ATOM 192 CA ILE A 13 6.359 -3.114 -5.917 1.00 0.00 C ATOM 193 C ILE A 13 5.994 -4.600 -6.008 1.00 0.00 C ATOM 194 O ILE A 13 6.261 -5.365 -5.100 1.00 0.00 O ATOM 195 CB ILE A 13 5.100 -2.247 -6.074 1.00 0.00 C ATOM 196 CG1 ILE A 13 4.835 -1.927 -7.548 1.00 0.00 C ATOM 197 CG2 ILE A 13 5.293 -0.939 -5.313 1.00 0.00 C ATOM 198 CD1 ILE A 13 3.326 -1.809 -7.774 1.00 0.00 C ATOM 0 H ILE A 13 7.029 -2.882 -7.933 1.00 0.00 H new ATOM 0 HA ILE A 13 6.794 -2.906 -4.939 1.00 0.00 H new ATOM 0 HB ILE A 13 4.249 -2.800 -5.676 1.00 0.00 H new ATOM 0 HG12 ILE A 13 5.330 -0.996 -7.825 1.00 0.00 H new ATOM 0 HG13 ILE A 13 5.250 -2.710 -8.183 1.00 0.00 H new ATOM 0 HG21 ILE A 13 4.402 -0.320 -5.421 1.00 0.00 H new ATOM 0 HG22 ILE A 13 5.460 -1.153 -4.257 1.00 0.00 H new ATOM 0 HG23 ILE A 13 6.155 -0.408 -5.716 1.00 0.00 H new ATOM 0 HD11 ILE A 13 3.132 -1.581 -8.822 1.00 0.00 H new ATOM 0 HD12 ILE A 13 2.844 -2.751 -7.512 1.00 0.00 H new ATOM 0 HD13 ILE A 13 2.926 -1.011 -7.149 1.00 0.00 H new ATOM 210 N GLY A 14 5.385 -5.022 -7.087 1.00 0.00 N ATOM 211 CA GLY A 14 5.013 -6.463 -7.214 1.00 0.00 C ATOM 212 C GLY A 14 4.891 -6.829 -8.692 1.00 0.00 C ATOM 213 O GLY A 14 4.575 -5.998 -9.520 1.00 0.00 O ATOM 0 H GLY A 14 5.131 -4.435 -7.881 1.00 0.00 H new ATOM 0 HA2 GLY A 14 5.767 -7.088 -6.735 1.00 0.00 H new ATOM 0 HA3 GLY A 14 4.069 -6.653 -6.702 1.00 0.00 H new ATOM 217 N LYS A 15 5.163 -8.060 -9.038 1.00 0.00 N ATOM 218 CA LYS A 15 5.085 -8.460 -10.471 1.00 0.00 C ATOM 219 C LYS A 15 4.158 -9.665 -10.637 1.00 0.00 C ATOM 220 O LYS A 15 4.270 -10.651 -9.935 1.00 0.00 O ATOM 221 CB LYS A 15 6.487 -8.832 -10.963 1.00 0.00 C ATOM 222 CG LYS A 15 6.485 -8.955 -12.488 1.00 0.00 C ATOM 223 CD LYS A 15 7.561 -9.954 -12.923 1.00 0.00 C ATOM 224 CE LYS A 15 6.919 -11.319 -13.181 1.00 0.00 C ATOM 225 NZ LYS A 15 7.079 -12.182 -11.976 1.00 0.00 N ATOM 0 H LYS A 15 5.434 -8.802 -8.392 1.00 0.00 H new ATOM 0 HA LYS A 15 4.690 -7.627 -11.052 1.00 0.00 H new ATOM 0 HB2 LYS A 15 7.205 -8.074 -10.651 1.00 0.00 H new ATOM 0 HB3 LYS A 15 6.802 -9.774 -10.513 1.00 0.00 H new ATOM 0 HG2 LYS A 15 5.506 -9.285 -12.835 1.00 0.00 H new ATOM 0 HG3 LYS A 15 6.673 -7.982 -12.942 1.00 0.00 H new ATOM 0 HD2 LYS A 15 8.058 -9.598 -13.825 1.00 0.00 H new ATOM 0 HD3 LYS A 15 8.325 -10.040 -12.151 1.00 0.00 H new ATOM 0 HE2 LYS A 15 5.862 -11.196 -13.415 1.00 0.00 H new ATOM 0 HE3 LYS A 15 7.384 -11.794 -14.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 6.766 -13.149 -12.197 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 8.079 -12.199 -11.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 6.504 -11.801 -11.198 1.00 0.00 H new ATOM 239 N ASP A 16 3.262 -9.600 -11.584 1.00 0.00 N ATOM 240 CA ASP A 16 2.339 -10.742 -11.838 1.00 0.00 C ATOM 241 C ASP A 16 1.535 -11.106 -10.582 1.00 0.00 C ATOM 242 O ASP A 16 1.440 -12.264 -10.224 1.00 0.00 O ATOM 243 CB ASP A 16 3.160 -11.957 -12.285 1.00 0.00 C ATOM 244 CG ASP A 16 3.153 -12.049 -13.812 1.00 0.00 C ATOM 245 OD1 ASP A 16 3.890 -11.302 -14.435 1.00 0.00 O ATOM 246 OD2 ASP A 16 2.411 -12.866 -14.333 1.00 0.00 O ATOM 0 H ASP A 16 3.129 -8.797 -12.198 1.00 0.00 H new ATOM 0 HA ASP A 16 1.634 -10.448 -12.616 1.00 0.00 H new ATOM 0 HB2 ASP A 16 4.184 -11.870 -11.921 1.00 0.00 H new ATOM 0 HB3 ASP A 16 2.744 -12.868 -11.854 1.00 0.00 H new ATOM 251 N GLY A 17 0.919 -10.154 -9.922 1.00 0.00 N ATOM 252 CA GLY A 17 0.098 -10.499 -8.724 1.00 0.00 C ATOM 253 C GLY A 17 0.978 -10.723 -7.491 1.00 0.00 C ATOM 254 O GLY A 17 1.073 -9.878 -6.624 1.00 0.00 O ATOM 0 H GLY A 17 0.950 -9.163 -10.160 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -0.613 -9.697 -8.525 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -0.484 -11.398 -8.926 1.00 0.00 H new ATOM 258 N HIS A 18 1.592 -11.869 -7.393 1.00 0.00 N ATOM 259 CA HIS A 18 2.439 -12.177 -6.203 1.00 0.00 C ATOM 260 C HIS A 18 3.546 -11.130 -6.046 1.00 0.00 C ATOM 261 O HIS A 18 3.526 -10.087 -6.670 1.00 0.00 O ATOM 262 CB HIS A 18 3.061 -13.564 -6.381 1.00 0.00 C ATOM 263 CG HIS A 18 3.826 -13.609 -7.674 1.00 0.00 C ATOM 264 ND1 HIS A 18 5.167 -13.271 -7.751 1.00 0.00 N ATOM 265 CD2 HIS A 18 3.451 -13.949 -8.950 1.00 0.00 C ATOM 266 CE1 HIS A 18 5.548 -13.412 -9.034 1.00 0.00 C ATOM 267 NE2 HIS A 18 4.540 -13.824 -9.807 1.00 0.00 N ATOM 0 H HIS A 18 1.544 -12.612 -8.090 1.00 0.00 H new ATOM 0 HA HIS A 18 1.818 -12.159 -5.307 1.00 0.00 H new ATOM 0 HB2 HIS A 18 3.725 -13.786 -5.546 1.00 0.00 H new ATOM 0 HB3 HIS A 18 2.282 -14.326 -6.381 1.00 0.00 H new ATOM 0 HD1 HIS A 18 5.758 -12.970 -6.976 1.00 0.00 H new ATOM 0 HD2 HIS A 18 2.461 -14.265 -9.244 1.00 0.00 H new ATOM 0 HE1 HIS A 18 6.547 -13.216 -9.394 1.00 0.00 H new ATOM 275 N LEU A 19 4.520 -11.412 -5.219 1.00 0.00 N ATOM 276 CA LEU A 19 5.641 -10.453 -5.017 1.00 0.00 C ATOM 277 C LEU A 19 6.894 -11.014 -5.693 1.00 0.00 C ATOM 278 O LEU A 19 6.977 -12.201 -5.941 1.00 0.00 O ATOM 279 CB LEU A 19 5.907 -10.279 -3.520 1.00 0.00 C ATOM 280 CG LEU A 19 4.998 -9.185 -2.960 1.00 0.00 C ATOM 281 CD1 LEU A 19 4.739 -9.447 -1.475 1.00 0.00 C ATOM 282 CD2 LEU A 19 5.676 -7.823 -3.125 1.00 0.00 C ATOM 0 H LEU A 19 4.585 -12.271 -4.673 1.00 0.00 H new ATOM 0 HA LEU A 19 5.383 -9.486 -5.449 1.00 0.00 H new ATOM 0 HB2 LEU A 19 5.727 -11.218 -2.997 1.00 0.00 H new ATOM 0 HB3 LEU A 19 6.952 -10.017 -3.354 1.00 0.00 H new ATOM 0 HG LEU A 19 4.052 -9.188 -3.501 1.00 0.00 H new ATOM 0 HD11 LEU A 19 4.091 -8.667 -1.076 1.00 0.00 H new ATOM 0 HD12 LEU A 19 4.256 -10.417 -1.355 1.00 0.00 H new ATOM 0 HD13 LEU A 19 5.686 -9.444 -0.935 1.00 0.00 H new ATOM 0 HD21 LEU A 19 5.028 -7.043 -2.726 1.00 0.00 H new ATOM 0 HD22 LEU A 19 6.623 -7.820 -2.585 1.00 0.00 H new ATOM 0 HD23 LEU A 19 5.861 -7.635 -4.182 1.00 0.00 H new ATOM 294 N PRO A 20 7.835 -10.150 -5.974 1.00 0.00 N ATOM 295 CA PRO A 20 9.140 -10.476 -6.637 1.00 0.00 C ATOM 296 C PRO A 20 10.123 -11.033 -5.605 1.00 0.00 C ATOM 297 O PRO A 20 10.944 -11.876 -5.908 1.00 0.00 O ATOM 298 CB PRO A 20 9.666 -9.166 -7.221 1.00 0.00 C ATOM 299 CG PRO A 20 8.771 -8.052 -6.711 1.00 0.00 C ATOM 300 CD PRO A 20 7.814 -8.672 -5.700 1.00 0.00 C ATOM 0 HA PRO A 20 9.017 -11.229 -7.415 1.00 0.00 H new ATOM 0 HB2 PRO A 20 10.699 -8.998 -6.918 1.00 0.00 H new ATOM 0 HB3 PRO A 20 9.655 -9.199 -8.310 1.00 0.00 H new ATOM 0 HG2 PRO A 20 9.364 -7.264 -6.247 1.00 0.00 H new ATOM 0 HG3 PRO A 20 8.220 -7.594 -7.532 1.00 0.00 H new ATOM 0 HD2 PRO A 20 8.131 -8.458 -4.679 1.00 0.00 H new ATOM 0 HD3 PRO A 20 6.808 -8.267 -5.813 1.00 0.00 H new ATOM 308 N TRP A 21 10.051 -10.559 -4.390 1.00 0.00 N ATOM 309 CA TRP A 21 10.981 -11.046 -3.334 1.00 0.00 C ATOM 310 C TRP A 21 10.189 -11.820 -2.271 1.00 0.00 C ATOM 311 O TRP A 21 9.092 -12.284 -2.515 1.00 0.00 O ATOM 312 CB TRP A 21 11.675 -9.838 -2.691 1.00 0.00 C ATOM 313 CG TRP A 21 10.643 -8.859 -2.235 1.00 0.00 C ATOM 314 CD1 TRP A 21 9.914 -8.966 -1.098 1.00 0.00 C ATOM 315 CD2 TRP A 21 10.210 -7.630 -2.887 1.00 0.00 C ATOM 316 NE1 TRP A 21 9.053 -7.884 -1.018 1.00 0.00 N ATOM 317 CE2 TRP A 21 9.200 -7.031 -2.095 1.00 0.00 C ATOM 318 CE3 TRP A 21 10.590 -6.983 -4.079 1.00 0.00 C ATOM 319 CZ2 TRP A 21 8.588 -5.833 -2.473 1.00 0.00 C ATOM 320 CZ3 TRP A 21 9.977 -5.777 -4.461 1.00 0.00 C ATOM 321 CH2 TRP A 21 8.978 -5.204 -3.659 1.00 0.00 C ATOM 0 H TRP A 21 9.384 -9.851 -4.083 1.00 0.00 H new ATOM 0 HA TRP A 21 11.728 -11.708 -3.771 1.00 0.00 H new ATOM 0 HB2 TRP A 21 12.284 -10.161 -1.847 1.00 0.00 H new ATOM 0 HB3 TRP A 21 12.348 -9.367 -3.408 1.00 0.00 H new ATOM 0 HD1 TRP A 21 9.991 -9.763 -0.374 1.00 0.00 H new ATOM 0 HE1 TRP A 21 8.391 -7.735 -0.257 1.00 0.00 H new ATOM 0 HE3 TRP A 21 11.357 -7.416 -4.704 1.00 0.00 H new ATOM 0 HZ2 TRP A 21 7.819 -5.396 -1.853 1.00 0.00 H new ATOM 0 HZ3 TRP A 21 10.276 -5.289 -5.377 1.00 0.00 H new ATOM 0 HH2 TRP A 21 8.511 -4.277 -3.958 1.00 0.00 H new ATOM 332 N HIS A 22 10.735 -11.949 -1.091 1.00 0.00 N ATOM 333 CA HIS A 22 10.025 -12.675 0.000 1.00 0.00 C ATOM 334 C HIS A 22 10.461 -12.081 1.339 1.00 0.00 C ATOM 335 O HIS A 22 11.449 -12.492 1.913 1.00 0.00 O ATOM 336 CB HIS A 22 10.392 -14.160 -0.049 1.00 0.00 C ATOM 337 CG HIS A 22 9.335 -14.964 0.656 1.00 0.00 C ATOM 338 ND1 HIS A 22 8.562 -15.908 -0.003 1.00 0.00 N ATOM 339 CD2 HIS A 22 8.912 -14.979 1.962 1.00 0.00 C ATOM 340 CE1 HIS A 22 7.723 -16.447 0.901 1.00 0.00 C ATOM 341 NE2 HIS A 22 7.894 -15.916 2.114 1.00 0.00 N ATOM 0 H HIS A 22 11.650 -11.579 -0.835 1.00 0.00 H new ATOM 0 HA HIS A 22 8.947 -12.573 -0.121 1.00 0.00 H new ATOM 0 HB2 HIS A 22 10.483 -14.489 -1.084 1.00 0.00 H new ATOM 0 HB3 HIS A 22 11.361 -14.321 0.423 1.00 0.00 H new ATOM 0 HD2 HIS A 22 9.309 -14.358 2.752 1.00 0.00 H new ATOM 0 HE1 HIS A 22 6.999 -17.216 0.673 1.00 0.00 H new ATOM 0 HE2 HIS A 22 7.387 -16.147 2.969 1.00 0.00 H new ATOM 349 N LEU A 23 9.740 -11.111 1.837 1.00 0.00 N ATOM 350 CA LEU A 23 10.126 -10.480 3.132 1.00 0.00 C ATOM 351 C LEU A 23 8.953 -10.543 4.118 1.00 0.00 C ATOM 352 O LEU A 23 8.017 -9.777 4.006 1.00 0.00 O ATOM 353 CB LEU A 23 10.498 -9.014 2.885 1.00 0.00 C ATOM 354 CG LEU A 23 11.147 -8.425 4.141 1.00 0.00 C ATOM 355 CD1 LEU A 23 12.441 -9.179 4.447 1.00 0.00 C ATOM 356 CD2 LEU A 23 11.460 -6.942 3.907 1.00 0.00 C ATOM 0 H LEU A 23 8.900 -10.729 1.402 1.00 0.00 H new ATOM 0 HA LEU A 23 10.976 -11.016 3.553 1.00 0.00 H new ATOM 0 HB2 LEU A 23 11.184 -8.941 2.041 1.00 0.00 H new ATOM 0 HB3 LEU A 23 9.608 -8.443 2.622 1.00 0.00 H new ATOM 0 HG LEU A 23 10.463 -8.522 4.984 1.00 0.00 H new ATOM 0 HD11 LEU A 23 12.903 -8.760 5.341 1.00 0.00 H new ATOM 0 HD12 LEU A 23 12.217 -10.233 4.614 1.00 0.00 H new ATOM 0 HD13 LEU A 23 13.126 -9.082 3.605 1.00 0.00 H new ATOM 0 HD21 LEU A 23 11.922 -6.522 4.801 1.00 0.00 H new ATOM 0 HD22 LEU A 23 12.144 -6.843 3.064 1.00 0.00 H new ATOM 0 HD23 LEU A 23 10.537 -6.405 3.690 1.00 0.00 H new ATOM 368 N PRO A 24 9.042 -11.446 5.065 1.00 0.00 N ATOM 369 CA PRO A 24 8.015 -11.668 6.140 1.00 0.00 C ATOM 370 C PRO A 24 8.016 -10.475 7.098 1.00 0.00 C ATOM 371 O PRO A 24 6.981 -10.032 7.556 1.00 0.00 O ATOM 372 CB PRO A 24 8.403 -12.944 6.882 1.00 0.00 C ATOM 373 CG PRO A 24 9.720 -13.428 6.314 1.00 0.00 C ATOM 374 CD PRO A 24 10.172 -12.422 5.262 1.00 0.00 C ATOM 0 HA PRO A 24 7.015 -11.765 5.717 1.00 0.00 H new ATOM 0 HB2 PRO A 24 8.496 -12.751 7.951 1.00 0.00 H new ATOM 0 HB3 PRO A 24 7.632 -13.705 6.761 1.00 0.00 H new ATOM 0 HG2 PRO A 24 10.467 -13.517 7.103 1.00 0.00 H new ATOM 0 HG3 PRO A 24 9.605 -14.417 5.872 1.00 0.00 H new ATOM 0 HD2 PRO A 24 11.075 -11.905 5.587 1.00 0.00 H new ATOM 0 HD3 PRO A 24 10.413 -12.926 4.326 1.00 0.00 H new ATOM 382 N ASP A 25 9.174 -9.949 7.397 1.00 0.00 N ATOM 383 CA ASP A 25 9.253 -8.780 8.319 1.00 0.00 C ATOM 384 C ASP A 25 8.518 -7.587 7.699 1.00 0.00 C ATOM 385 O ASP A 25 8.051 -6.705 8.395 1.00 0.00 O ATOM 386 CB ASP A 25 10.721 -8.412 8.547 1.00 0.00 C ATOM 387 CG ASP A 25 10.905 -7.899 9.976 1.00 0.00 C ATOM 388 OD1 ASP A 25 10.875 -8.713 10.885 1.00 0.00 O ATOM 389 OD2 ASP A 25 11.073 -6.701 10.138 1.00 0.00 O ATOM 0 H ASP A 25 10.071 -10.280 7.041 1.00 0.00 H new ATOM 0 HA ASP A 25 8.788 -9.036 9.271 1.00 0.00 H new ATOM 0 HB2 ASP A 25 11.355 -9.282 8.378 1.00 0.00 H new ATOM 0 HB3 ASP A 25 11.030 -7.649 7.833 1.00 0.00 H new ATOM 394 N ASP A 26 8.410 -7.553 6.396 1.00 0.00 N ATOM 395 CA ASP A 26 7.704 -6.419 5.736 1.00 0.00 C ATOM 396 C ASP A 26 6.196 -6.669 5.809 1.00 0.00 C ATOM 397 O ASP A 26 5.428 -5.781 6.122 1.00 0.00 O ATOM 398 CB ASP A 26 8.160 -6.315 4.275 1.00 0.00 C ATOM 399 CG ASP A 26 7.290 -5.308 3.513 1.00 0.00 C ATOM 400 OD1 ASP A 26 7.317 -4.134 3.858 1.00 0.00 O ATOM 401 OD2 ASP A 26 6.609 -5.732 2.598 1.00 0.00 O ATOM 0 H ASP A 26 8.780 -8.262 5.763 1.00 0.00 H new ATOM 0 HA ASP A 26 7.938 -5.482 6.241 1.00 0.00 H new ATOM 0 HB2 ASP A 26 9.205 -6.006 4.235 1.00 0.00 H new ATOM 0 HB3 ASP A 26 8.098 -7.293 3.798 1.00 0.00 H new ATOM 406 N LEU A 27 5.764 -7.876 5.533 1.00 0.00 N ATOM 407 CA LEU A 27 4.305 -8.183 5.599 1.00 0.00 C ATOM 408 C LEU A 27 3.766 -7.760 6.968 1.00 0.00 C ATOM 409 O LEU A 27 2.746 -7.108 7.069 1.00 0.00 O ATOM 410 CB LEU A 27 4.089 -9.686 5.407 1.00 0.00 C ATOM 411 CG LEU A 27 4.488 -10.083 3.984 1.00 0.00 C ATOM 412 CD1 LEU A 27 4.973 -11.535 3.976 1.00 0.00 C ATOM 413 CD2 LEU A 27 3.278 -9.942 3.053 1.00 0.00 C ATOM 0 H LEU A 27 6.360 -8.659 5.265 1.00 0.00 H new ATOM 0 HA LEU A 27 3.780 -7.641 4.813 1.00 0.00 H new ATOM 0 HB2 LEU A 27 4.682 -10.245 6.131 1.00 0.00 H new ATOM 0 HB3 LEU A 27 3.044 -9.940 5.587 1.00 0.00 H new ATOM 0 HG LEU A 27 5.289 -9.430 3.637 1.00 0.00 H new ATOM 0 HD11 LEU A 27 5.257 -11.818 2.963 1.00 0.00 H new ATOM 0 HD12 LEU A 27 5.835 -11.634 4.636 1.00 0.00 H new ATOM 0 HD13 LEU A 27 4.173 -12.188 4.324 1.00 0.00 H new ATOM 0 HD21 LEU A 27 3.564 -10.225 2.040 1.00 0.00 H new ATOM 0 HD22 LEU A 27 2.475 -10.593 3.399 1.00 0.00 H new ATOM 0 HD23 LEU A 27 2.934 -8.908 3.057 1.00 0.00 H new ATOM 425 N HIS A 28 4.457 -8.113 8.021 1.00 0.00 N ATOM 426 CA HIS A 28 3.998 -7.717 9.382 1.00 0.00 C ATOM 427 C HIS A 28 3.966 -6.191 9.463 1.00 0.00 C ATOM 428 O HIS A 28 3.067 -5.606 10.035 1.00 0.00 O ATOM 429 CB HIS A 28 4.968 -8.264 10.432 1.00 0.00 C ATOM 430 CG HIS A 28 4.931 -9.767 10.416 1.00 0.00 C ATOM 431 ND1 HIS A 28 3.744 -10.478 10.500 1.00 0.00 N ATOM 432 CD2 HIS A 28 5.926 -10.708 10.328 1.00 0.00 C ATOM 433 CE1 HIS A 28 4.052 -11.787 10.460 1.00 0.00 C ATOM 434 NE2 HIS A 28 5.369 -11.983 10.355 1.00 0.00 N ATOM 0 H HIS A 28 5.319 -8.658 7.995 1.00 0.00 H new ATOM 0 HA HIS A 28 3.004 -8.122 9.570 1.00 0.00 H new ATOM 0 HB2 HIS A 28 5.979 -7.913 10.226 1.00 0.00 H new ATOM 0 HB3 HIS A 28 4.697 -7.894 11.421 1.00 0.00 H new ATOM 0 HD2 HIS A 28 6.981 -10.492 10.250 1.00 0.00 H new ATOM 0 HE1 HIS A 28 3.323 -12.583 10.507 1.00 0.00 H new ATOM 0 HE2 HIS A 28 5.861 -12.875 10.305 1.00 0.00 H new ATOM 442 N TYR A 29 4.934 -5.543 8.870 1.00 0.00 N ATOM 443 CA TYR A 29 4.957 -4.054 8.883 1.00 0.00 C ATOM 444 C TYR A 29 3.737 -3.537 8.120 1.00 0.00 C ATOM 445 O TYR A 29 3.148 -2.535 8.470 1.00 0.00 O ATOM 446 CB TYR A 29 6.235 -3.557 8.201 1.00 0.00 C ATOM 447 CG TYR A 29 6.347 -2.060 8.363 1.00 0.00 C ATOM 448 CD1 TYR A 29 6.643 -1.512 9.616 1.00 0.00 C ATOM 449 CD2 TYR A 29 6.154 -1.220 7.259 1.00 0.00 C ATOM 450 CE1 TYR A 29 6.748 -0.124 9.766 1.00 0.00 C ATOM 451 CE2 TYR A 29 6.258 0.168 7.409 1.00 0.00 C ATOM 452 CZ TYR A 29 6.555 0.716 8.663 1.00 0.00 C ATOM 453 OH TYR A 29 6.658 2.084 8.810 1.00 0.00 O ATOM 0 H TYR A 29 5.711 -5.983 8.377 1.00 0.00 H new ATOM 0 HA TYR A 29 4.934 -3.691 9.910 1.00 0.00 H new ATOM 0 HB2 TYR A 29 7.106 -4.046 8.637 1.00 0.00 H new ATOM 0 HB3 TYR A 29 6.220 -3.818 7.143 1.00 0.00 H new ATOM 0 HD1 TYR A 29 6.790 -2.160 10.467 1.00 0.00 H new ATOM 0 HD2 TYR A 29 5.925 -1.643 6.292 1.00 0.00 H new ATOM 0 HE1 TYR A 29 6.978 0.299 10.733 1.00 0.00 H new ATOM 0 HE2 TYR A 29 6.109 0.816 6.558 1.00 0.00 H new ATOM 0 HH TYR A 29 6.497 2.519 7.947 1.00 0.00 H new ATOM 463 N PHE A 30 3.361 -4.225 7.074 1.00 0.00 N ATOM 464 CA PHE A 30 2.182 -3.795 6.270 1.00 0.00 C ATOM 465 C PHE A 30 0.904 -3.979 7.093 1.00 0.00 C ATOM 466 O PHE A 30 0.075 -3.094 7.177 1.00 0.00 O ATOM 467 CB PHE A 30 2.098 -4.640 4.993 1.00 0.00 C ATOM 468 CG PHE A 30 0.817 -4.321 4.257 1.00 0.00 C ATOM 469 CD1 PHE A 30 0.578 -3.019 3.805 1.00 0.00 C ATOM 470 CD2 PHE A 30 -0.133 -5.325 4.035 1.00 0.00 C ATOM 471 CE1 PHE A 30 -0.612 -2.719 3.131 1.00 0.00 C ATOM 472 CE2 PHE A 30 -1.322 -5.026 3.360 1.00 0.00 C ATOM 473 CZ PHE A 30 -1.562 -3.723 2.909 1.00 0.00 C ATOM 0 H PHE A 30 3.824 -5.071 6.741 1.00 0.00 H new ATOM 0 HA PHE A 30 2.290 -2.744 6.002 1.00 0.00 H new ATOM 0 HB2 PHE A 30 2.957 -4.437 4.353 1.00 0.00 H new ATOM 0 HB3 PHE A 30 2.131 -5.700 5.244 1.00 0.00 H new ATOM 0 HD1 PHE A 30 1.312 -2.245 3.976 1.00 0.00 H new ATOM 0 HD2 PHE A 30 0.052 -6.330 4.385 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -0.797 -1.714 2.783 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -2.054 -5.801 3.187 1.00 0.00 H new ATOM 0 HZ PHE A 30 -2.480 -3.492 2.390 1.00 0.00 H new ATOM 483 N ARG A 31 0.736 -5.123 7.699 1.00 0.00 N ATOM 484 CA ARG A 31 -0.491 -5.366 8.509 1.00 0.00 C ATOM 485 C ARG A 31 -0.529 -4.397 9.692 1.00 0.00 C ATOM 486 O ARG A 31 -1.409 -3.567 9.795 1.00 0.00 O ATOM 487 CB ARG A 31 -0.477 -6.805 9.030 1.00 0.00 C ATOM 488 CG ARG A 31 -1.913 -7.302 9.203 1.00 0.00 C ATOM 489 CD ARG A 31 -1.897 -8.735 9.738 1.00 0.00 C ATOM 490 NE ARG A 31 -1.397 -8.736 11.144 1.00 0.00 N ATOM 491 CZ ARG A 31 -1.346 -9.849 11.835 1.00 0.00 C ATOM 492 NH1 ARG A 31 -1.733 -10.982 11.307 1.00 0.00 N ATOM 493 NH2 ARG A 31 -0.906 -9.826 13.064 1.00 0.00 N ATOM 0 H ARG A 31 1.396 -5.900 7.668 1.00 0.00 H new ATOM 0 HA ARG A 31 -1.372 -5.209 7.887 1.00 0.00 H new ATOM 0 HB2 ARG A 31 0.060 -7.449 8.334 1.00 0.00 H new ATOM 0 HB3 ARG A 31 0.052 -6.853 9.982 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -2.454 -6.652 9.891 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -2.439 -7.265 8.249 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -2.899 -9.161 9.697 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -1.259 -9.361 9.114 1.00 0.00 H new ATOM 0 HE ARG A 31 -1.092 -7.862 11.572 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -2.079 -11.006 10.348 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -1.689 -11.841 11.855 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -0.604 -8.945 13.481 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -0.864 -10.689 13.607 1.00 0.00 H new ATOM 507 N ALA A 32 0.418 -4.507 10.589 1.00 0.00 N ATOM 508 CA ALA A 32 0.449 -3.608 11.784 1.00 0.00 C ATOM 509 C ALA A 32 0.245 -2.144 11.368 1.00 0.00 C ATOM 510 O ALA A 32 -0.408 -1.383 12.055 1.00 0.00 O ATOM 511 CB ALA A 32 1.803 -3.749 12.483 1.00 0.00 C ATOM 0 H ALA A 32 1.177 -5.187 10.545 1.00 0.00 H new ATOM 0 HA ALA A 32 -0.357 -3.895 12.460 1.00 0.00 H new ATOM 0 HB1 ALA A 32 1.832 -3.096 13.355 1.00 0.00 H new ATOM 0 HB2 ALA A 32 1.944 -4.783 12.799 1.00 0.00 H new ATOM 0 HB3 ALA A 32 2.599 -3.469 11.793 1.00 0.00 H new ATOM 517 N GLN A 33 0.809 -1.741 10.261 1.00 0.00 N ATOM 518 CA GLN A 33 0.657 -0.324 9.815 1.00 0.00 C ATOM 519 C GLN A 33 -0.775 -0.064 9.329 1.00 0.00 C ATOM 520 O GLN A 33 -1.193 1.070 9.196 1.00 0.00 O ATOM 521 CB GLN A 33 1.635 -0.047 8.673 1.00 0.00 C ATOM 522 CG GLN A 33 3.007 0.311 9.248 1.00 0.00 C ATOM 523 CD GLN A 33 3.000 1.767 9.717 1.00 0.00 C ATOM 524 OE1 GLN A 33 2.579 2.699 8.906 1.00 0.00 O flip ATOM 525 NE2 GLN A 33 3.382 2.060 10.832 1.00 0.00 N flip ATOM 0 H GLN A 33 1.369 -2.331 9.646 1.00 0.00 H new ATOM 0 HA GLN A 33 0.868 0.335 10.657 1.00 0.00 H new ATOM 0 HB2 GLN A 33 1.716 -0.923 8.030 1.00 0.00 H new ATOM 0 HB3 GLN A 33 1.265 0.770 8.054 1.00 0.00 H new ATOM 0 HG2 GLN A 33 3.247 -0.349 10.081 1.00 0.00 H new ATOM 0 HG3 GLN A 33 3.779 0.165 8.493 1.00 0.00 H new ATOM 0 HE21 GLN A 33 3.711 1.332 11.466 1.00 0.00 H new ATOM 0 HE22 GLN A 33 3.374 3.034 11.134 1.00 0.00 H new ATOM 534 N THR A 34 -1.525 -1.097 9.050 1.00 0.00 N ATOM 535 CA THR A 34 -2.921 -0.888 8.561 1.00 0.00 C ATOM 536 C THR A 34 -3.921 -1.563 9.502 1.00 0.00 C ATOM 537 O THR A 34 -4.973 -2.005 9.083 1.00 0.00 O ATOM 538 CB THR A 34 -3.063 -1.479 7.157 1.00 0.00 C ATOM 539 OG1 THR A 34 -2.838 -2.880 7.210 1.00 0.00 O ATOM 540 CG2 THR A 34 -2.042 -0.831 6.221 1.00 0.00 C ATOM 0 H THR A 34 -1.235 -2.071 9.138 1.00 0.00 H new ATOM 0 HA THR A 34 -3.129 0.182 8.534 1.00 0.00 H new ATOM 0 HB THR A 34 -4.068 -1.286 6.782 1.00 0.00 H new ATOM 0 HG1 THR A 34 -1.874 -3.057 7.202 1.00 0.00 H new ATOM 0 HG21 THR A 34 -2.145 -1.254 5.222 1.00 0.00 H new ATOM 0 HG22 THR A 34 -2.217 0.244 6.180 1.00 0.00 H new ATOM 0 HG23 THR A 34 -1.035 -1.021 6.593 1.00 0.00 H new ATOM 548 N VAL A 35 -3.612 -1.640 10.769 1.00 0.00 N ATOM 549 CA VAL A 35 -4.562 -2.282 11.725 1.00 0.00 C ATOM 550 C VAL A 35 -5.593 -1.253 12.193 1.00 0.00 C ATOM 551 O VAL A 35 -5.251 -0.189 12.670 1.00 0.00 O ATOM 552 CB VAL A 35 -3.803 -2.828 12.939 1.00 0.00 C ATOM 553 CG1 VAL A 35 -2.807 -3.892 12.482 1.00 0.00 C ATOM 554 CG2 VAL A 35 -3.050 -1.692 13.640 1.00 0.00 C ATOM 0 H VAL A 35 -2.748 -1.289 11.182 1.00 0.00 H new ATOM 0 HA VAL A 35 -5.067 -3.105 11.220 1.00 0.00 H new ATOM 0 HB VAL A 35 -4.516 -3.269 13.636 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -2.267 -4.280 13.346 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -3.343 -4.706 11.993 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -2.099 -3.450 11.780 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -2.513 -2.089 14.502 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -2.340 -1.243 12.945 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -3.761 -0.935 13.972 1.00 0.00 H new ATOM 564 N GLY A 36 -6.853 -1.572 12.072 1.00 0.00 N ATOM 565 CA GLY A 36 -7.914 -0.627 12.522 1.00 0.00 C ATOM 566 C GLY A 36 -8.050 0.542 11.541 1.00 0.00 C ATOM 567 O GLY A 36 -8.663 1.541 11.856 1.00 0.00 O ATOM 0 H GLY A 36 -7.194 -2.449 11.679 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -8.865 -1.153 12.603 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -7.673 -0.248 13.515 1.00 0.00 H new ATOM 571 N LYS A 37 -7.480 0.441 10.366 1.00 0.00 N ATOM 572 CA LYS A 37 -7.587 1.567 9.386 1.00 0.00 C ATOM 573 C LYS A 37 -8.178 1.056 8.066 1.00 0.00 C ATOM 574 O LYS A 37 -8.305 -0.134 7.856 1.00 0.00 O ATOM 575 CB LYS A 37 -6.196 2.150 9.128 1.00 0.00 C ATOM 576 CG LYS A 37 -5.706 2.882 10.379 1.00 0.00 C ATOM 577 CD LYS A 37 -4.372 3.570 10.079 1.00 0.00 C ATOM 578 CE LYS A 37 -4.627 5.012 9.632 1.00 0.00 C ATOM 579 NZ LYS A 37 -4.405 5.939 10.779 1.00 0.00 N ATOM 0 H LYS A 37 -6.948 -0.367 10.044 1.00 0.00 H new ATOM 0 HA LYS A 37 -8.239 2.338 9.796 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -5.500 1.354 8.864 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -6.230 2.837 8.282 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -6.444 3.619 10.695 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -5.587 2.178 11.202 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -3.739 3.560 10.966 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -3.838 3.026 9.300 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -3.962 5.271 8.808 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -5.647 5.113 9.262 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -4.579 6.918 10.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -5.057 5.697 11.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -3.424 5.850 11.113 1.00 0.00 H new ATOM 593 N ILE A 38 -8.542 1.948 7.174 1.00 0.00 N ATOM 594 CA ILE A 38 -9.122 1.506 5.869 1.00 0.00 C ATOM 595 C ILE A 38 -7.988 1.182 4.894 1.00 0.00 C ATOM 596 O ILE A 38 -7.158 2.018 4.602 1.00 0.00 O ATOM 597 CB ILE A 38 -9.978 2.626 5.276 1.00 0.00 C ATOM 598 CG1 ILE A 38 -11.000 3.103 6.308 1.00 0.00 C ATOM 599 CG2 ILE A 38 -10.714 2.105 4.041 1.00 0.00 C ATOM 600 CD1 ILE A 38 -11.663 4.385 5.802 1.00 0.00 C ATOM 0 H ILE A 38 -8.462 2.958 7.294 1.00 0.00 H new ATOM 0 HA ILE A 38 -9.738 0.622 6.034 1.00 0.00 H new ATOM 0 HB ILE A 38 -9.332 3.459 4.997 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -11.752 2.332 6.476 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -10.511 3.285 7.265 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -11.324 2.903 3.618 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -9.989 1.771 3.299 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -11.354 1.270 4.324 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -12.393 4.730 6.534 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -10.904 5.154 5.656 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -12.165 4.186 4.855 1.00 0.00 H new ATOM 612 N MET A 39 -7.939 -0.024 4.394 1.00 0.00 N ATOM 613 CA MET A 39 -6.850 -0.394 3.444 1.00 0.00 C ATOM 614 C MET A 39 -7.402 -0.460 2.016 1.00 0.00 C ATOM 615 O MET A 39 -8.232 -1.290 1.703 1.00 0.00 O ATOM 616 CB MET A 39 -6.283 -1.760 3.834 1.00 0.00 C ATOM 617 CG MET A 39 -5.098 -2.103 2.928 1.00 0.00 C ATOM 618 SD MET A 39 -5.074 -3.886 2.617 1.00 0.00 S ATOM 619 CE MET A 39 -4.644 -4.397 4.297 1.00 0.00 C ATOM 0 H MET A 39 -8.605 -0.768 4.602 1.00 0.00 H new ATOM 0 HA MET A 39 -6.063 0.359 3.488 1.00 0.00 H new ATOM 0 HB2 MET A 39 -5.965 -1.749 4.877 1.00 0.00 H new ATOM 0 HB3 MET A 39 -7.055 -2.524 3.745 1.00 0.00 H new ATOM 0 HG2 MET A 39 -5.177 -1.560 1.986 1.00 0.00 H new ATOM 0 HG3 MET A 39 -4.165 -1.792 3.398 1.00 0.00 H new ATOM 0 HE1 MET A 39 -4.028 -5.295 4.258 1.00 0.00 H new ATOM 0 HE2 MET A 39 -4.090 -3.598 4.790 1.00 0.00 H new ATOM 0 HE3 MET A 39 -5.555 -4.606 4.858 1.00 0.00 H new ATOM 629 N VAL A 40 -6.947 0.408 1.149 1.00 0.00 N ATOM 630 CA VAL A 40 -7.446 0.394 -0.258 1.00 0.00 C ATOM 631 C VAL A 40 -6.543 -0.502 -1.112 1.00 0.00 C ATOM 632 O VAL A 40 -5.372 -0.221 -1.312 1.00 0.00 O ATOM 633 CB VAL A 40 -7.433 1.817 -0.821 1.00 0.00 C ATOM 634 CG1 VAL A 40 -8.112 1.832 -2.193 1.00 0.00 C ATOM 635 CG2 VAL A 40 -8.189 2.747 0.132 1.00 0.00 C ATOM 0 H VAL A 40 -6.252 1.125 1.355 1.00 0.00 H new ATOM 0 HA VAL A 40 -8.465 0.007 -0.277 1.00 0.00 H new ATOM 0 HB VAL A 40 -6.403 2.158 -0.923 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -8.102 2.846 -2.593 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -7.575 1.169 -2.872 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -9.143 1.492 -2.093 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -8.181 3.761 -0.267 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -9.219 2.405 0.233 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -7.706 2.738 1.109 1.00 0.00 H new ATOM 645 N VAL A 41 -7.083 -1.585 -1.611 1.00 0.00 N ATOM 646 CA VAL A 41 -6.273 -2.518 -2.449 1.00 0.00 C ATOM 647 C VAL A 41 -6.994 -2.780 -3.776 1.00 0.00 C ATOM 648 O VAL A 41 -8.152 -3.152 -3.800 1.00 0.00 O ATOM 649 CB VAL A 41 -6.094 -3.848 -1.712 1.00 0.00 C ATOM 650 CG1 VAL A 41 -5.081 -3.677 -0.579 1.00 0.00 C ATOM 651 CG2 VAL A 41 -7.439 -4.299 -1.133 1.00 0.00 C ATOM 0 H VAL A 41 -8.054 -1.864 -1.473 1.00 0.00 H new ATOM 0 HA VAL A 41 -5.299 -2.067 -2.641 1.00 0.00 H new ATOM 0 HB VAL A 41 -5.729 -4.601 -2.411 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -4.956 -4.625 -0.057 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -4.123 -3.361 -0.992 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -5.441 -2.922 0.120 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -7.310 -5.246 -0.609 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -7.806 -3.545 -0.436 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -8.159 -4.427 -1.942 1.00 0.00 H new ATOM 661 N GLY A 42 -6.324 -2.578 -4.880 1.00 0.00 N ATOM 662 CA GLY A 42 -6.969 -2.804 -6.208 1.00 0.00 C ATOM 663 C GLY A 42 -7.489 -4.243 -6.318 1.00 0.00 C ATOM 664 O GLY A 42 -6.902 -5.173 -5.801 1.00 0.00 O ATOM 0 H GLY A 42 -5.354 -2.265 -4.920 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -7.793 -2.103 -6.342 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -6.251 -2.609 -7.005 1.00 0.00 H new ATOM 668 N ARG A 43 -8.600 -4.420 -6.987 1.00 0.00 N ATOM 669 CA ARG A 43 -9.205 -5.779 -7.148 1.00 0.00 C ATOM 670 C ARG A 43 -8.160 -6.807 -7.607 1.00 0.00 C ATOM 671 O ARG A 43 -8.336 -7.996 -7.419 1.00 0.00 O ATOM 672 CB ARG A 43 -10.320 -5.692 -8.197 1.00 0.00 C ATOM 673 CG ARG A 43 -10.980 -7.063 -8.378 1.00 0.00 C ATOM 674 CD ARG A 43 -10.450 -7.725 -9.654 1.00 0.00 C ATOM 675 NE ARG A 43 -10.910 -6.954 -10.850 1.00 0.00 N ATOM 676 CZ ARG A 43 -10.881 -7.497 -12.046 1.00 0.00 C ATOM 677 NH1 ARG A 43 -10.442 -8.718 -12.217 1.00 0.00 N ATOM 678 NH2 ARG A 43 -11.289 -6.810 -13.078 1.00 0.00 N ATOM 0 H ARG A 43 -9.123 -3.668 -7.436 1.00 0.00 H new ATOM 0 HA ARG A 43 -9.598 -6.104 -6.185 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -11.065 -4.959 -7.887 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -9.910 -5.349 -9.147 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -10.771 -7.695 -7.515 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -12.063 -6.952 -8.437 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -9.361 -7.763 -9.630 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -10.803 -8.754 -9.715 1.00 0.00 H new ATOM 0 HE ARG A 43 -11.249 -5.999 -10.736 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -10.117 -9.260 -11.416 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -10.425 -9.128 -13.151 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -11.628 -5.856 -12.954 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -11.268 -7.227 -14.009 1.00 0.00 H new ATOM 692 N ARG A 44 -7.082 -6.376 -8.204 1.00 0.00 N ATOM 693 CA ARG A 44 -6.050 -7.352 -8.664 1.00 0.00 C ATOM 694 C ARG A 44 -5.187 -7.789 -7.477 1.00 0.00 C ATOM 695 O ARG A 44 -4.908 -8.961 -7.300 1.00 0.00 O ATOM 696 CB ARG A 44 -5.171 -6.695 -9.728 1.00 0.00 C ATOM 697 CG ARG A 44 -5.584 -7.186 -11.120 1.00 0.00 C ATOM 698 CD ARG A 44 -4.562 -8.203 -11.636 1.00 0.00 C ATOM 699 NE ARG A 44 -5.196 -9.552 -11.707 1.00 0.00 N ATOM 700 CZ ARG A 44 -5.945 -9.891 -12.730 1.00 0.00 C ATOM 701 NH1 ARG A 44 -6.159 -9.054 -13.714 1.00 0.00 N ATOM 702 NH2 ARG A 44 -6.487 -11.078 -12.765 1.00 0.00 N ATOM 0 H ARG A 44 -6.871 -5.396 -8.393 1.00 0.00 H new ATOM 0 HA ARG A 44 -6.541 -8.228 -9.089 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -5.266 -5.611 -9.672 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -4.123 -6.933 -9.545 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -6.573 -7.641 -11.076 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -5.651 -6.343 -11.808 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -4.203 -7.906 -12.621 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -3.695 -8.231 -10.976 1.00 0.00 H new ATOM 0 HE ARG A 44 -5.045 -10.219 -10.951 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -5.741 -8.124 -13.692 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -6.744 -9.332 -14.502 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -6.327 -11.734 -12.001 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -7.070 -11.349 -13.557 1.00 0.00 H new ATOM 716 N THR A 45 -4.772 -6.863 -6.652 1.00 0.00 N ATOM 717 CA THR A 45 -3.938 -7.243 -5.475 1.00 0.00 C ATOM 718 C THR A 45 -4.802 -8.018 -4.478 1.00 0.00 C ATOM 719 O THR A 45 -4.435 -9.087 -4.029 1.00 0.00 O ATOM 720 CB THR A 45 -3.386 -5.984 -4.802 1.00 0.00 C ATOM 721 OG1 THR A 45 -2.871 -5.106 -5.793 1.00 0.00 O ATOM 722 CG2 THR A 45 -2.269 -6.374 -3.831 1.00 0.00 C ATOM 0 H THR A 45 -4.973 -5.867 -6.742 1.00 0.00 H new ATOM 0 HA THR A 45 -3.106 -7.865 -5.805 1.00 0.00 H new ATOM 0 HB THR A 45 -4.184 -5.483 -4.254 1.00 0.00 H new ATOM 0 HG1 THR A 45 -3.597 -4.818 -6.385 1.00 0.00 H new ATOM 0 HG21 THR A 45 -1.875 -5.478 -3.351 1.00 0.00 H new ATOM 0 HG22 THR A 45 -2.666 -7.048 -3.072 1.00 0.00 H new ATOM 0 HG23 THR A 45 -1.470 -6.874 -4.378 1.00 0.00 H new ATOM 730 N TYR A 46 -5.953 -7.497 -4.136 1.00 0.00 N ATOM 731 CA TYR A 46 -6.846 -8.212 -3.175 1.00 0.00 C ATOM 732 C TYR A 46 -7.113 -9.628 -3.688 1.00 0.00 C ATOM 733 O TYR A 46 -7.123 -10.581 -2.934 1.00 0.00 O ATOM 734 CB TYR A 46 -8.172 -7.460 -3.052 1.00 0.00 C ATOM 735 CG TYR A 46 -8.927 -7.962 -1.843 1.00 0.00 C ATOM 736 CD1 TYR A 46 -8.561 -7.537 -0.560 1.00 0.00 C ATOM 737 CD2 TYR A 46 -9.996 -8.849 -2.007 1.00 0.00 C ATOM 738 CE1 TYR A 46 -9.266 -7.998 0.557 1.00 0.00 C ATOM 739 CE2 TYR A 46 -10.701 -9.310 -0.889 1.00 0.00 C ATOM 740 CZ TYR A 46 -10.336 -8.884 0.393 1.00 0.00 C ATOM 741 OH TYR A 46 -11.031 -9.338 1.495 1.00 0.00 O ATOM 0 H TYR A 46 -6.313 -6.607 -4.481 1.00 0.00 H new ATOM 0 HA TYR A 46 -6.364 -8.260 -2.199 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -7.988 -6.390 -2.960 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -8.769 -7.605 -3.952 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -7.735 -6.853 -0.433 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -10.278 -9.178 -2.996 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -8.984 -7.670 1.546 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -11.527 -9.995 -1.016 1.00 0.00 H new ATOM 0 HH TYR A 46 -11.744 -9.945 1.205 1.00 0.00 H new ATOM 751 N GLU A 47 -7.322 -9.770 -4.970 1.00 0.00 N ATOM 752 CA GLU A 47 -7.582 -11.122 -5.541 1.00 0.00 C ATOM 753 C GLU A 47 -6.299 -11.959 -5.479 1.00 0.00 C ATOM 754 O GLU A 47 -6.333 -13.170 -5.579 1.00 0.00 O ATOM 755 CB GLU A 47 -8.034 -10.981 -6.996 1.00 0.00 C ATOM 756 CG GLU A 47 -9.548 -10.763 -7.040 1.00 0.00 C ATOM 757 CD GLU A 47 -10.123 -11.422 -8.295 1.00 0.00 C ATOM 758 OE1 GLU A 47 -10.042 -10.813 -9.349 1.00 0.00 O ATOM 759 OE2 GLU A 47 -10.635 -12.523 -8.181 1.00 0.00 O ATOM 0 H GLU A 47 -7.324 -9.007 -5.646 1.00 0.00 H new ATOM 0 HA GLU A 47 -8.364 -11.617 -4.965 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -7.521 -10.143 -7.468 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -7.768 -11.876 -7.559 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -10.013 -11.186 -6.149 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -9.772 -9.696 -7.041 1.00 0.00 H new ATOM 766 N SER A 48 -5.169 -11.322 -5.305 1.00 0.00 N ATOM 767 CA SER A 48 -3.886 -12.080 -5.225 1.00 0.00 C ATOM 768 C SER A 48 -3.478 -12.251 -3.755 1.00 0.00 C ATOM 769 O SER A 48 -2.642 -13.071 -3.429 1.00 0.00 O ATOM 770 CB SER A 48 -2.794 -11.316 -5.974 1.00 0.00 C ATOM 771 OG SER A 48 -2.913 -11.574 -7.367 1.00 0.00 O ATOM 0 H SER A 48 -5.080 -10.310 -5.215 1.00 0.00 H new ATOM 0 HA SER A 48 -4.018 -13.062 -5.679 1.00 0.00 H new ATOM 0 HB2 SER A 48 -2.884 -10.247 -5.781 1.00 0.00 H new ATOM 0 HB3 SER A 48 -1.810 -11.622 -5.618 1.00 0.00 H new ATOM 0 HG SER A 48 -2.453 -10.870 -7.871 1.00 0.00 H new ATOM 777 N PHE A 49 -4.058 -11.477 -2.867 1.00 0.00 N ATOM 778 CA PHE A 49 -3.708 -11.582 -1.413 1.00 0.00 C ATOM 779 C PHE A 49 -3.704 -13.056 -0.976 1.00 0.00 C ATOM 780 O PHE A 49 -4.376 -13.876 -1.571 1.00 0.00 O ATOM 781 CB PHE A 49 -4.757 -10.823 -0.591 1.00 0.00 C ATOM 782 CG PHE A 49 -4.185 -9.518 -0.084 1.00 0.00 C ATOM 783 CD1 PHE A 49 -4.191 -8.384 -0.904 1.00 0.00 C ATOM 784 CD2 PHE A 49 -3.665 -9.440 1.213 1.00 0.00 C ATOM 785 CE1 PHE A 49 -3.676 -7.173 -0.427 1.00 0.00 C ATOM 786 CE2 PHE A 49 -3.148 -8.230 1.688 1.00 0.00 C ATOM 787 CZ PHE A 49 -3.154 -7.096 0.869 1.00 0.00 C ATOM 0 H PHE A 49 -4.763 -10.773 -3.088 1.00 0.00 H new ATOM 0 HA PHE A 49 -2.718 -11.156 -1.251 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -5.637 -10.628 -1.204 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -5.083 -11.436 0.250 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -4.593 -8.443 -1.905 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -3.663 -10.314 1.847 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -3.682 -6.298 -1.060 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -2.744 -8.171 2.688 1.00 0.00 H new ATOM 0 HZ PHE A 49 -2.756 -6.162 1.237 1.00 0.00 H new ATOM 797 N PRO A 50 -2.951 -13.347 0.059 1.00 0.00 N ATOM 798 CA PRO A 50 -2.795 -14.709 0.671 1.00 0.00 C ATOM 799 C PRO A 50 -3.965 -14.991 1.619 1.00 0.00 C ATOM 800 O PRO A 50 -4.701 -15.942 1.447 1.00 0.00 O ATOM 801 CB PRO A 50 -1.482 -14.684 1.448 1.00 0.00 C ATOM 802 CG PRO A 50 -1.058 -13.234 1.572 1.00 0.00 C ATOM 803 CD PRO A 50 -2.096 -12.388 0.841 1.00 0.00 C ATOM 0 HA PRO A 50 -2.787 -15.490 -0.090 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -1.610 -15.132 2.433 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -0.718 -15.265 0.931 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -0.994 -12.942 2.620 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -0.069 -13.086 1.139 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -2.699 -11.817 1.547 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -1.614 -11.669 0.179 1.00 0.00 H new ATOM 811 N LYS A 51 -4.141 -14.166 2.619 1.00 0.00 N ATOM 812 CA LYS A 51 -5.262 -14.380 3.579 1.00 0.00 C ATOM 813 C LYS A 51 -6.225 -13.191 3.507 1.00 0.00 C ATOM 814 O LYS A 51 -5.837 -12.055 3.694 1.00 0.00 O ATOM 815 CB LYS A 51 -4.702 -14.501 5.002 1.00 0.00 C ATOM 816 CG LYS A 51 -4.822 -15.951 5.488 1.00 0.00 C ATOM 817 CD LYS A 51 -5.655 -15.999 6.774 1.00 0.00 C ATOM 818 CE LYS A 51 -4.992 -16.942 7.781 1.00 0.00 C ATOM 819 NZ LYS A 51 -6.041 -17.706 8.513 1.00 0.00 N ATOM 0 H LYS A 51 -3.556 -13.353 2.811 1.00 0.00 H new ATOM 0 HA LYS A 51 -5.794 -15.296 3.321 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -3.658 -14.188 5.019 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -5.246 -13.837 5.674 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -5.289 -16.565 4.718 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -3.831 -16.367 5.670 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -5.743 -14.999 7.200 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -6.666 -16.341 6.552 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -4.321 -17.629 7.265 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -4.385 -16.372 8.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -5.590 -18.347 9.197 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -6.664 -17.044 9.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -6.602 -18.262 7.836 1.00 0.00 H new ATOM 833 N ARG A 52 -7.478 -13.447 3.239 1.00 0.00 N ATOM 834 CA ARG A 52 -8.471 -12.335 3.159 1.00 0.00 C ATOM 835 C ARG A 52 -9.786 -12.778 3.814 1.00 0.00 C ATOM 836 O ARG A 52 -10.254 -13.873 3.568 1.00 0.00 O ATOM 837 CB ARG A 52 -8.745 -11.979 1.693 1.00 0.00 C ATOM 838 CG ARG A 52 -7.427 -11.766 0.940 1.00 0.00 C ATOM 839 CD ARG A 52 -7.273 -12.844 -0.135 1.00 0.00 C ATOM 840 NE ARG A 52 -8.340 -12.671 -1.163 1.00 0.00 N ATOM 841 CZ ARG A 52 -8.429 -13.492 -2.181 1.00 0.00 C ATOM 842 NH1 ARG A 52 -7.582 -14.481 -2.319 1.00 0.00 N ATOM 843 NH2 ARG A 52 -9.372 -13.322 -3.067 1.00 0.00 N ATOM 0 H ARG A 52 -7.857 -14.379 3.072 1.00 0.00 H new ATOM 0 HA ARG A 52 -8.068 -11.464 3.676 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -9.317 -12.777 1.219 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -9.352 -11.076 1.639 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -7.413 -10.777 0.483 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -6.588 -11.808 1.635 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -6.290 -12.773 -0.600 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -7.342 -13.835 0.314 1.00 0.00 H new ATOM 0 HE ARG A 52 -9.008 -11.905 -1.073 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -6.843 -14.619 -1.630 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -7.662 -15.113 -3.115 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -10.035 -12.553 -2.965 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -9.446 -13.958 -3.861 1.00 0.00 H new ATOM 857 N PRO A 53 -10.359 -11.911 4.616 1.00 0.00 N ATOM 858 CA PRO A 53 -9.855 -10.543 4.977 1.00 0.00 C ATOM 859 C PRO A 53 -8.929 -10.633 6.195 1.00 0.00 C ATOM 860 O PRO A 53 -8.762 -11.683 6.782 1.00 0.00 O ATOM 861 CB PRO A 53 -11.095 -9.725 5.324 1.00 0.00 C ATOM 862 CG PRO A 53 -12.218 -10.712 5.586 1.00 0.00 C ATOM 863 CD PRO A 53 -11.661 -12.111 5.332 1.00 0.00 C ATOM 0 HA PRO A 53 -9.288 -10.092 4.163 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -10.914 -9.104 6.202 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -11.355 -9.053 4.506 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -12.578 -10.622 6.611 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -13.066 -10.511 4.932 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -11.513 -12.649 6.269 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -12.351 -12.703 4.730 1.00 0.00 H new ATOM 871 N LEU A 54 -8.328 -9.538 6.575 1.00 0.00 N ATOM 872 CA LEU A 54 -7.413 -9.557 7.752 1.00 0.00 C ATOM 873 C LEU A 54 -8.236 -9.512 9.046 1.00 0.00 C ATOM 874 O LEU A 54 -9.352 -9.032 9.052 1.00 0.00 O ATOM 875 CB LEU A 54 -6.486 -8.344 7.691 1.00 0.00 C ATOM 876 CG LEU A 54 -5.581 -8.462 6.465 1.00 0.00 C ATOM 877 CD1 LEU A 54 -5.418 -7.088 5.816 1.00 0.00 C ATOM 878 CD2 LEU A 54 -4.210 -8.991 6.893 1.00 0.00 C ATOM 0 H LEU A 54 -8.431 -8.631 6.121 1.00 0.00 H new ATOM 0 HA LEU A 54 -6.819 -10.471 7.737 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -7.072 -7.426 7.638 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -5.884 -8.286 8.598 1.00 0.00 H new ATOM 0 HG LEU A 54 -6.029 -9.150 5.748 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -4.773 -7.173 4.942 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -6.394 -6.712 5.511 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -4.971 -6.398 6.532 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -3.564 -9.076 6.019 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -3.762 -8.303 7.610 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -4.326 -9.972 7.355 1.00 0.00 H new ATOM 890 N PRO A 55 -7.653 -10.018 10.106 1.00 0.00 N ATOM 891 CA PRO A 55 -8.261 -10.088 11.481 1.00 0.00 C ATOM 892 C PRO A 55 -8.430 -8.680 12.062 1.00 0.00 C ATOM 893 O PRO A 55 -7.482 -7.931 12.187 1.00 0.00 O ATOM 894 CB PRO A 55 -7.312 -10.903 12.355 1.00 0.00 C ATOM 895 CG PRO A 55 -6.072 -11.202 11.542 1.00 0.00 C ATOM 896 CD PRO A 55 -6.273 -10.621 10.147 1.00 0.00 C ATOM 0 HA PRO A 55 -9.246 -10.552 11.440 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -7.052 -10.348 13.257 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -7.790 -11.828 12.677 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -5.192 -10.765 12.014 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -5.903 -12.277 11.486 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -5.517 -9.865 9.933 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -6.171 -11.398 9.389 1.00 0.00 H new ATOM 904 N GLU A 56 -9.635 -8.327 12.431 1.00 0.00 N ATOM 905 CA GLU A 56 -9.888 -6.977 13.022 1.00 0.00 C ATOM 906 C GLU A 56 -9.266 -5.885 12.143 1.00 0.00 C ATOM 907 O GLU A 56 -8.608 -4.985 12.627 1.00 0.00 O ATOM 908 CB GLU A 56 -9.276 -6.915 14.425 1.00 0.00 C ATOM 909 CG GLU A 56 -10.354 -7.224 15.469 1.00 0.00 C ATOM 910 CD GLU A 56 -10.230 -6.245 16.639 1.00 0.00 C ATOM 911 OE1 GLU A 56 -10.488 -5.071 16.433 1.00 0.00 O ATOM 912 OE2 GLU A 56 -9.879 -6.687 17.720 1.00 0.00 O ATOM 0 H GLU A 56 -10.461 -8.920 12.348 1.00 0.00 H new ATOM 0 HA GLU A 56 -10.964 -6.811 13.080 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -8.459 -7.631 14.508 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -8.853 -5.927 14.605 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -11.344 -7.145 15.019 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -10.246 -8.248 15.826 1.00 0.00 H new ATOM 919 N ARG A 57 -9.469 -5.959 10.856 1.00 0.00 N ATOM 920 CA ARG A 57 -8.889 -4.925 9.953 1.00 0.00 C ATOM 921 C ARG A 57 -9.893 -4.568 8.860 1.00 0.00 C ATOM 922 O ARG A 57 -10.473 -5.431 8.230 1.00 0.00 O ATOM 923 CB ARG A 57 -7.615 -5.466 9.305 1.00 0.00 C ATOM 924 CG ARG A 57 -6.407 -5.141 10.184 1.00 0.00 C ATOM 925 CD ARG A 57 -5.646 -6.426 10.511 1.00 0.00 C ATOM 926 NE ARG A 57 -5.283 -6.420 11.953 1.00 0.00 N ATOM 927 CZ ARG A 57 -4.610 -7.414 12.481 1.00 0.00 C ATOM 928 NH1 ARG A 57 -4.236 -8.431 11.748 1.00 0.00 N ATOM 929 NH2 ARG A 57 -4.307 -7.386 13.750 1.00 0.00 N ATOM 0 H ARG A 57 -10.010 -6.689 10.392 1.00 0.00 H new ATOM 0 HA ARG A 57 -8.656 -4.035 10.537 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -7.696 -6.544 9.167 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -7.485 -5.027 8.316 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -5.750 -4.439 9.671 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -6.734 -4.657 11.104 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -6.261 -7.296 10.281 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -4.748 -6.499 9.897 1.00 0.00 H new ATOM 0 HE ARG A 57 -5.561 -5.633 12.539 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -4.467 -8.456 10.755 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -3.713 -9.198 12.170 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -4.593 -6.594 14.325 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -3.784 -8.156 14.167 1.00 0.00 H new ATOM 943 N THR A 58 -10.092 -3.300 8.622 1.00 0.00 N ATOM 944 CA THR A 58 -11.047 -2.883 7.561 1.00 0.00 C ATOM 945 C THR A 58 -10.289 -2.751 6.239 1.00 0.00 C ATOM 946 O THR A 58 -9.371 -1.964 6.117 1.00 0.00 O ATOM 947 CB THR A 58 -11.671 -1.535 7.933 1.00 0.00 C ATOM 948 OG1 THR A 58 -12.029 -1.545 9.308 1.00 0.00 O ATOM 949 CG2 THR A 58 -12.918 -1.295 7.081 1.00 0.00 C ATOM 0 H THR A 58 -9.633 -2.536 9.118 1.00 0.00 H new ATOM 0 HA THR A 58 -11.838 -3.626 7.461 1.00 0.00 H new ATOM 0 HB THR A 58 -10.951 -0.738 7.750 1.00 0.00 H new ATOM 0 HG1 THR A 58 -12.994 -1.396 9.396 1.00 0.00 H new ATOM 0 HG21 THR A 58 -13.361 -0.335 7.347 1.00 0.00 H new ATOM 0 HG22 THR A 58 -12.642 -1.288 6.026 1.00 0.00 H new ATOM 0 HG23 THR A 58 -13.641 -2.091 7.262 1.00 0.00 H new ATOM 957 N ASN A 59 -10.669 -3.511 5.250 1.00 0.00 N ATOM 958 CA ASN A 59 -9.974 -3.429 3.933 1.00 0.00 C ATOM 959 C ASN A 59 -11.008 -3.095 2.856 1.00 0.00 C ATOM 960 O ASN A 59 -12.153 -3.491 2.949 1.00 0.00 O ATOM 961 CB ASN A 59 -9.307 -4.774 3.604 1.00 0.00 C ATOM 962 CG ASN A 59 -8.834 -5.465 4.891 1.00 0.00 C ATOM 963 OD1 ASN A 59 -8.236 -4.767 5.819 1.00 0.00 O flip ATOM 964 ND2 ASN A 59 -9.006 -6.657 5.050 1.00 0.00 N flip ATOM 0 H ASN A 59 -11.432 -4.187 5.296 1.00 0.00 H new ATOM 0 HA ASN A 59 -9.206 -2.657 3.971 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -10.011 -5.417 3.076 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -8.460 -4.614 2.937 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -9.473 -7.206 4.328 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -8.684 -7.109 5.906 1.00 0.00 H new ATOM 971 N VAL A 60 -10.625 -2.367 1.839 1.00 0.00 N ATOM 972 CA VAL A 60 -11.605 -2.013 0.772 1.00 0.00 C ATOM 973 C VAL A 60 -11.058 -2.439 -0.593 1.00 0.00 C ATOM 974 O VAL A 60 -9.896 -2.252 -0.894 1.00 0.00 O ATOM 975 CB VAL A 60 -11.842 -0.500 0.776 1.00 0.00 C ATOM 976 CG1 VAL A 60 -12.952 -0.153 -0.218 1.00 0.00 C ATOM 977 CG2 VAL A 60 -12.259 -0.047 2.178 1.00 0.00 C ATOM 0 H VAL A 60 -9.681 -2.005 1.702 1.00 0.00 H new ATOM 0 HA VAL A 60 -12.546 -2.530 0.962 1.00 0.00 H new ATOM 0 HB VAL A 60 -10.921 0.008 0.489 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -13.120 0.924 -0.214 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -12.657 -0.471 -1.218 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -13.871 -0.664 0.069 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -12.427 1.030 2.177 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -13.178 -0.557 2.467 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -11.470 -0.291 2.889 1.00 0.00 H new ATOM 987 N VAL A 61 -11.890 -3.021 -1.416 1.00 0.00 N ATOM 988 CA VAL A 61 -11.427 -3.472 -2.761 1.00 0.00 C ATOM 989 C VAL A 61 -11.833 -2.440 -3.815 1.00 0.00 C ATOM 990 O VAL A 61 -12.842 -1.775 -3.689 1.00 0.00 O ATOM 991 CB VAL A 61 -12.084 -4.814 -3.099 1.00 0.00 C ATOM 992 CG1 VAL A 61 -11.444 -5.396 -4.360 1.00 0.00 C ATOM 993 CG2 VAL A 61 -11.897 -5.790 -1.933 1.00 0.00 C ATOM 0 H VAL A 61 -12.873 -3.204 -1.214 1.00 0.00 H new ATOM 0 HA VAL A 61 -10.342 -3.581 -2.752 1.00 0.00 H new ATOM 0 HB VAL A 61 -13.149 -4.658 -3.272 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -11.913 -6.351 -4.599 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -11.584 -4.705 -5.191 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -10.378 -5.548 -4.190 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -12.366 -6.743 -2.178 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -10.833 -5.944 -1.755 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -12.359 -5.378 -1.036 1.00 0.00 H new ATOM 1003 N LEU A 62 -11.056 -2.306 -4.857 1.00 0.00 N ATOM 1004 CA LEU A 62 -11.400 -1.323 -5.923 1.00 0.00 C ATOM 1005 C LEU A 62 -11.556 -2.060 -7.256 1.00 0.00 C ATOM 1006 O LEU A 62 -10.664 -2.757 -7.699 1.00 0.00 O ATOM 1007 CB LEU A 62 -10.291 -0.271 -6.033 1.00 0.00 C ATOM 1008 CG LEU A 62 -10.787 1.050 -5.438 1.00 0.00 C ATOM 1009 CD1 LEU A 62 -10.874 0.920 -3.917 1.00 0.00 C ATOM 1010 CD2 LEU A 62 -9.815 2.181 -5.799 1.00 0.00 C ATOM 0 H LEU A 62 -10.198 -2.835 -5.015 1.00 0.00 H new ATOM 0 HA LEU A 62 -12.336 -0.824 -5.674 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -9.399 -0.609 -5.505 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -10.009 -0.130 -7.077 1.00 0.00 H new ATOM 0 HG LEU A 62 -11.772 1.280 -5.844 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -11.227 1.859 -3.491 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -11.569 0.121 -3.659 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -9.888 0.687 -3.515 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -10.173 3.118 -5.373 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -8.827 1.954 -5.398 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -9.753 2.275 -6.883 1.00 0.00 H new ATOM 1022 N THR A 63 -12.690 -1.917 -7.889 1.00 0.00 N ATOM 1023 CA THR A 63 -12.913 -2.618 -9.189 1.00 0.00 C ATOM 1024 C THR A 63 -13.831 -1.785 -10.088 1.00 0.00 C ATOM 1025 O THR A 63 -14.554 -0.923 -9.628 1.00 0.00 O ATOM 1026 CB THR A 63 -13.563 -3.982 -8.925 1.00 0.00 C ATOM 1027 OG1 THR A 63 -13.722 -4.674 -10.155 1.00 0.00 O ATOM 1028 CG2 THR A 63 -14.933 -3.787 -8.268 1.00 0.00 C ATOM 0 H THR A 63 -13.470 -1.347 -7.564 1.00 0.00 H new ATOM 0 HA THR A 63 -11.954 -2.754 -9.689 1.00 0.00 H new ATOM 0 HB THR A 63 -12.925 -4.562 -8.258 1.00 0.00 H new ATOM 0 HG1 THR A 63 -12.841 -4.883 -10.529 1.00 0.00 H new ATOM 0 HG21 THR A 63 -15.390 -4.759 -8.083 1.00 0.00 H new ATOM 0 HG22 THR A 63 -14.811 -3.258 -7.323 1.00 0.00 H new ATOM 0 HG23 THR A 63 -15.574 -3.205 -8.930 1.00 0.00 H new ATOM 1036 N HIS A 64 -13.808 -2.046 -11.368 1.00 0.00 N ATOM 1037 CA HIS A 64 -14.679 -1.284 -12.307 1.00 0.00 C ATOM 1038 C HIS A 64 -15.960 -2.080 -12.588 1.00 0.00 C ATOM 1039 O HIS A 64 -16.802 -1.658 -13.357 1.00 0.00 O ATOM 1040 CB HIS A 64 -13.932 -1.048 -13.622 1.00 0.00 C ATOM 1041 CG HIS A 64 -13.273 0.304 -13.591 1.00 0.00 C ATOM 1042 ND1 HIS A 64 -13.923 1.452 -14.016 1.00 0.00 N ATOM 1043 CD2 HIS A 64 -12.023 0.708 -13.190 1.00 0.00 C ATOM 1044 CE1 HIS A 64 -13.071 2.481 -13.862 1.00 0.00 C ATOM 1045 NE2 HIS A 64 -11.898 2.083 -13.362 1.00 0.00 N ATOM 0 H HIS A 64 -13.221 -2.757 -11.804 1.00 0.00 H new ATOM 0 HA HIS A 64 -14.939 -0.326 -11.856 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -13.183 -1.826 -13.771 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -14.625 -1.107 -14.461 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -11.254 0.057 -12.800 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -13.307 3.505 -14.112 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -11.085 2.662 -13.152 1.00 0.00 H new ATOM 1053 N GLN A 65 -16.115 -3.229 -11.978 1.00 0.00 N ATOM 1054 CA GLN A 65 -17.341 -4.042 -12.219 1.00 0.00 C ATOM 1055 C GLN A 65 -18.526 -3.394 -11.502 1.00 0.00 C ATOM 1056 O GLN A 65 -18.376 -2.413 -10.800 1.00 0.00 O ATOM 1057 CB GLN A 65 -17.131 -5.460 -11.681 1.00 0.00 C ATOM 1058 CG GLN A 65 -16.274 -6.259 -12.664 1.00 0.00 C ATOM 1059 CD GLN A 65 -14.794 -6.009 -12.371 1.00 0.00 C ATOM 1060 OE1 GLN A 65 -14.164 -6.774 -11.668 1.00 0.00 O ATOM 1061 NE2 GLN A 65 -14.209 -4.962 -12.884 1.00 0.00 N ATOM 0 H GLN A 65 -15.445 -3.636 -11.325 1.00 0.00 H new ATOM 0 HA GLN A 65 -17.542 -4.089 -13.289 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -16.645 -5.422 -10.706 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -18.093 -5.952 -11.538 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -16.498 -7.322 -12.577 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -16.507 -5.966 -13.688 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -14.738 -4.320 -13.474 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -13.222 -4.785 -12.695 1.00 0.00 H new ATOM 1070 N GLU A 66 -19.702 -3.932 -11.676 1.00 0.00 N ATOM 1071 CA GLU A 66 -20.897 -3.343 -11.006 1.00 0.00 C ATOM 1072 C GLU A 66 -21.506 -4.360 -10.035 1.00 0.00 C ATOM 1073 O GLU A 66 -22.177 -3.996 -9.089 1.00 0.00 O ATOM 1074 CB GLU A 66 -21.936 -2.965 -12.067 1.00 0.00 C ATOM 1075 CG GLU A 66 -22.050 -1.440 -12.157 1.00 0.00 C ATOM 1076 CD GLU A 66 -21.185 -0.929 -13.310 1.00 0.00 C ATOM 1077 OE1 GLU A 66 -21.684 -0.880 -14.423 1.00 0.00 O ATOM 1078 OE2 GLU A 66 -20.039 -0.595 -13.062 1.00 0.00 O ATOM 0 H GLU A 66 -19.887 -4.753 -12.252 1.00 0.00 H new ATOM 0 HA GLU A 66 -20.597 -2.455 -10.450 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -21.648 -3.376 -13.035 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -22.904 -3.397 -11.813 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -23.089 -1.151 -12.313 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -21.730 -0.985 -11.220 1.00 0.00 H new ATOM 1085 N ASP A 67 -21.293 -5.629 -10.265 1.00 0.00 N ATOM 1086 CA ASP A 67 -21.878 -6.657 -9.356 1.00 0.00 C ATOM 1087 C ASP A 67 -20.777 -7.332 -8.533 1.00 0.00 C ATOM 1088 O ASP A 67 -20.887 -8.488 -8.175 1.00 0.00 O ATOM 1089 CB ASP A 67 -22.607 -7.713 -10.190 1.00 0.00 C ATOM 1090 CG ASP A 67 -24.092 -7.354 -10.284 1.00 0.00 C ATOM 1091 OD1 ASP A 67 -24.419 -6.469 -11.057 1.00 0.00 O ATOM 1092 OD2 ASP A 67 -24.876 -7.971 -9.581 1.00 0.00 O ATOM 0 H ASP A 67 -20.741 -5.997 -11.040 1.00 0.00 H new ATOM 0 HA ASP A 67 -22.577 -6.170 -8.676 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -22.171 -7.768 -11.188 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -22.488 -8.697 -9.736 1.00 0.00 H new ATOM 1097 N TYR A 68 -19.719 -6.627 -8.221 1.00 0.00 N ATOM 1098 CA TYR A 68 -18.627 -7.248 -7.412 1.00 0.00 C ATOM 1099 C TYR A 68 -19.199 -7.711 -6.069 1.00 0.00 C ATOM 1100 O TYR A 68 -19.682 -6.918 -5.285 1.00 0.00 O ATOM 1101 CB TYR A 68 -17.511 -6.227 -7.170 1.00 0.00 C ATOM 1102 CG TYR A 68 -16.201 -6.957 -6.984 1.00 0.00 C ATOM 1103 CD1 TYR A 68 -15.440 -7.325 -8.100 1.00 0.00 C ATOM 1104 CD2 TYR A 68 -15.754 -7.277 -5.696 1.00 0.00 C ATOM 1105 CE1 TYR A 68 -14.233 -8.013 -7.928 1.00 0.00 C ATOM 1106 CE2 TYR A 68 -14.546 -7.964 -5.524 1.00 0.00 C ATOM 1107 CZ TYR A 68 -13.786 -8.332 -6.641 1.00 0.00 C ATOM 1108 OH TYR A 68 -12.596 -9.011 -6.472 1.00 0.00 O ATOM 0 H TYR A 68 -19.565 -5.655 -8.489 1.00 0.00 H new ATOM 0 HA TYR A 68 -18.216 -8.101 -7.952 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -17.441 -5.540 -8.013 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -17.735 -5.627 -6.288 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -15.784 -7.078 -9.094 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -16.341 -6.994 -4.835 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -13.647 -8.298 -8.789 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -14.201 -8.210 -4.531 1.00 0.00 H new ATOM 0 HH TYR A 68 -12.433 -9.152 -5.516 1.00 0.00 H new ATOM 1118 N GLN A 69 -19.149 -8.989 -5.796 1.00 0.00 N ATOM 1119 CA GLN A 69 -19.692 -9.501 -4.504 1.00 0.00 C ATOM 1120 C GLN A 69 -18.539 -9.853 -3.562 1.00 0.00 C ATOM 1121 O GLN A 69 -17.783 -10.772 -3.809 1.00 0.00 O ATOM 1122 CB GLN A 69 -20.536 -10.751 -4.763 1.00 0.00 C ATOM 1123 CG GLN A 69 -21.733 -10.387 -5.644 1.00 0.00 C ATOM 1124 CD GLN A 69 -22.830 -9.759 -4.783 1.00 0.00 C ATOM 1125 OE1 GLN A 69 -23.245 -10.331 -3.794 1.00 0.00 O ATOM 1126 NE2 GLN A 69 -23.323 -8.599 -5.120 1.00 0.00 N ATOM 0 H GLN A 69 -18.755 -9.700 -6.413 1.00 0.00 H new ATOM 0 HA GLN A 69 -20.312 -8.731 -4.045 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -19.932 -11.516 -5.251 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -20.881 -11.172 -3.818 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -21.425 -9.691 -6.424 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -22.114 -11.278 -6.144 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -22.975 -8.119 -5.950 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -24.056 -8.173 -4.554 1.00 0.00 H new ATOM 1135 N ALA A 70 -18.405 -9.136 -2.479 1.00 0.00 N ATOM 1136 CA ALA A 70 -17.307 -9.433 -1.515 1.00 0.00 C ATOM 1137 C ALA A 70 -17.839 -9.310 -0.087 1.00 0.00 C ATOM 1138 O ALA A 70 -17.764 -8.262 0.524 1.00 0.00 O ATOM 1139 CB ALA A 70 -16.162 -8.441 -1.722 1.00 0.00 C ATOM 0 H ALA A 70 -19.009 -8.356 -2.220 1.00 0.00 H new ATOM 0 HA ALA A 70 -16.941 -10.446 -1.681 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -15.360 -8.659 -1.017 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -15.784 -8.529 -2.740 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -16.525 -7.427 -1.556 1.00 0.00 H new ATOM 1145 N GLN A 71 -18.378 -10.373 0.449 1.00 0.00 N ATOM 1146 CA GLN A 71 -18.917 -10.319 1.838 1.00 0.00 C ATOM 1147 C GLN A 71 -17.757 -10.238 2.831 1.00 0.00 C ATOM 1148 O GLN A 71 -16.895 -11.095 2.863 1.00 0.00 O ATOM 1149 CB GLN A 71 -19.740 -11.578 2.117 1.00 0.00 C ATOM 1150 CG GLN A 71 -21.059 -11.512 1.340 1.00 0.00 C ATOM 1151 CD GLN A 71 -22.233 -11.699 2.304 1.00 0.00 C ATOM 1152 OE1 GLN A 71 -22.735 -12.795 2.463 1.00 0.00 O ATOM 1153 NE2 GLN A 71 -22.696 -10.669 2.957 1.00 0.00 N ATOM 0 H GLN A 71 -18.468 -11.276 -0.016 1.00 0.00 H new ATOM 0 HA GLN A 71 -19.552 -9.440 1.947 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -19.178 -12.465 1.824 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -19.939 -11.665 3.185 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -21.144 -10.553 0.829 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -21.079 -12.285 0.572 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -22.275 -9.749 2.824 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -23.479 -10.783 3.601 1.00 0.00 H new ATOM 1162 N GLY A 72 -17.732 -9.217 3.642 1.00 0.00 N ATOM 1163 CA GLY A 72 -16.631 -9.080 4.636 1.00 0.00 C ATOM 1164 C GLY A 72 -15.683 -7.961 4.202 1.00 0.00 C ATOM 1165 O GLY A 72 -15.154 -7.235 5.022 1.00 0.00 O ATOM 0 H GLY A 72 -18.427 -8.471 3.659 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -17.042 -8.860 5.621 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -16.085 -10.020 4.721 1.00 0.00 H new ATOM 1169 N ALA A 73 -15.457 -7.816 2.922 1.00 0.00 N ATOM 1170 CA ALA A 73 -14.536 -6.745 2.445 1.00 0.00 C ATOM 1171 C ALA A 73 -15.338 -5.629 1.766 1.00 0.00 C ATOM 1172 O ALA A 73 -16.278 -5.876 1.037 1.00 0.00 O ATOM 1173 CB ALA A 73 -13.541 -7.338 1.447 1.00 0.00 C ATOM 0 H ALA A 73 -15.870 -8.392 2.189 1.00 0.00 H new ATOM 0 HA ALA A 73 -13.998 -6.330 3.297 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -12.867 -6.556 1.097 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -12.964 -8.125 1.933 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -14.082 -7.757 0.599 1.00 0.00 H new ATOM 1179 N VAL A 74 -14.964 -4.403 2.010 1.00 0.00 N ATOM 1180 CA VAL A 74 -15.690 -3.251 1.394 1.00 0.00 C ATOM 1181 C VAL A 74 -15.517 -3.280 -0.127 1.00 0.00 C ATOM 1182 O VAL A 74 -14.473 -3.637 -0.638 1.00 0.00 O ATOM 1183 CB VAL A 74 -15.124 -1.935 1.935 1.00 0.00 C ATOM 1184 CG1 VAL A 74 -16.023 -0.772 1.501 1.00 0.00 C ATOM 1185 CG2 VAL A 74 -15.057 -1.991 3.466 1.00 0.00 C ATOM 0 H VAL A 74 -14.182 -4.146 2.613 1.00 0.00 H new ATOM 0 HA VAL A 74 -16.748 -3.327 1.643 1.00 0.00 H new ATOM 0 HB VAL A 74 -14.121 -1.784 1.537 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -15.619 0.164 1.887 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -16.062 -0.729 0.413 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -17.028 -0.923 1.895 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -14.654 -1.053 3.847 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -16.058 -2.146 3.869 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -14.412 -2.814 3.772 1.00 0.00 H new ATOM 1195 N VAL A 75 -16.539 -2.905 -0.853 1.00 0.00 N ATOM 1196 CA VAL A 75 -16.442 -2.905 -2.343 1.00 0.00 C ATOM 1197 C VAL A 75 -16.817 -1.523 -2.887 1.00 0.00 C ATOM 1198 O VAL A 75 -17.852 -0.977 -2.556 1.00 0.00 O ATOM 1199 CB VAL A 75 -17.398 -3.951 -2.920 1.00 0.00 C ATOM 1200 CG1 VAL A 75 -17.176 -4.068 -4.430 1.00 0.00 C ATOM 1201 CG2 VAL A 75 -17.134 -5.307 -2.258 1.00 0.00 C ATOM 0 H VAL A 75 -17.437 -2.599 -0.478 1.00 0.00 H new ATOM 0 HA VAL A 75 -15.419 -3.144 -2.634 1.00 0.00 H new ATOM 0 HB VAL A 75 -18.427 -3.647 -2.726 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -17.857 -4.813 -4.841 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -17.366 -3.104 -4.901 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -16.147 -4.371 -4.624 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -17.815 -6.052 -2.670 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -16.105 -5.611 -2.450 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -17.293 -5.224 -1.183 1.00 0.00 H new ATOM 1211 N VAL A 76 -15.987 -0.958 -3.725 1.00 0.00 N ATOM 1212 CA VAL A 76 -16.296 0.385 -4.296 1.00 0.00 C ATOM 1213 C VAL A 76 -15.750 0.470 -5.723 1.00 0.00 C ATOM 1214 O VAL A 76 -14.923 -0.323 -6.129 1.00 0.00 O ATOM 1215 CB VAL A 76 -15.642 1.470 -3.439 1.00 0.00 C ATOM 1216 CG1 VAL A 76 -16.273 1.472 -2.046 1.00 0.00 C ATOM 1217 CG2 VAL A 76 -14.142 1.189 -3.318 1.00 0.00 C ATOM 0 H VAL A 76 -15.108 -1.370 -4.038 1.00 0.00 H new ATOM 0 HA VAL A 76 -17.376 0.532 -4.308 1.00 0.00 H new ATOM 0 HB VAL A 76 -15.794 2.442 -3.908 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -15.806 2.246 -1.436 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -17.341 1.672 -2.131 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -16.122 0.500 -1.577 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -13.675 1.962 -2.707 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -13.991 0.216 -2.850 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -13.691 1.189 -4.310 1.00 0.00 H new ATOM 1227 N HIS A 77 -16.208 1.425 -6.487 1.00 0.00 N ATOM 1228 CA HIS A 77 -15.719 1.569 -7.889 1.00 0.00 C ATOM 1229 C HIS A 77 -15.538 3.054 -8.198 1.00 0.00 C ATOM 1230 O HIS A 77 -15.780 3.500 -9.304 1.00 0.00 O ATOM 1231 CB HIS A 77 -16.741 0.978 -8.869 1.00 0.00 C ATOM 1232 CG HIS A 77 -17.384 -0.248 -8.277 1.00 0.00 C ATOM 1233 ND1 HIS A 77 -16.641 -1.307 -7.780 1.00 0.00 N ATOM 1234 CD2 HIS A 77 -18.700 -0.599 -8.101 1.00 0.00 C ATOM 1235 CE1 HIS A 77 -17.506 -2.235 -7.333 1.00 0.00 C ATOM 1236 NE2 HIS A 77 -18.775 -1.854 -7.505 1.00 0.00 N ATOM 0 H HIS A 77 -16.903 2.114 -6.199 1.00 0.00 H new ATOM 0 HA HIS A 77 -14.773 1.039 -7.996 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -17.504 1.721 -9.101 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -16.249 0.722 -9.807 1.00 0.00 H new ATOM 0 HD1 HIS A 77 -15.623 -1.371 -7.757 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -19.548 0.007 -8.383 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -17.211 -3.174 -6.889 1.00 0.00 H new ATOM 1244 N ASP A 78 -15.113 3.828 -7.233 1.00 0.00 N ATOM 1245 CA ASP A 78 -14.919 5.283 -7.483 1.00 0.00 C ATOM 1246 C ASP A 78 -14.163 5.919 -6.313 1.00 0.00 C ATOM 1247 O ASP A 78 -14.701 6.090 -5.234 1.00 0.00 O ATOM 1248 CB ASP A 78 -16.285 5.959 -7.640 1.00 0.00 C ATOM 1249 CG ASP A 78 -16.350 6.677 -8.991 1.00 0.00 C ATOM 1250 OD1 ASP A 78 -15.633 7.649 -9.158 1.00 0.00 O ATOM 1251 OD2 ASP A 78 -17.117 6.241 -9.834 1.00 0.00 O ATOM 0 H ASP A 78 -14.893 3.515 -6.287 1.00 0.00 H new ATOM 0 HA ASP A 78 -14.338 5.416 -8.396 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -17.080 5.216 -7.573 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -16.445 6.671 -6.830 1.00 0.00 H new ATOM 1256 N VAL A 79 -12.913 6.260 -6.514 1.00 0.00 N ATOM 1257 CA VAL A 79 -12.106 6.887 -5.420 1.00 0.00 C ATOM 1258 C VAL A 79 -12.935 7.957 -4.696 1.00 0.00 C ATOM 1259 O VAL A 79 -12.730 8.227 -3.528 1.00 0.00 O ATOM 1260 CB VAL A 79 -10.859 7.540 -6.027 1.00 0.00 C ATOM 1261 CG1 VAL A 79 -10.099 8.313 -4.945 1.00 0.00 C ATOM 1262 CG2 VAL A 79 -9.950 6.456 -6.611 1.00 0.00 C ATOM 0 H VAL A 79 -12.414 6.130 -7.394 1.00 0.00 H new ATOM 0 HA VAL A 79 -11.816 6.118 -4.704 1.00 0.00 H new ATOM 0 HB VAL A 79 -11.162 8.229 -6.816 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -9.214 8.775 -5.382 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -10.744 9.087 -4.529 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -9.797 7.628 -4.153 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -9.063 6.919 -7.043 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -9.652 5.767 -5.821 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -10.487 5.909 -7.386 1.00 0.00 H new ATOM 1272 N ALA A 80 -13.877 8.557 -5.375 1.00 0.00 N ATOM 1273 CA ALA A 80 -14.724 9.593 -4.722 1.00 0.00 C ATOM 1274 C ALA A 80 -15.459 8.970 -3.533 1.00 0.00 C ATOM 1275 O ALA A 80 -15.556 9.558 -2.471 1.00 0.00 O ATOM 1276 CB ALA A 80 -15.744 10.128 -5.730 1.00 0.00 C ATOM 0 H ALA A 80 -14.095 8.373 -6.354 1.00 0.00 H new ATOM 0 HA ALA A 80 -14.095 10.413 -4.374 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -16.364 10.886 -5.252 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -15.220 10.569 -6.578 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -16.375 9.310 -6.078 1.00 0.00 H new ATOM 1282 N ALA A 81 -15.972 7.777 -3.699 1.00 0.00 N ATOM 1283 CA ALA A 81 -16.695 7.110 -2.581 1.00 0.00 C ATOM 1284 C ALA A 81 -15.712 6.775 -1.460 1.00 0.00 C ATOM 1285 O ALA A 81 -15.966 7.041 -0.301 1.00 0.00 O ATOM 1286 CB ALA A 81 -17.342 5.822 -3.093 1.00 0.00 C ATOM 0 H ALA A 81 -15.920 7.238 -4.563 1.00 0.00 H new ATOM 0 HA ALA A 81 -17.465 7.779 -2.197 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -17.872 5.332 -2.277 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -18.045 6.060 -3.891 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -16.570 5.155 -3.477 1.00 0.00 H new ATOM 1292 N VAL A 82 -14.591 6.185 -1.791 1.00 0.00 N ATOM 1293 CA VAL A 82 -13.596 5.828 -0.731 1.00 0.00 C ATOM 1294 C VAL A 82 -13.241 7.079 0.077 1.00 0.00 C ATOM 1295 O VAL A 82 -13.092 7.030 1.284 1.00 0.00 O ATOM 1296 CB VAL A 82 -12.321 5.266 -1.373 1.00 0.00 C ATOM 1297 CG1 VAL A 82 -11.496 4.530 -0.312 1.00 0.00 C ATOM 1298 CG2 VAL A 82 -12.688 4.289 -2.494 1.00 0.00 C ATOM 0 H VAL A 82 -14.322 5.936 -2.743 1.00 0.00 H new ATOM 0 HA VAL A 82 -14.032 5.074 -0.076 1.00 0.00 H new ATOM 0 HB VAL A 82 -11.739 6.089 -1.788 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -10.590 4.131 -0.768 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -11.226 5.223 0.485 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -12.084 3.712 0.103 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -11.778 3.894 -2.945 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -13.275 3.468 -2.083 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -13.273 4.809 -3.253 1.00 0.00 H new ATOM 1308 N PHE A 83 -13.107 8.198 -0.581 1.00 0.00 N ATOM 1309 CA PHE A 83 -12.765 9.456 0.142 1.00 0.00 C ATOM 1310 C PHE A 83 -13.917 9.837 1.074 1.00 0.00 C ATOM 1311 O PHE A 83 -13.726 10.506 2.071 1.00 0.00 O ATOM 1312 CB PHE A 83 -12.545 10.582 -0.872 1.00 0.00 C ATOM 1313 CG PHE A 83 -11.088 10.641 -1.267 1.00 0.00 C ATOM 1314 CD1 PHE A 83 -10.109 10.863 -0.294 1.00 0.00 C ATOM 1315 CD2 PHE A 83 -10.717 10.481 -2.607 1.00 0.00 C ATOM 1316 CE1 PHE A 83 -8.760 10.926 -0.659 1.00 0.00 C ATOM 1317 CE2 PHE A 83 -9.368 10.544 -2.972 1.00 0.00 C ATOM 1318 CZ PHE A 83 -8.390 10.767 -1.997 1.00 0.00 C ATOM 0 H PHE A 83 -13.220 8.296 -1.590 1.00 0.00 H new ATOM 0 HA PHE A 83 -11.857 9.304 0.725 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -13.163 10.415 -1.754 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -12.853 11.535 -0.443 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -10.394 10.986 0.740 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -11.472 10.309 -3.359 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -8.004 11.098 0.093 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -9.082 10.421 -4.006 1.00 0.00 H new ATOM 0 HZ PHE A 83 -7.349 10.816 -2.279 1.00 0.00 H new ATOM 1328 N ALA A 84 -15.115 9.428 0.750 1.00 0.00 N ATOM 1329 CA ALA A 84 -16.284 9.778 1.608 1.00 0.00 C ATOM 1330 C ALA A 84 -16.306 8.910 2.874 1.00 0.00 C ATOM 1331 O ALA A 84 -16.877 9.291 3.881 1.00 0.00 O ATOM 1332 CB ALA A 84 -17.577 9.557 0.818 1.00 0.00 C ATOM 0 H ALA A 84 -15.334 8.866 -0.073 1.00 0.00 H new ATOM 0 HA ALA A 84 -16.201 10.824 1.903 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -18.433 9.812 1.443 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -17.574 10.190 -0.069 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -17.646 8.511 0.518 1.00 0.00 H new ATOM 1338 N TYR A 85 -15.692 7.755 2.850 1.00 0.00 N ATOM 1339 CA TYR A 85 -15.699 6.894 4.068 1.00 0.00 C ATOM 1340 C TYR A 85 -14.699 7.443 5.084 1.00 0.00 C ATOM 1341 O TYR A 85 -15.042 7.712 6.220 1.00 0.00 O ATOM 1342 CB TYR A 85 -15.310 5.462 3.690 1.00 0.00 C ATOM 1343 CG TYR A 85 -15.935 4.496 4.670 1.00 0.00 C ATOM 1344 CD1 TYR A 85 -17.283 4.141 4.540 1.00 0.00 C ATOM 1345 CD2 TYR A 85 -15.167 3.959 5.710 1.00 0.00 C ATOM 1346 CE1 TYR A 85 -17.862 3.248 5.451 1.00 0.00 C ATOM 1347 CE2 TYR A 85 -15.745 3.066 6.619 1.00 0.00 C ATOM 1348 CZ TYR A 85 -17.093 2.710 6.490 1.00 0.00 C ATOM 1349 OH TYR A 85 -17.663 1.830 7.387 1.00 0.00 O ATOM 0 H TYR A 85 -15.191 7.374 2.047 1.00 0.00 H new ATOM 0 HA TYR A 85 -16.698 6.892 4.504 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -15.645 5.238 2.677 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -14.225 5.354 3.698 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -17.876 4.555 3.738 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -14.128 4.234 5.811 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -18.902 2.974 5.352 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -15.151 2.651 7.420 1.00 0.00 H new ATOM 0 HH TYR A 85 -17.535 2.164 8.299 1.00 0.00 H new ATOM 1359 N ALA A 86 -13.467 7.623 4.683 1.00 0.00 N ATOM 1360 CA ALA A 86 -12.445 8.166 5.626 1.00 0.00 C ATOM 1361 C ALA A 86 -12.966 9.467 6.239 1.00 0.00 C ATOM 1362 O ALA A 86 -12.803 9.723 7.416 1.00 0.00 O ATOM 1363 CB ALA A 86 -11.148 8.447 4.866 1.00 0.00 C ATOM 0 H ALA A 86 -13.125 7.418 3.744 1.00 0.00 H new ATOM 0 HA ALA A 86 -12.253 7.439 6.415 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -10.402 8.844 5.554 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -10.778 7.522 4.423 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -11.339 9.176 4.078 1.00 0.00 H new ATOM 1369 N LYS A 87 -13.608 10.280 5.446 1.00 0.00 N ATOM 1370 CA LYS A 87 -14.159 11.559 5.970 1.00 0.00 C ATOM 1371 C LYS A 87 -15.258 11.258 6.992 1.00 0.00 C ATOM 1372 O LYS A 87 -15.514 12.038 7.888 1.00 0.00 O ATOM 1373 CB LYS A 87 -14.749 12.371 4.811 1.00 0.00 C ATOM 1374 CG LYS A 87 -14.007 13.704 4.684 1.00 0.00 C ATOM 1375 CD LYS A 87 -14.039 14.173 3.226 1.00 0.00 C ATOM 1376 CE LYS A 87 -12.620 14.521 2.766 1.00 0.00 C ATOM 1377 NZ LYS A 87 -12.268 15.896 3.224 1.00 0.00 N ATOM 0 H LYS A 87 -13.775 10.112 4.454 1.00 0.00 H new ATOM 0 HA LYS A 87 -13.364 12.131 6.448 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -14.667 11.808 3.881 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -15.810 12.550 4.983 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -14.470 14.452 5.327 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -12.976 13.591 5.018 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -14.456 13.391 2.591 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -14.688 15.044 3.128 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -11.909 13.800 3.169 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -12.554 14.461 1.680 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -11.304 16.130 2.911 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -12.939 16.579 2.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -12.314 15.939 4.262 1.00 0.00 H new ATOM 1391 N GLN A 88 -15.923 10.139 6.854 1.00 0.00 N ATOM 1392 CA GLN A 88 -17.019 9.801 7.809 1.00 0.00 C ATOM 1393 C GLN A 88 -16.467 9.072 9.043 1.00 0.00 C ATOM 1394 O GLN A 88 -17.065 9.109 10.101 1.00 0.00 O ATOM 1395 CB GLN A 88 -18.041 8.901 7.105 1.00 0.00 C ATOM 1396 CG GLN A 88 -19.359 9.660 6.925 1.00 0.00 C ATOM 1397 CD GLN A 88 -19.899 9.424 5.513 1.00 0.00 C ATOM 1398 OE1 GLN A 88 -19.294 9.975 4.496 1.00 0.00 O flip ATOM 1399 NE2 GLN A 88 -20.880 8.730 5.333 1.00 0.00 N flip ATOM 0 H GLN A 88 -15.754 9.447 6.123 1.00 0.00 H new ATOM 0 HA GLN A 88 -17.492 10.727 8.137 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -17.656 8.586 6.135 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -18.208 7.997 7.690 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -20.087 9.325 7.664 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -19.202 10.726 7.092 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -21.353 8.299 6.128 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -21.231 8.578 4.387 1.00 0.00 H new ATOM 1408 N HIS A 89 -15.349 8.398 8.929 1.00 0.00 N ATOM 1409 CA HIS A 89 -14.801 7.664 10.112 1.00 0.00 C ATOM 1410 C HIS A 89 -13.803 8.550 10.877 1.00 0.00 C ATOM 1411 O HIS A 89 -12.795 8.949 10.329 1.00 0.00 O ATOM 1412 CB HIS A 89 -14.081 6.402 9.628 1.00 0.00 C ATOM 1413 CG HIS A 89 -15.027 5.233 9.670 1.00 0.00 C ATOM 1414 ND1 HIS A 89 -14.793 4.120 10.463 1.00 0.00 N ATOM 1415 CD2 HIS A 89 -16.212 4.988 9.022 1.00 0.00 C ATOM 1416 CE1 HIS A 89 -15.813 3.265 10.274 1.00 0.00 C ATOM 1417 NE2 HIS A 89 -16.707 3.744 9.405 1.00 0.00 N ATOM 0 H HIS A 89 -14.796 8.324 8.075 1.00 0.00 H new ATOM 0 HA HIS A 89 -15.623 7.399 10.777 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -13.713 6.548 8.613 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -13.213 6.203 10.256 1.00 0.00 H new ATOM 0 HD1 HIS A 89 -13.992 3.976 11.078 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -16.688 5.658 8.322 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -15.899 2.307 10.765 1.00 0.00 H new ATOM 1425 N PRO A 90 -14.106 8.821 12.128 1.00 0.00 N ATOM 1426 CA PRO A 90 -13.279 9.649 13.072 1.00 0.00 C ATOM 1427 C PRO A 90 -12.208 8.781 13.751 1.00 0.00 C ATOM 1428 O PRO A 90 -11.436 9.255 14.562 1.00 0.00 O ATOM 1429 CB PRO A 90 -14.248 10.188 14.117 1.00 0.00 C ATOM 1430 CG PRO A 90 -15.501 9.335 14.046 1.00 0.00 C ATOM 1431 CD PRO A 90 -15.332 8.371 12.874 1.00 0.00 C ATOM 0 HA PRO A 90 -12.763 10.452 12.545 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -13.806 10.141 15.112 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -14.483 11.234 13.921 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -15.645 8.786 14.977 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -16.383 9.960 13.905 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -15.217 7.346 13.227 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -16.209 8.389 12.227 1.00 0.00 H new ATOM 1439 N ASP A 91 -12.153 7.516 13.422 1.00 0.00 N ATOM 1440 CA ASP A 91 -11.129 6.620 14.041 1.00 0.00 C ATOM 1441 C ASP A 91 -10.579 5.659 12.982 1.00 0.00 C ATOM 1442 O ASP A 91 -9.871 4.719 13.287 1.00 0.00 O ATOM 1443 CB ASP A 91 -11.769 5.819 15.176 1.00 0.00 C ATOM 1444 CG ASP A 91 -11.945 6.721 16.399 1.00 0.00 C ATOM 1445 OD1 ASP A 91 -12.763 7.623 16.332 1.00 0.00 O ATOM 1446 OD2 ASP A 91 -11.257 6.495 17.381 1.00 0.00 O ATOM 0 H ASP A 91 -12.774 7.064 12.751 1.00 0.00 H new ATOM 0 HA ASP A 91 -10.314 7.224 14.439 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -12.735 5.426 14.859 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -11.144 4.963 15.429 1.00 0.00 H new ATOM 1451 N GLN A 92 -10.892 5.899 11.738 1.00 0.00 N ATOM 1452 CA GLN A 92 -10.394 5.025 10.643 1.00 0.00 C ATOM 1453 C GLN A 92 -10.176 5.900 9.414 1.00 0.00 C ATOM 1454 O GLN A 92 -11.117 6.268 8.739 1.00 0.00 O ATOM 1455 CB GLN A 92 -11.440 3.950 10.331 1.00 0.00 C ATOM 1456 CG GLN A 92 -10.739 2.631 10.011 1.00 0.00 C ATOM 1457 CD GLN A 92 -11.746 1.482 10.093 1.00 0.00 C ATOM 1458 OE1 GLN A 92 -11.745 0.724 11.042 1.00 0.00 O ATOM 1459 NE2 GLN A 92 -12.612 1.320 9.130 1.00 0.00 N ATOM 0 H GLN A 92 -11.480 6.675 11.432 1.00 0.00 H new ATOM 0 HA GLN A 92 -9.464 4.536 10.934 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -12.109 3.821 11.182 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -12.055 4.261 9.487 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -10.300 2.673 9.014 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -9.922 2.462 10.712 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -12.613 1.956 8.333 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -13.288 0.557 9.175 1.00 0.00 H new ATOM 1468 N GLU A 93 -8.955 6.255 9.114 1.00 0.00 N ATOM 1469 CA GLU A 93 -8.710 7.127 7.935 1.00 0.00 C ATOM 1470 C GLU A 93 -8.598 6.278 6.665 1.00 0.00 C ATOM 1471 O GLU A 93 -9.022 5.138 6.625 1.00 0.00 O ATOM 1472 CB GLU A 93 -7.414 7.912 8.164 1.00 0.00 C ATOM 1473 CG GLU A 93 -7.739 9.230 8.871 1.00 0.00 C ATOM 1474 CD GLU A 93 -6.497 10.122 8.887 1.00 0.00 C ATOM 1475 OE1 GLU A 93 -6.225 10.745 7.874 1.00 0.00 O ATOM 1476 OE2 GLU A 93 -5.838 10.168 9.913 1.00 0.00 O ATOM 0 H GLU A 93 -8.122 5.979 9.633 1.00 0.00 H new ATOM 0 HA GLU A 93 -9.542 7.820 7.810 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -6.721 7.324 8.766 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -6.921 8.109 7.212 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -8.557 9.737 8.359 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -8.073 9.035 9.890 1.00 0.00 H new ATOM 1483 N LEU A 94 -8.021 6.832 5.633 1.00 0.00 N ATOM 1484 CA LEU A 94 -7.864 6.080 4.360 1.00 0.00 C ATOM 1485 C LEU A 94 -6.409 5.629 4.216 1.00 0.00 C ATOM 1486 O LEU A 94 -5.508 6.438 4.124 1.00 0.00 O ATOM 1487 CB LEU A 94 -8.235 6.996 3.192 1.00 0.00 C ATOM 1488 CG LEU A 94 -8.846 6.171 2.059 1.00 0.00 C ATOM 1489 CD1 LEU A 94 -10.288 5.791 2.413 1.00 0.00 C ATOM 1490 CD2 LEU A 94 -8.837 7.005 0.777 1.00 0.00 C ATOM 0 H LEU A 94 -7.649 7.782 5.620 1.00 0.00 H new ATOM 0 HA LEU A 94 -8.515 5.206 4.361 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -8.943 7.755 3.524 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -7.349 7.521 2.835 1.00 0.00 H new ATOM 0 HG LEU A 94 -8.264 5.261 1.914 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -10.719 5.203 1.602 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -10.294 5.203 3.331 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -10.878 6.696 2.558 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -9.271 6.425 -0.037 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -9.422 7.912 0.929 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -7.811 7.273 0.525 1.00 0.00 H new ATOM 1502 N VAL A 95 -6.168 4.348 4.195 1.00 0.00 N ATOM 1503 CA VAL A 95 -4.768 3.858 4.047 1.00 0.00 C ATOM 1504 C VAL A 95 -4.643 3.136 2.709 1.00 0.00 C ATOM 1505 O VAL A 95 -5.389 2.222 2.417 1.00 0.00 O ATOM 1506 CB VAL A 95 -4.422 2.896 5.185 1.00 0.00 C ATOM 1507 CG1 VAL A 95 -2.945 2.509 5.094 1.00 0.00 C ATOM 1508 CG2 VAL A 95 -4.683 3.582 6.526 1.00 0.00 C ATOM 0 H VAL A 95 -6.878 3.620 4.274 1.00 0.00 H new ATOM 0 HA VAL A 95 -4.079 4.702 4.084 1.00 0.00 H new ATOM 0 HB VAL A 95 -5.039 2.001 5.105 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -2.698 1.824 5.905 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -2.754 2.023 4.137 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -2.329 3.404 5.175 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -4.437 2.898 7.338 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -4.064 4.476 6.604 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -5.734 3.862 6.593 1.00 0.00 H new ATOM 1518 N ILE A 96 -3.720 3.548 1.885 1.00 0.00 N ATOM 1519 CA ILE A 96 -3.566 2.888 0.559 1.00 0.00 C ATOM 1520 C ILE A 96 -2.683 1.652 0.702 1.00 0.00 C ATOM 1521 O ILE A 96 -1.701 1.649 1.427 1.00 0.00 O ATOM 1522 CB ILE A 96 -2.932 3.857 -0.441 1.00 0.00 C ATOM 1523 CG1 ILE A 96 -3.570 5.246 -0.302 1.00 0.00 C ATOM 1524 CG2 ILE A 96 -3.159 3.335 -1.863 1.00 0.00 C ATOM 1525 CD1 ILE A 96 -5.076 5.158 -0.551 1.00 0.00 C ATOM 0 H ILE A 96 -3.068 4.310 2.071 1.00 0.00 H new ATOM 0 HA ILE A 96 -4.550 2.593 0.193 1.00 0.00 H new ATOM 0 HB ILE A 96 -1.863 3.933 -0.240 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -3.381 5.644 0.695 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -3.116 5.937 -1.012 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -2.709 4.022 -2.579 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -2.701 2.351 -1.967 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.229 3.259 -2.056 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -5.520 6.148 -0.450 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -5.257 4.780 -1.557 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -5.526 4.483 0.177 1.00 0.00 H new ATOM 1537 N ALA A 97 -3.010 0.615 -0.018 1.00 0.00 N ATOM 1538 CA ALA A 97 -2.197 -0.629 0.029 1.00 0.00 C ATOM 1539 C ALA A 97 -1.759 -0.990 -1.395 1.00 0.00 C ATOM 1540 O ALA A 97 -1.050 -1.954 -1.611 1.00 0.00 O ATOM 1541 CB ALA A 97 -3.039 -1.762 0.616 1.00 0.00 C ATOM 0 H ALA A 97 -3.815 0.578 -0.643 1.00 0.00 H new ATOM 0 HA ALA A 97 -1.317 -0.477 0.654 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -2.445 -2.676 0.652 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -3.356 -1.495 1.624 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -3.917 -1.924 -0.009 1.00 0.00 H new ATOM 1547 N GLY A 98 -2.149 -0.199 -2.364 1.00 0.00 N ATOM 1548 CA GLY A 98 -1.732 -0.468 -3.768 1.00 0.00 C ATOM 1549 C GLY A 98 -2.830 -1.227 -4.528 1.00 0.00 C ATOM 1550 O GLY A 98 -3.978 -1.231 -4.134 1.00 0.00 O ATOM 0 H GLY A 98 -2.740 0.623 -2.239 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -1.517 0.473 -4.275 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -0.811 -1.051 -3.773 1.00 0.00 H new ATOM 1554 N GLY A 99 -2.486 -1.859 -5.629 1.00 0.00 N ATOM 1555 CA GLY A 99 -1.071 -1.849 -6.106 1.00 0.00 C ATOM 1556 C GLY A 99 -0.704 -0.484 -6.699 1.00 0.00 C ATOM 1557 O GLY A 99 -1.091 0.555 -6.202 1.00 0.00 O ATOM 0 H GLY A 99 -3.133 -2.383 -6.218 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -0.402 -2.082 -5.278 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -0.931 -2.626 -6.857 1.00 0.00 H new ATOM 1561 N ALA A 100 0.037 -0.488 -7.774 1.00 0.00 N ATOM 1562 CA ALA A 100 0.447 0.796 -8.410 1.00 0.00 C ATOM 1563 C ALA A 100 -0.787 1.554 -8.894 1.00 0.00 C ATOM 1564 O ALA A 100 -0.831 2.768 -8.860 1.00 0.00 O ATOM 1565 CB ALA A 100 1.364 0.501 -9.600 1.00 0.00 C ATOM 0 H ALA A 100 0.377 -1.329 -8.241 1.00 0.00 H new ATOM 0 HA ALA A 100 0.977 1.407 -7.679 1.00 0.00 H new ATOM 0 HB1 ALA A 100 1.666 1.438 -10.068 1.00 0.00 H new ATOM 0 HB2 ALA A 100 2.249 -0.033 -9.254 1.00 0.00 H new ATOM 0 HB3 ALA A 100 0.831 -0.112 -10.327 1.00 0.00 H new ATOM 1571 N GLN A 101 -1.780 0.853 -9.367 1.00 0.00 N ATOM 1572 CA GLN A 101 -2.996 1.546 -9.871 1.00 0.00 C ATOM 1573 C GLN A 101 -3.628 2.367 -8.747 1.00 0.00 C ATOM 1574 O GLN A 101 -4.105 3.463 -8.974 1.00 0.00 O ATOM 1575 CB GLN A 101 -4.001 0.517 -10.399 1.00 0.00 C ATOM 1576 CG GLN A 101 -4.149 0.690 -11.914 1.00 0.00 C ATOM 1577 CD GLN A 101 -5.419 -0.014 -12.394 1.00 0.00 C ATOM 1578 OE1 GLN A 101 -5.362 -1.124 -12.884 1.00 0.00 O ATOM 1579 NE2 GLN A 101 -6.570 0.590 -12.276 1.00 0.00 N ATOM 0 H GLN A 101 -1.801 -0.165 -9.426 1.00 0.00 H new ATOM 0 HA GLN A 101 -2.715 2.215 -10.684 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -3.662 -0.493 -10.168 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -4.966 0.649 -9.910 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -4.192 1.750 -12.166 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -3.278 0.277 -12.423 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -6.617 1.522 -11.864 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -7.422 0.130 -12.595 1.00 0.00 H new ATOM 1588 N ILE A 102 -3.665 1.859 -7.539 1.00 0.00 N ATOM 1589 CA ILE A 102 -4.298 2.637 -6.439 1.00 0.00 C ATOM 1590 C ILE A 102 -3.350 3.741 -5.964 1.00 0.00 C ATOM 1591 O ILE A 102 -3.783 4.751 -5.449 1.00 0.00 O ATOM 1592 CB ILE A 102 -4.619 1.698 -5.271 1.00 0.00 C ATOM 1593 CG1 ILE A 102 -5.457 0.515 -5.775 1.00 0.00 C ATOM 1594 CG2 ILE A 102 -5.404 2.457 -4.199 1.00 0.00 C ATOM 1595 CD1 ILE A 102 -6.746 1.024 -6.428 1.00 0.00 C ATOM 0 H ILE A 102 -3.288 0.949 -7.273 1.00 0.00 H new ATOM 0 HA ILE A 102 -5.217 3.093 -6.806 1.00 0.00 H new ATOM 0 HB ILE A 102 -3.687 1.327 -4.843 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -4.882 -0.068 -6.494 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -5.698 -0.150 -4.945 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -5.630 1.786 -3.370 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -4.808 3.294 -3.836 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -6.334 2.832 -4.626 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -7.333 0.177 -6.782 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -7.326 1.588 -5.697 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -6.497 1.670 -7.270 1.00 0.00 H new ATOM 1607 N PHE A 103 -2.064 3.571 -6.124 1.00 0.00 N ATOM 1608 CA PHE A 103 -1.119 4.632 -5.670 1.00 0.00 C ATOM 1609 C PHE A 103 -1.187 5.824 -6.628 1.00 0.00 C ATOM 1610 O PHE A 103 -0.841 6.931 -6.272 1.00 0.00 O ATOM 1611 CB PHE A 103 0.315 4.083 -5.666 1.00 0.00 C ATOM 1612 CG PHE A 103 0.476 3.042 -4.581 1.00 0.00 C ATOM 1613 CD1 PHE A 103 -0.061 3.261 -3.307 1.00 0.00 C ATOM 1614 CD2 PHE A 103 1.166 1.853 -4.852 1.00 0.00 C ATOM 1615 CE1 PHE A 103 0.089 2.293 -2.306 1.00 0.00 C ATOM 1616 CE2 PHE A 103 1.316 0.885 -3.851 1.00 0.00 C ATOM 1617 CZ PHE A 103 0.776 1.106 -2.579 1.00 0.00 C ATOM 0 H PHE A 103 -1.630 2.750 -6.546 1.00 0.00 H new ATOM 0 HA PHE A 103 -1.397 4.947 -4.664 1.00 0.00 H new ATOM 0 HB2 PHE A 103 0.547 3.645 -6.637 1.00 0.00 H new ATOM 0 HB3 PHE A 103 1.023 4.897 -5.507 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -0.592 4.178 -3.096 1.00 0.00 H new ATOM 0 HD2 PHE A 103 1.583 1.683 -5.834 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -0.326 2.463 -1.323 1.00 0.00 H new ATOM 0 HE2 PHE A 103 1.848 -0.031 -4.061 1.00 0.00 H new ATOM 0 HZ PHE A 103 0.890 0.359 -1.807 1.00 0.00 H new ATOM 1627 N THR A 104 -1.605 5.600 -7.846 1.00 0.00 N ATOM 1628 CA THR A 104 -1.666 6.718 -8.834 1.00 0.00 C ATOM 1629 C THR A 104 -2.939 7.551 -8.631 1.00 0.00 C ATOM 1630 O THR A 104 -2.892 8.765 -8.585 1.00 0.00 O ATOM 1631 CB THR A 104 -1.606 6.139 -10.263 1.00 0.00 C ATOM 1632 OG1 THR A 104 -0.891 7.035 -11.101 1.00 0.00 O ATOM 1633 CG2 THR A 104 -3.010 5.920 -10.843 1.00 0.00 C ATOM 0 H THR A 104 -1.907 4.692 -8.200 1.00 0.00 H new ATOM 0 HA THR A 104 -0.813 7.379 -8.684 1.00 0.00 H new ATOM 0 HB THR A 104 -1.103 5.173 -10.216 1.00 0.00 H new ATOM 0 HG1 THR A 104 -0.849 6.670 -12.010 1.00 0.00 H new ATOM 0 HG21 THR A 104 -2.928 5.511 -11.850 1.00 0.00 H new ATOM 0 HG22 THR A 104 -3.560 5.222 -10.212 1.00 0.00 H new ATOM 0 HG23 THR A 104 -3.541 6.871 -10.879 1.00 0.00 H new ATOM 1641 N ALA A 105 -4.075 6.918 -8.527 1.00 0.00 N ATOM 1642 CA ALA A 105 -5.345 7.686 -8.348 1.00 0.00 C ATOM 1643 C ALA A 105 -5.317 8.465 -7.029 1.00 0.00 C ATOM 1644 O ALA A 105 -5.929 9.507 -6.904 1.00 0.00 O ATOM 1645 CB ALA A 105 -6.529 6.718 -8.337 1.00 0.00 C ATOM 0 H ALA A 105 -4.181 5.904 -8.558 1.00 0.00 H new ATOM 0 HA ALA A 105 -5.448 8.390 -9.174 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -7.455 7.278 -8.206 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -6.563 6.174 -9.281 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -6.413 6.011 -7.515 1.00 0.00 H new ATOM 1651 N PHE A 106 -4.630 7.961 -6.041 1.00 0.00 N ATOM 1652 CA PHE A 106 -4.582 8.668 -4.725 1.00 0.00 C ATOM 1653 C PHE A 106 -3.300 9.503 -4.612 1.00 0.00 C ATOM 1654 O PHE A 106 -3.111 10.237 -3.660 1.00 0.00 O ATOM 1655 CB PHE A 106 -4.598 7.630 -3.602 1.00 0.00 C ATOM 1656 CG PHE A 106 -5.991 7.068 -3.438 1.00 0.00 C ATOM 1657 CD1 PHE A 106 -6.921 7.732 -2.634 1.00 0.00 C ATOM 1658 CD2 PHE A 106 -6.346 5.875 -4.079 1.00 0.00 C ATOM 1659 CE1 PHE A 106 -8.205 7.203 -2.470 1.00 0.00 C ATOM 1660 CE2 PHE A 106 -7.631 5.349 -3.917 1.00 0.00 C ATOM 1661 CZ PHE A 106 -8.560 6.012 -3.111 1.00 0.00 C ATOM 0 H PHE A 106 -4.099 7.091 -6.086 1.00 0.00 H new ATOM 0 HA PHE A 106 -5.445 9.329 -4.646 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -3.897 6.827 -3.828 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -4.269 8.087 -2.669 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -6.648 8.653 -2.140 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -5.627 5.361 -4.699 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -8.924 7.715 -1.847 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -7.906 4.431 -4.415 1.00 0.00 H new ATOM 0 HZ PHE A 106 -9.552 5.605 -2.983 1.00 0.00 H new ATOM 1671 N LYS A 107 -2.401 9.377 -5.553 1.00 0.00 N ATOM 1672 CA LYS A 107 -1.125 10.147 -5.467 1.00 0.00 C ATOM 1673 C LYS A 107 -1.409 11.653 -5.344 1.00 0.00 C ATOM 1674 O LYS A 107 -0.693 12.363 -4.671 1.00 0.00 O ATOM 1675 CB LYS A 107 -0.242 9.856 -6.693 1.00 0.00 C ATOM 1676 CG LYS A 107 -0.796 10.533 -7.952 1.00 0.00 C ATOM 1677 CD LYS A 107 0.215 11.565 -8.459 1.00 0.00 C ATOM 1678 CE LYS A 107 -0.352 12.285 -9.683 1.00 0.00 C ATOM 1679 NZ LYS A 107 -0.306 13.757 -9.455 1.00 0.00 N ATOM 0 H LYS A 107 -2.494 8.778 -6.373 1.00 0.00 H new ATOM 0 HA LYS A 107 -0.588 9.830 -4.573 1.00 0.00 H new ATOM 0 HB2 LYS A 107 0.772 10.208 -6.505 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -0.182 8.780 -6.853 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -0.990 9.788 -8.724 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -1.747 11.017 -7.730 1.00 0.00 H new ATOM 0 HD2 LYS A 107 0.439 12.286 -7.673 1.00 0.00 H new ATOM 0 HD3 LYS A 107 1.153 11.073 -8.717 1.00 0.00 H new ATOM 0 HE2 LYS A 107 0.224 12.025 -10.571 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -1.378 11.966 -9.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -0.691 14.249 -10.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -0.874 13.996 -8.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 0.679 14.054 -9.302 1.00 0.00 H new ATOM 1693 N ASP A 108 -2.442 12.153 -5.973 1.00 0.00 N ATOM 1694 CA ASP A 108 -2.740 13.612 -5.871 1.00 0.00 C ATOM 1695 C ASP A 108 -3.188 13.966 -4.448 1.00 0.00 C ATOM 1696 O ASP A 108 -2.860 15.015 -3.929 1.00 0.00 O ATOM 1697 CB ASP A 108 -3.860 13.964 -6.853 1.00 0.00 C ATOM 1698 CG ASP A 108 -3.659 15.388 -7.373 1.00 0.00 C ATOM 1699 OD1 ASP A 108 -3.922 16.314 -6.623 1.00 0.00 O ATOM 1700 OD2 ASP A 108 -3.248 15.529 -8.513 1.00 0.00 O ATOM 0 H ASP A 108 -3.089 11.616 -6.550 1.00 0.00 H new ATOM 0 HA ASP A 108 -1.839 14.177 -6.110 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -3.863 13.260 -7.685 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -4.829 13.879 -6.361 1.00 0.00 H new ATOM 1705 N ASP A 109 -3.949 13.108 -3.823 1.00 0.00 N ATOM 1706 CA ASP A 109 -4.436 13.398 -2.441 1.00 0.00 C ATOM 1707 C ASP A 109 -3.698 12.513 -1.434 1.00 0.00 C ATOM 1708 O ASP A 109 -4.175 11.457 -1.066 1.00 0.00 O ATOM 1709 CB ASP A 109 -5.935 13.103 -2.366 1.00 0.00 C ATOM 1710 CG ASP A 109 -6.722 14.311 -2.878 1.00 0.00 C ATOM 1711 OD1 ASP A 109 -6.841 14.448 -4.084 1.00 0.00 O ATOM 1712 OD2 ASP A 109 -7.193 15.078 -2.054 1.00 0.00 O ATOM 0 H ASP A 109 -4.256 12.216 -4.210 1.00 0.00 H new ATOM 0 HA ASP A 109 -4.250 14.446 -2.204 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -6.173 12.222 -2.962 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -6.221 12.879 -1.338 1.00 0.00 H new ATOM 1717 N VAL A 110 -2.542 12.929 -0.980 1.00 0.00 N ATOM 1718 CA VAL A 110 -1.788 12.099 0.007 1.00 0.00 C ATOM 1719 C VAL A 110 -1.631 12.869 1.320 1.00 0.00 C ATOM 1720 O VAL A 110 -1.584 14.084 1.338 1.00 0.00 O ATOM 1721 CB VAL A 110 -0.393 11.781 -0.536 1.00 0.00 C ATOM 1722 CG1 VAL A 110 0.229 10.653 0.289 1.00 0.00 C ATOM 1723 CG2 VAL A 110 -0.489 11.353 -2.002 1.00 0.00 C ATOM 0 H VAL A 110 -2.090 13.803 -1.249 1.00 0.00 H new ATOM 0 HA VAL A 110 -2.341 11.175 0.178 1.00 0.00 H new ATOM 0 HB VAL A 110 0.232 12.672 -0.466 1.00 0.00 H new ATOM 0 HG11 VAL A 110 1.223 10.425 -0.097 1.00 0.00 H new ATOM 0 HG12 VAL A 110 0.307 10.964 1.331 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -0.399 9.764 0.222 1.00 0.00 H new ATOM 0 HG21 VAL A 110 0.508 11.128 -2.381 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.116 10.465 -2.081 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -0.927 12.160 -2.589 1.00 0.00 H new ATOM 1733 N ASP A 111 -1.543 12.168 2.420 1.00 0.00 N ATOM 1734 CA ASP A 111 -1.376 12.849 3.737 1.00 0.00 C ATOM 1735 C ASP A 111 -0.151 12.268 4.450 1.00 0.00 C ATOM 1736 O ASP A 111 0.584 12.969 5.119 1.00 0.00 O ATOM 1737 CB ASP A 111 -2.622 12.619 4.595 1.00 0.00 C ATOM 1738 CG ASP A 111 -3.633 13.739 4.343 1.00 0.00 C ATOM 1739 OD1 ASP A 111 -3.361 14.857 4.750 1.00 0.00 O ATOM 1740 OD2 ASP A 111 -4.661 13.461 3.748 1.00 0.00 O ATOM 0 H ASP A 111 -1.580 11.150 2.463 1.00 0.00 H new ATOM 0 HA ASP A 111 -1.239 13.919 3.581 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -3.067 11.653 4.356 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -2.349 12.592 5.650 1.00 0.00 H new ATOM 1745 N THR A 112 0.071 10.987 4.306 1.00 0.00 N ATOM 1746 CA THR A 112 1.244 10.342 4.965 1.00 0.00 C ATOM 1747 C THR A 112 1.783 9.236 4.053 1.00 0.00 C ATOM 1748 O THR A 112 1.049 8.375 3.612 1.00 0.00 O ATOM 1749 CB THR A 112 0.807 9.733 6.301 1.00 0.00 C ATOM 1750 OG1 THR A 112 -0.086 10.624 6.954 1.00 0.00 O ATOM 1751 CG2 THR A 112 2.033 9.496 7.187 1.00 0.00 C ATOM 0 H THR A 112 -0.514 10.357 3.757 1.00 0.00 H new ATOM 0 HA THR A 112 2.021 11.085 5.143 1.00 0.00 H new ATOM 0 HB THR A 112 0.307 8.782 6.119 1.00 0.00 H new ATOM 0 HG1 THR A 112 -0.368 10.236 7.809 1.00 0.00 H new ATOM 0 HG21 THR A 112 1.718 9.063 8.136 1.00 0.00 H new ATOM 0 HG22 THR A 112 2.718 8.812 6.686 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.538 10.444 7.371 1.00 0.00 H new ATOM 1759 N LEU A 113 3.056 9.255 3.758 1.00 0.00 N ATOM 1760 CA LEU A 113 3.625 8.204 2.866 1.00 0.00 C ATOM 1761 C LEU A 113 4.486 7.236 3.680 1.00 0.00 C ATOM 1762 O LEU A 113 5.314 7.640 4.472 1.00 0.00 O ATOM 1763 CB LEU A 113 4.485 8.859 1.783 1.00 0.00 C ATOM 1764 CG LEU A 113 3.611 9.760 0.910 1.00 0.00 C ATOM 1765 CD1 LEU A 113 4.460 10.891 0.325 1.00 0.00 C ATOM 1766 CD2 LEU A 113 3.014 8.931 -0.228 1.00 0.00 C ATOM 0 H LEU A 113 3.723 9.949 4.094 1.00 0.00 H new ATOM 0 HA LEU A 113 2.807 7.654 2.401 1.00 0.00 H new ATOM 0 HB2 LEU A 113 5.283 9.443 2.242 1.00 0.00 H new ATOM 0 HB3 LEU A 113 4.962 8.094 1.171 1.00 0.00 H new ATOM 0 HG LEU A 113 2.810 10.187 1.514 1.00 0.00 H new ATOM 0 HD11 LEU A 113 3.834 11.531 -0.297 1.00 0.00 H new ATOM 0 HD12 LEU A 113 4.890 11.480 1.135 1.00 0.00 H new ATOM 0 HD13 LEU A 113 5.261 10.468 -0.281 1.00 0.00 H new ATOM 0 HD21 LEU A 113 2.390 9.569 -0.854 1.00 0.00 H new ATOM 0 HD22 LEU A 113 3.818 8.507 -0.830 1.00 0.00 H new ATOM 0 HD23 LEU A 113 2.408 8.126 0.187 1.00 0.00 H new ATOM 1778 N LEU A 114 4.299 5.959 3.478 1.00 0.00 N ATOM 1779 CA LEU A 114 5.103 4.945 4.218 1.00 0.00 C ATOM 1780 C LEU A 114 5.747 4.005 3.199 1.00 0.00 C ATOM 1781 O LEU A 114 5.134 3.063 2.735 1.00 0.00 O ATOM 1782 CB LEU A 114 4.186 4.144 5.144 1.00 0.00 C ATOM 1783 CG LEU A 114 3.643 5.060 6.243 1.00 0.00 C ATOM 1784 CD1 LEU A 114 2.195 4.679 6.559 1.00 0.00 C ATOM 1785 CD2 LEU A 114 4.498 4.901 7.501 1.00 0.00 C ATOM 0 H LEU A 114 3.617 5.572 2.826 1.00 0.00 H new ATOM 0 HA LEU A 114 5.871 5.436 4.815 1.00 0.00 H new ATOM 0 HB2 LEU A 114 3.362 3.714 4.574 1.00 0.00 H new ATOM 0 HB3 LEU A 114 4.735 3.313 5.587 1.00 0.00 H new ATOM 0 HG LEU A 114 3.678 6.096 5.905 1.00 0.00 H new ATOM 0 HD11 LEU A 114 1.809 5.332 7.342 1.00 0.00 H new ATOM 0 HD12 LEU A 114 1.586 4.789 5.662 1.00 0.00 H new ATOM 0 HD13 LEU A 114 2.157 3.644 6.899 1.00 0.00 H new ATOM 0 HD21 LEU A 114 4.114 5.552 8.286 1.00 0.00 H new ATOM 0 HD22 LEU A 114 4.460 3.865 7.838 1.00 0.00 H new ATOM 0 HD23 LEU A 114 5.530 5.172 7.277 1.00 0.00 H new ATOM 1797 N VAL A 115 6.967 4.272 2.823 1.00 0.00 N ATOM 1798 CA VAL A 115 7.632 3.410 1.805 1.00 0.00 C ATOM 1799 C VAL A 115 8.771 2.592 2.425 1.00 0.00 C ATOM 1800 O VAL A 115 9.504 3.059 3.274 1.00 0.00 O ATOM 1801 CB VAL A 115 8.180 4.291 0.677 1.00 0.00 C ATOM 1802 CG1 VAL A 115 9.245 5.249 1.223 1.00 0.00 C ATOM 1803 CG2 VAL A 115 8.795 3.399 -0.404 1.00 0.00 C ATOM 0 H VAL A 115 7.531 5.046 3.175 1.00 0.00 H new ATOM 0 HA VAL A 115 6.895 2.712 1.409 1.00 0.00 H new ATOM 0 HB VAL A 115 7.366 4.878 0.252 1.00 0.00 H new ATOM 0 HG11 VAL A 115 9.626 5.869 0.412 1.00 0.00 H new ATOM 0 HG12 VAL A 115 8.803 5.885 1.990 1.00 0.00 H new ATOM 0 HG13 VAL A 115 10.064 4.674 1.656 1.00 0.00 H new ATOM 0 HG21 VAL A 115 9.187 4.021 -1.209 1.00 0.00 H new ATOM 0 HG22 VAL A 115 9.605 2.811 0.027 1.00 0.00 H new ATOM 0 HG23 VAL A 115 8.032 2.729 -0.801 1.00 0.00 H new ATOM 1813 N THR A 116 8.926 1.372 1.978 1.00 0.00 N ATOM 1814 CA THR A 116 10.020 0.505 2.501 1.00 0.00 C ATOM 1815 C THR A 116 11.045 0.290 1.386 1.00 0.00 C ATOM 1816 O THR A 116 10.758 -0.338 0.387 1.00 0.00 O ATOM 1817 CB THR A 116 9.453 -0.855 2.929 1.00 0.00 C ATOM 1818 OG1 THR A 116 8.132 -0.693 3.428 1.00 0.00 O ATOM 1819 CG2 THR A 116 10.340 -1.457 4.019 1.00 0.00 C ATOM 0 H THR A 116 8.336 0.938 1.268 1.00 0.00 H new ATOM 0 HA THR A 116 10.486 0.984 3.362 1.00 0.00 H new ATOM 0 HB THR A 116 9.431 -1.521 2.067 1.00 0.00 H new ATOM 0 HG1 THR A 116 7.775 -1.565 3.698 1.00 0.00 H new ATOM 0 HG21 THR A 116 9.937 -2.423 4.323 1.00 0.00 H new ATOM 0 HG22 THR A 116 11.351 -1.590 3.633 1.00 0.00 H new ATOM 0 HG23 THR A 116 10.365 -0.787 4.879 1.00 0.00 H new ATOM 1827 N ARG A 117 12.232 0.813 1.540 1.00 0.00 N ATOM 1828 CA ARG A 117 13.265 0.643 0.478 1.00 0.00 C ATOM 1829 C ARG A 117 14.144 -0.571 0.796 1.00 0.00 C ATOM 1830 O ARG A 117 14.851 -0.589 1.784 1.00 0.00 O ATOM 1831 CB ARG A 117 14.140 1.899 0.416 1.00 0.00 C ATOM 1832 CG ARG A 117 13.581 2.867 -0.631 1.00 0.00 C ATOM 1833 CD ARG A 117 14.736 3.592 -1.328 1.00 0.00 C ATOM 1834 NE ARG A 117 14.363 5.022 -1.556 1.00 0.00 N ATOM 1835 CZ ARG A 117 14.198 5.498 -2.771 1.00 0.00 C ATOM 1836 NH1 ARG A 117 14.346 4.736 -3.826 1.00 0.00 N ATOM 1837 NH2 ARG A 117 13.878 6.754 -2.928 1.00 0.00 N ATOM 0 H ARG A 117 12.530 1.350 2.354 1.00 0.00 H new ATOM 0 HA ARG A 117 12.772 0.489 -0.482 1.00 0.00 H new ATOM 0 HB2 ARG A 117 14.169 2.382 1.393 1.00 0.00 H new ATOM 0 HB3 ARG A 117 15.165 1.628 0.164 1.00 0.00 H new ATOM 0 HG2 ARG A 117 12.985 2.322 -1.363 1.00 0.00 H new ATOM 0 HG3 ARG A 117 12.918 3.590 -0.156 1.00 0.00 H new ATOM 0 HD2 ARG A 117 15.637 3.533 -0.718 1.00 0.00 H new ATOM 0 HD3 ARG A 117 14.962 3.108 -2.278 1.00 0.00 H new ATOM 0 HE ARG A 117 14.234 5.640 -0.755 1.00 0.00 H new ATOM 0 HH11 ARG A 117 14.594 3.753 -3.714 1.00 0.00 H new ATOM 0 HH12 ARG A 117 14.213 5.126 -4.759 1.00 0.00 H new ATOM 0 HH21 ARG A 117 13.758 7.356 -2.113 1.00 0.00 H new ATOM 0 HH22 ARG A 117 13.748 7.134 -3.866 1.00 0.00 H new ATOM 1851 N LEU A 118 14.117 -1.579 -0.040 1.00 0.00 N ATOM 1852 CA LEU A 118 14.966 -2.780 0.215 1.00 0.00 C ATOM 1853 C LEU A 118 16.376 -2.504 -0.315 1.00 0.00 C ATOM 1854 O LEU A 118 16.564 -1.695 -1.202 1.00 0.00 O ATOM 1855 CB LEU A 118 14.380 -4.006 -0.500 1.00 0.00 C ATOM 1856 CG LEU A 118 13.079 -4.439 0.184 1.00 0.00 C ATOM 1857 CD1 LEU A 118 11.943 -3.512 -0.243 1.00 0.00 C ATOM 1858 CD2 LEU A 118 12.736 -5.876 -0.224 1.00 0.00 C ATOM 0 H LEU A 118 13.546 -1.621 -0.884 1.00 0.00 H new ATOM 0 HA LEU A 118 14.998 -2.983 1.285 1.00 0.00 H new ATOM 0 HB2 LEU A 118 14.189 -3.770 -1.547 1.00 0.00 H new ATOM 0 HB3 LEU A 118 15.099 -4.825 -0.484 1.00 0.00 H new ATOM 0 HG LEU A 118 13.208 -4.387 1.265 1.00 0.00 H new ATOM 0 HD11 LEU A 118 11.018 -3.821 0.244 1.00 0.00 H new ATOM 0 HD12 LEU A 118 12.181 -2.488 0.046 1.00 0.00 H new ATOM 0 HD13 LEU A 118 11.818 -3.564 -1.325 1.00 0.00 H new ATOM 0 HD21 LEU A 118 11.810 -6.182 0.264 1.00 0.00 H new ATOM 0 HD22 LEU A 118 12.610 -5.927 -1.306 1.00 0.00 H new ATOM 0 HD23 LEU A 118 13.543 -6.543 0.079 1.00 0.00 H new ATOM 1870 N ALA A 119 17.368 -3.160 0.225 1.00 0.00 N ATOM 1871 CA ALA A 119 18.764 -2.920 -0.246 1.00 0.00 C ATOM 1872 C ALA A 119 19.029 -3.713 -1.529 1.00 0.00 C ATOM 1873 O ALA A 119 19.859 -3.341 -2.335 1.00 0.00 O ATOM 1874 CB ALA A 119 19.750 -3.362 0.836 1.00 0.00 C ATOM 0 H ALA A 119 17.273 -3.850 0.970 1.00 0.00 H new ATOM 0 HA ALA A 119 18.893 -1.857 -0.450 1.00 0.00 H new ATOM 0 HB1 ALA A 119 20.770 -3.187 0.493 1.00 0.00 H new ATOM 0 HB2 ALA A 119 19.571 -2.791 1.747 1.00 0.00 H new ATOM 0 HB3 ALA A 119 19.613 -4.424 1.041 1.00 0.00 H new ATOM 1880 N GLY A 120 18.339 -4.805 -1.722 1.00 0.00 N ATOM 1881 CA GLY A 120 18.561 -5.620 -2.951 1.00 0.00 C ATOM 1882 C GLY A 120 17.787 -5.012 -4.121 1.00 0.00 C ATOM 1883 O GLY A 120 17.044 -4.064 -3.960 1.00 0.00 O ATOM 0 H GLY A 120 17.632 -5.168 -1.082 1.00 0.00 H new ATOM 0 HA2 GLY A 120 19.625 -5.657 -3.187 1.00 0.00 H new ATOM 0 HA3 GLY A 120 18.236 -6.646 -2.782 1.00 0.00 H new ATOM 1887 N SER A 121 17.956 -5.552 -5.299 1.00 0.00 N ATOM 1888 CA SER A 121 17.233 -5.010 -6.484 1.00 0.00 C ATOM 1889 C SER A 121 16.484 -6.143 -7.188 1.00 0.00 C ATOM 1890 O SER A 121 17.077 -7.100 -7.647 1.00 0.00 O ATOM 1891 CB SER A 121 18.240 -4.389 -7.451 1.00 0.00 C ATOM 1892 OG SER A 121 19.005 -5.421 -8.059 1.00 0.00 O ATOM 0 H SER A 121 18.565 -6.347 -5.491 1.00 0.00 H new ATOM 0 HA SER A 121 16.521 -4.251 -6.160 1.00 0.00 H new ATOM 0 HB2 SER A 121 17.720 -3.809 -8.213 1.00 0.00 H new ATOM 0 HB3 SER A 121 18.896 -3.700 -6.919 1.00 0.00 H new ATOM 0 HG SER A 121 18.690 -6.293 -7.741 1.00 0.00 H new ATOM 1898 N PHE A 122 15.185 -6.045 -7.269 1.00 0.00 N ATOM 1899 CA PHE A 122 14.391 -7.116 -7.935 1.00 0.00 C ATOM 1900 C PHE A 122 13.835 -6.589 -9.260 1.00 0.00 C ATOM 1901 O PHE A 122 13.776 -5.397 -9.488 1.00 0.00 O ATOM 1902 CB PHE A 122 13.241 -7.542 -7.019 1.00 0.00 C ATOM 1903 CG PHE A 122 13.792 -7.859 -5.649 1.00 0.00 C ATOM 1904 CD1 PHE A 122 13.987 -6.831 -4.720 1.00 0.00 C ATOM 1905 CD2 PHE A 122 14.116 -9.179 -5.311 1.00 0.00 C ATOM 1906 CE1 PHE A 122 14.504 -7.120 -3.452 1.00 0.00 C ATOM 1907 CE2 PHE A 122 14.635 -9.469 -4.042 1.00 0.00 C ATOM 1908 CZ PHE A 122 14.828 -8.439 -3.112 1.00 0.00 C ATOM 0 H PHE A 122 14.638 -5.267 -6.901 1.00 0.00 H new ATOM 0 HA PHE A 122 15.030 -7.977 -8.132 1.00 0.00 H new ATOM 0 HB2 PHE A 122 12.500 -6.746 -6.951 1.00 0.00 H new ATOM 0 HB3 PHE A 122 12.735 -8.415 -7.432 1.00 0.00 H new ATOM 0 HD1 PHE A 122 13.738 -5.813 -4.982 1.00 0.00 H new ATOM 0 HD2 PHE A 122 13.966 -9.973 -6.028 1.00 0.00 H new ATOM 0 HE1 PHE A 122 14.653 -6.326 -2.736 1.00 0.00 H new ATOM 0 HE2 PHE A 122 14.886 -10.486 -3.781 1.00 0.00 H new ATOM 0 HZ PHE A 122 15.226 -8.662 -2.133 1.00 0.00 H new ATOM 1918 N GLU A 123 13.428 -7.470 -10.135 1.00 0.00 N ATOM 1919 CA GLU A 123 12.878 -7.020 -11.448 1.00 0.00 C ATOM 1920 C GLU A 123 11.380 -7.337 -11.527 1.00 0.00 C ATOM 1921 O GLU A 123 10.885 -8.224 -10.860 1.00 0.00 O ATOM 1922 CB GLU A 123 13.614 -7.729 -12.589 1.00 0.00 C ATOM 1923 CG GLU A 123 13.495 -9.247 -12.424 1.00 0.00 C ATOM 1924 CD GLU A 123 12.383 -9.775 -13.332 1.00 0.00 C ATOM 1925 OE1 GLU A 123 11.251 -9.825 -12.881 1.00 0.00 O ATOM 1926 OE2 GLU A 123 12.683 -10.119 -14.463 1.00 0.00 O ATOM 0 H GLU A 123 13.452 -8.480 -9.998 1.00 0.00 H new ATOM 0 HA GLU A 123 13.020 -5.943 -11.540 1.00 0.00 H new ATOM 0 HB2 GLU A 123 13.195 -7.425 -13.548 1.00 0.00 H new ATOM 0 HB3 GLU A 123 14.664 -7.436 -12.593 1.00 0.00 H new ATOM 0 HG2 GLU A 123 14.442 -9.726 -12.675 1.00 0.00 H new ATOM 0 HG3 GLU A 123 13.278 -9.494 -11.385 1.00 0.00 H new ATOM 1933 N GLY A 124 10.662 -6.613 -12.346 1.00 0.00 N ATOM 1934 CA GLY A 124 9.196 -6.854 -12.490 1.00 0.00 C ATOM 1935 C GLY A 124 8.659 -5.960 -13.611 1.00 0.00 C ATOM 1936 O GLY A 124 9.404 -5.515 -14.461 1.00 0.00 O ATOM 0 H GLY A 124 11.032 -5.859 -12.925 1.00 0.00 H new ATOM 0 HA2 GLY A 124 9.006 -7.903 -12.719 1.00 0.00 H new ATOM 0 HA3 GLY A 124 8.683 -6.635 -11.553 1.00 0.00 H new ATOM 1940 N ASP A 125 7.380 -5.682 -13.623 1.00 0.00 N ATOM 1941 CA ASP A 125 6.813 -4.802 -14.687 1.00 0.00 C ATOM 1942 C ASP A 125 5.877 -3.767 -14.040 1.00 0.00 C ATOM 1943 O ASP A 125 5.492 -2.792 -14.656 1.00 0.00 O ATOM 1944 CB ASP A 125 6.023 -5.652 -15.687 1.00 0.00 C ATOM 1945 CG ASP A 125 6.825 -5.798 -16.982 1.00 0.00 C ATOM 1946 OD1 ASP A 125 7.854 -6.452 -16.948 1.00 0.00 O ATOM 1947 OD2 ASP A 125 6.396 -5.253 -17.986 1.00 0.00 O ATOM 0 H ASP A 125 6.704 -6.027 -12.941 1.00 0.00 H new ATOM 0 HA ASP A 125 7.621 -4.290 -15.209 1.00 0.00 H new ATOM 0 HB2 ASP A 125 5.817 -6.634 -15.262 1.00 0.00 H new ATOM 0 HB3 ASP A 125 5.060 -5.186 -15.894 1.00 0.00 H new ATOM 1952 N THR A 126 5.520 -3.974 -12.797 1.00 0.00 N ATOM 1953 CA THR A 126 4.625 -3.013 -12.094 1.00 0.00 C ATOM 1954 C THR A 126 5.453 -2.256 -11.059 1.00 0.00 C ATOM 1955 O THR A 126 6.000 -2.842 -10.145 1.00 0.00 O ATOM 1956 CB THR A 126 3.500 -3.776 -11.389 1.00 0.00 C ATOM 1957 OG1 THR A 126 3.096 -4.872 -12.198 1.00 0.00 O ATOM 1958 CG2 THR A 126 2.311 -2.844 -11.158 1.00 0.00 C ATOM 0 H THR A 126 5.814 -4.775 -12.238 1.00 0.00 H new ATOM 0 HA THR A 126 4.186 -2.318 -12.810 1.00 0.00 H new ATOM 0 HB THR A 126 3.858 -4.144 -10.428 1.00 0.00 H new ATOM 0 HG1 THR A 126 2.377 -5.363 -11.748 1.00 0.00 H new ATOM 0 HG21 THR A 126 1.512 -3.390 -10.656 1.00 0.00 H new ATOM 0 HG22 THR A 126 2.622 -2.004 -10.537 1.00 0.00 H new ATOM 0 HG23 THR A 126 1.949 -2.472 -12.116 1.00 0.00 H new ATOM 1966 N LYS A 127 5.561 -0.963 -11.197 1.00 0.00 N ATOM 1967 CA LYS A 127 6.371 -0.177 -10.223 1.00 0.00 C ATOM 1968 C LYS A 127 5.512 0.910 -9.585 1.00 0.00 C ATOM 1969 O LYS A 127 4.480 1.292 -10.102 1.00 0.00 O ATOM 1970 CB LYS A 127 7.554 0.470 -10.951 1.00 0.00 C ATOM 1971 CG LYS A 127 8.562 -0.611 -11.353 1.00 0.00 C ATOM 1972 CD LYS A 127 9.788 0.040 -12.004 1.00 0.00 C ATOM 1973 CE LYS A 127 11.038 -0.269 -11.176 1.00 0.00 C ATOM 1974 NZ LYS A 127 12.181 -0.555 -12.089 1.00 0.00 N ATOM 0 H LYS A 127 5.125 -0.418 -11.940 1.00 0.00 H new ATOM 0 HA LYS A 127 6.738 -0.844 -9.443 1.00 0.00 H new ATOM 0 HB2 LYS A 127 7.203 1.002 -11.836 1.00 0.00 H new ATOM 0 HB3 LYS A 127 8.033 1.206 -10.306 1.00 0.00 H new ATOM 0 HG2 LYS A 127 8.865 -1.183 -10.476 1.00 0.00 H new ATOM 0 HG3 LYS A 127 8.100 -1.313 -12.047 1.00 0.00 H new ATOM 0 HD2 LYS A 127 9.912 -0.333 -13.021 1.00 0.00 H new ATOM 0 HD3 LYS A 127 9.644 1.118 -12.075 1.00 0.00 H new ATOM 0 HE2 LYS A 127 11.277 0.576 -10.530 1.00 0.00 H new ATOM 0 HE3 LYS A 127 10.855 -1.125 -10.527 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 12.936 -1.037 -11.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 11.859 -1.165 -12.867 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 12.547 0.338 -12.478 1.00 0.00 H new ATOM 1988 N MET A 128 5.941 1.410 -8.461 1.00 0.00 N ATOM 1989 CA MET A 128 5.169 2.471 -7.764 1.00 0.00 C ATOM 1990 C MET A 128 5.095 3.722 -8.639 1.00 0.00 C ATOM 1991 O MET A 128 5.948 3.963 -9.472 1.00 0.00 O ATOM 1992 CB MET A 128 5.865 2.810 -6.447 1.00 0.00 C ATOM 1993 CG MET A 128 4.825 3.278 -5.430 1.00 0.00 C ATOM 1994 SD MET A 128 4.866 5.082 -5.306 1.00 0.00 S ATOM 1995 CE MET A 128 3.599 5.235 -4.027 1.00 0.00 C ATOM 0 H MET A 128 6.801 1.125 -7.992 1.00 0.00 H new ATOM 0 HA MET A 128 4.158 2.115 -7.568 1.00 0.00 H new ATOM 0 HB2 MET A 128 6.394 1.936 -6.067 1.00 0.00 H new ATOM 0 HB3 MET A 128 6.610 3.589 -6.607 1.00 0.00 H new ATOM 0 HG2 MET A 128 3.831 2.947 -5.732 1.00 0.00 H new ATOM 0 HG3 MET A 128 5.027 2.832 -4.456 1.00 0.00 H new ATOM 0 HE1 MET A 128 2.878 5.999 -4.319 1.00 0.00 H new ATOM 0 HE2 MET A 128 3.087 4.280 -3.906 1.00 0.00 H new ATOM 0 HE3 MET A 128 4.066 5.519 -3.084 1.00 0.00 H new ATOM 2005 N ILE A 129 4.072 4.511 -8.460 1.00 0.00 N ATOM 2006 CA ILE A 129 3.915 5.747 -9.279 1.00 0.00 C ATOM 2007 C ILE A 129 4.936 6.802 -8.834 1.00 0.00 C ATOM 2008 O ILE A 129 5.552 6.666 -7.796 1.00 0.00 O ATOM 2009 CB ILE A 129 2.497 6.288 -9.081 1.00 0.00 C ATOM 2010 CG1 ILE A 129 2.219 6.461 -7.582 1.00 0.00 C ATOM 2011 CG2 ILE A 129 1.492 5.298 -9.673 1.00 0.00 C ATOM 2012 CD1 ILE A 129 2.023 7.943 -7.261 1.00 0.00 C ATOM 0 H ILE A 129 3.332 4.352 -7.776 1.00 0.00 H new ATOM 0 HA ILE A 129 4.084 5.517 -10.331 1.00 0.00 H new ATOM 0 HB ILE A 129 2.401 7.252 -9.581 1.00 0.00 H new ATOM 0 HG12 ILE A 129 1.330 5.897 -7.300 1.00 0.00 H new ATOM 0 HG13 ILE A 129 3.049 6.060 -7.000 1.00 0.00 H new ATOM 0 HG21 ILE A 129 0.480 5.680 -9.534 1.00 0.00 H new ATOM 0 HG22 ILE A 129 1.689 5.172 -10.738 1.00 0.00 H new ATOM 0 HG23 ILE A 129 1.589 4.336 -9.170 1.00 0.00 H new ATOM 0 HD11 ILE A 129 1.826 8.062 -6.196 1.00 0.00 H new ATOM 0 HD12 ILE A 129 2.924 8.495 -7.527 1.00 0.00 H new ATOM 0 HD13 ILE A 129 1.179 8.330 -7.831 1.00 0.00 H new ATOM 2024 N PRO A 130 5.087 7.825 -9.643 1.00 0.00 N ATOM 2025 CA PRO A 130 6.031 8.977 -9.425 1.00 0.00 C ATOM 2026 C PRO A 130 5.525 9.869 -8.288 1.00 0.00 C ATOM 2027 O PRO A 130 4.635 10.678 -8.471 1.00 0.00 O ATOM 2028 CB PRO A 130 6.081 9.769 -10.730 1.00 0.00 C ATOM 2029 CG PRO A 130 5.076 9.155 -11.682 1.00 0.00 C ATOM 2030 CD PRO A 130 4.348 8.044 -10.936 1.00 0.00 C ATOM 0 HA PRO A 130 7.022 8.617 -9.150 1.00 0.00 H new ATOM 0 HB2 PRO A 130 5.845 10.818 -10.550 1.00 0.00 H new ATOM 0 HB3 PRO A 130 7.083 9.737 -11.159 1.00 0.00 H new ATOM 0 HG2 PRO A 130 4.369 9.908 -12.030 1.00 0.00 H new ATOM 0 HG3 PRO A 130 5.578 8.758 -12.564 1.00 0.00 H new ATOM 0 HD2 PRO A 130 3.311 8.322 -10.745 1.00 0.00 H new ATOM 0 HD3 PRO A 130 4.329 7.130 -11.529 1.00 0.00 H new ATOM 2038 N LEU A 131 6.078 9.721 -7.113 1.00 0.00 N ATOM 2039 CA LEU A 131 5.624 10.553 -5.962 1.00 0.00 C ATOM 2040 C LEU A 131 6.435 11.850 -5.909 1.00 0.00 C ATOM 2041 O LEU A 131 7.564 11.907 -6.358 1.00 0.00 O ATOM 2042 CB LEU A 131 5.827 9.775 -4.661 1.00 0.00 C ATOM 2043 CG LEU A 131 4.611 8.887 -4.401 1.00 0.00 C ATOM 2044 CD1 LEU A 131 4.895 7.973 -3.208 1.00 0.00 C ATOM 2045 CD2 LEU A 131 3.392 9.764 -4.098 1.00 0.00 C ATOM 0 H LEU A 131 6.825 9.059 -6.901 1.00 0.00 H new ATOM 0 HA LEU A 131 4.568 10.793 -6.086 1.00 0.00 H new ATOM 0 HB2 LEU A 131 6.728 9.165 -4.727 1.00 0.00 H new ATOM 0 HB3 LEU A 131 5.970 10.466 -3.830 1.00 0.00 H new ATOM 0 HG LEU A 131 4.408 8.280 -5.283 1.00 0.00 H new ATOM 0 HD11 LEU A 131 4.028 7.339 -3.021 1.00 0.00 H new ATOM 0 HD12 LEU A 131 5.761 7.349 -3.426 1.00 0.00 H new ATOM 0 HD13 LEU A 131 5.098 8.579 -2.325 1.00 0.00 H new ATOM 0 HD21 LEU A 131 2.525 9.130 -3.913 1.00 0.00 H new ATOM 0 HD22 LEU A 131 3.592 10.373 -3.216 1.00 0.00 H new ATOM 0 HD23 LEU A 131 3.191 10.414 -4.949 1.00 0.00 H new ATOM 2057 N ASN A 132 5.862 12.895 -5.372 1.00 0.00 N ATOM 2058 CA ASN A 132 6.589 14.196 -5.297 1.00 0.00 C ATOM 2059 C ASN A 132 7.282 14.330 -3.936 1.00 0.00 C ATOM 2060 O ASN A 132 6.894 15.126 -3.105 1.00 0.00 O ATOM 2061 CB ASN A 132 5.590 15.343 -5.483 1.00 0.00 C ATOM 2062 CG ASN A 132 6.207 16.419 -6.378 1.00 0.00 C ATOM 2063 OD1 ASN A 132 5.872 16.522 -7.542 1.00 0.00 O ATOM 2064 ND2 ASN A 132 7.100 17.231 -5.882 1.00 0.00 N ATOM 0 H ASN A 132 4.920 12.903 -4.981 1.00 0.00 H new ATOM 0 HA ASN A 132 7.343 14.235 -6.083 1.00 0.00 H new ATOM 0 HB2 ASN A 132 4.669 14.968 -5.930 1.00 0.00 H new ATOM 0 HB3 ASN A 132 5.325 15.769 -4.515 1.00 0.00 H new ATOM 0 HD21 ASN A 132 7.517 17.952 -6.471 1.00 0.00 H new ATOM 0 HD22 ASN A 132 7.381 17.145 -4.905 1.00 0.00 H new ATOM 2071 N TRP A 133 8.305 13.551 -3.704 1.00 0.00 N ATOM 2072 CA TRP A 133 9.029 13.622 -2.397 1.00 0.00 C ATOM 2073 C TRP A 133 9.429 15.072 -2.101 1.00 0.00 C ATOM 2074 O TRP A 133 9.534 15.476 -0.959 1.00 0.00 O ATOM 2075 CB TRP A 133 10.288 12.751 -2.462 1.00 0.00 C ATOM 2076 CG TRP A 133 9.912 11.369 -2.891 1.00 0.00 C ATOM 2077 CD1 TRP A 133 9.963 10.910 -4.162 1.00 0.00 C ATOM 2078 CD2 TRP A 133 9.427 10.265 -2.075 1.00 0.00 C ATOM 2079 NE1 TRP A 133 9.530 9.597 -4.179 1.00 0.00 N ATOM 2080 CE2 TRP A 133 9.191 9.154 -2.917 1.00 0.00 C ATOM 2081 CE3 TRP A 133 9.169 10.121 -0.700 1.00 0.00 C ATOM 2082 CZ2 TRP A 133 8.715 7.944 -2.414 1.00 0.00 C ATOM 2083 CZ3 TRP A 133 8.691 8.904 -0.190 1.00 0.00 C ATOM 2084 CH2 TRP A 133 8.464 7.818 -1.046 1.00 0.00 C ATOM 0 H TRP A 133 8.673 12.866 -4.364 1.00 0.00 H new ATOM 0 HA TRP A 133 8.373 13.261 -1.605 1.00 0.00 H new ATOM 0 HB2 TRP A 133 11.004 13.179 -3.163 1.00 0.00 H new ATOM 0 HB3 TRP A 133 10.774 12.722 -1.487 1.00 0.00 H new ATOM 0 HD1 TRP A 133 10.288 11.476 -5.022 1.00 0.00 H new ATOM 0 HE1 TRP A 133 9.469 9.026 -5.022 1.00 0.00 H new ATOM 0 HE3 TRP A 133 9.340 10.952 -0.032 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 8.542 7.110 -3.078 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 8.497 8.804 0.868 1.00 0.00 H new ATOM 0 HH2 TRP A 133 8.095 6.884 -0.648 1.00 0.00 H new ATOM 2095 N ASP A 134 9.652 15.855 -3.122 1.00 0.00 N ATOM 2096 CA ASP A 134 10.045 17.278 -2.905 1.00 0.00 C ATOM 2097 C ASP A 134 8.904 18.037 -2.218 1.00 0.00 C ATOM 2098 O ASP A 134 9.127 19.016 -1.532 1.00 0.00 O ATOM 2099 CB ASP A 134 10.357 17.931 -4.255 1.00 0.00 C ATOM 2100 CG ASP A 134 11.708 18.647 -4.179 1.00 0.00 C ATOM 2101 OD1 ASP A 134 12.697 17.978 -3.926 1.00 0.00 O ATOM 2102 OD2 ASP A 134 11.730 19.851 -4.373 1.00 0.00 O ATOM 0 H ASP A 134 9.579 15.570 -4.099 1.00 0.00 H new ATOM 0 HA ASP A 134 10.929 17.313 -2.269 1.00 0.00 H new ATOM 0 HB2 ASP A 134 10.378 17.175 -5.040 1.00 0.00 H new ATOM 0 HB3 ASP A 134 9.572 18.641 -4.517 1.00 0.00 H new ATOM 2107 N ASP A 135 7.685 17.600 -2.398 1.00 0.00 N ATOM 2108 CA ASP A 135 6.532 18.301 -1.758 1.00 0.00 C ATOM 2109 C ASP A 135 6.242 17.683 -0.383 1.00 0.00 C ATOM 2110 O ASP A 135 5.468 18.212 0.391 1.00 0.00 O ATOM 2111 CB ASP A 135 5.295 18.159 -2.653 1.00 0.00 C ATOM 2112 CG ASP A 135 4.857 19.538 -3.150 1.00 0.00 C ATOM 2113 OD1 ASP A 135 5.601 20.137 -3.909 1.00 0.00 O ATOM 2114 OD2 ASP A 135 3.783 19.971 -2.764 1.00 0.00 O ATOM 0 H ASP A 135 7.438 16.787 -2.961 1.00 0.00 H new ATOM 0 HA ASP A 135 6.776 19.356 -1.631 1.00 0.00 H new ATOM 0 HB2 ASP A 135 5.520 17.511 -3.500 1.00 0.00 H new ATOM 0 HB3 ASP A 135 4.484 17.688 -2.097 1.00 0.00 H new ATOM 2119 N PHE A 136 6.857 16.572 -0.075 1.00 0.00 N ATOM 2120 CA PHE A 136 6.616 15.927 1.248 1.00 0.00 C ATOM 2121 C PHE A 136 7.899 15.971 2.078 1.00 0.00 C ATOM 2122 O PHE A 136 8.975 16.209 1.565 1.00 0.00 O ATOM 2123 CB PHE A 136 6.204 14.468 1.047 1.00 0.00 C ATOM 2124 CG PHE A 136 4.822 14.398 0.442 1.00 0.00 C ATOM 2125 CD1 PHE A 136 4.617 14.801 -0.882 1.00 0.00 C ATOM 2126 CD2 PHE A 136 3.749 13.914 1.201 1.00 0.00 C ATOM 2127 CE1 PHE A 136 3.340 14.720 -1.449 1.00 0.00 C ATOM 2128 CE2 PHE A 136 2.472 13.835 0.634 1.00 0.00 C ATOM 2129 CZ PHE A 136 2.268 14.237 -0.691 1.00 0.00 C ATOM 0 H PHE A 136 7.515 16.084 -0.682 1.00 0.00 H new ATOM 0 HA PHE A 136 5.820 16.463 1.765 1.00 0.00 H new ATOM 0 HB2 PHE A 136 6.920 13.966 0.396 1.00 0.00 H new ATOM 0 HB3 PHE A 136 6.218 13.943 2.002 1.00 0.00 H new ATOM 0 HD1 PHE A 136 5.445 15.175 -1.467 1.00 0.00 H new ATOM 0 HD2 PHE A 136 3.907 13.602 2.223 1.00 0.00 H new ATOM 0 HE1 PHE A 136 3.182 15.030 -2.471 1.00 0.00 H new ATOM 0 HE2 PHE A 136 1.644 13.464 1.219 1.00 0.00 H new ATOM 0 HZ PHE A 136 1.283 14.174 -1.128 1.00 0.00 H new ATOM 2139 N THR A 137 7.792 15.736 3.358 1.00 0.00 N ATOM 2140 CA THR A 137 9.001 15.752 4.229 1.00 0.00 C ATOM 2141 C THR A 137 8.994 14.508 5.120 1.00 0.00 C ATOM 2142 O THR A 137 8.000 14.190 5.742 1.00 0.00 O ATOM 2143 CB THR A 137 8.982 17.008 5.104 1.00 0.00 C ATOM 2144 OG1 THR A 137 8.589 18.124 4.317 1.00 0.00 O ATOM 2145 CG2 THR A 137 10.377 17.253 5.679 1.00 0.00 C ATOM 0 H THR A 137 6.916 15.533 3.839 1.00 0.00 H new ATOM 0 HA THR A 137 9.899 15.756 3.612 1.00 0.00 H new ATOM 0 HB THR A 137 8.274 16.871 5.922 1.00 0.00 H new ATOM 0 HG1 THR A 137 8.727 18.949 4.827 1.00 0.00 H new ATOM 0 HG21 THR A 137 10.362 18.148 6.302 1.00 0.00 H new ATOM 0 HG22 THR A 137 10.678 16.396 6.282 1.00 0.00 H new ATOM 0 HG23 THR A 137 11.088 17.390 4.864 1.00 0.00 H new ATOM 2153 N LYS A 138 10.090 13.796 5.186 1.00 0.00 N ATOM 2154 CA LYS A 138 10.139 12.568 6.031 1.00 0.00 C ATOM 2155 C LYS A 138 10.186 12.964 7.510 1.00 0.00 C ATOM 2156 O LYS A 138 11.095 13.638 7.952 1.00 0.00 O ATOM 2157 CB LYS A 138 11.398 11.775 5.670 1.00 0.00 C ATOM 2158 CG LYS A 138 11.320 10.371 6.271 1.00 0.00 C ATOM 2159 CD LYS A 138 12.153 10.318 7.553 1.00 0.00 C ATOM 2160 CE LYS A 138 13.642 10.369 7.198 1.00 0.00 C ATOM 2161 NZ LYS A 138 13.988 9.220 6.310 1.00 0.00 N ATOM 0 H LYS A 138 10.954 14.014 4.690 1.00 0.00 H new ATOM 0 HA LYS A 138 9.253 11.959 5.855 1.00 0.00 H new ATOM 0 HB2 LYS A 138 11.500 11.711 4.587 1.00 0.00 H new ATOM 0 HB3 LYS A 138 12.283 12.291 6.043 1.00 0.00 H new ATOM 0 HG2 LYS A 138 10.283 10.114 6.487 1.00 0.00 H new ATOM 0 HG3 LYS A 138 11.688 9.636 5.555 1.00 0.00 H new ATOM 0 HD2 LYS A 138 11.894 11.155 8.202 1.00 0.00 H new ATOM 0 HD3 LYS A 138 11.931 9.405 8.106 1.00 0.00 H new ATOM 0 HE2 LYS A 138 13.875 11.310 6.699 1.00 0.00 H new ATOM 0 HE3 LYS A 138 14.244 10.333 8.106 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 14.978 8.944 6.469 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 13.365 8.415 6.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 13.862 9.499 5.316 1.00 0.00 H new ATOM 2175 N VAL A 139 9.203 12.561 8.274 1.00 0.00 N ATOM 2176 CA VAL A 139 9.180 12.925 9.722 1.00 0.00 C ATOM 2177 C VAL A 139 9.694 11.761 10.576 1.00 0.00 C ATOM 2178 O VAL A 139 10.147 11.957 11.688 1.00 0.00 O ATOM 2179 CB VAL A 139 7.746 13.262 10.142 1.00 0.00 C ATOM 2180 CG1 VAL A 139 7.294 14.545 9.443 1.00 0.00 C ATOM 2181 CG2 VAL A 139 6.814 12.115 9.747 1.00 0.00 C ATOM 0 H VAL A 139 8.415 11.996 7.957 1.00 0.00 H new ATOM 0 HA VAL A 139 9.826 13.790 9.875 1.00 0.00 H new ATOM 0 HB VAL A 139 7.712 13.405 11.222 1.00 0.00 H new ATOM 0 HG11 VAL A 139 6.274 14.783 9.743 1.00 0.00 H new ATOM 0 HG12 VAL A 139 7.955 15.365 9.724 1.00 0.00 H new ATOM 0 HG13 VAL A 139 7.331 14.403 8.363 1.00 0.00 H new ATOM 0 HG21 VAL A 139 5.794 12.356 10.046 1.00 0.00 H new ATOM 0 HG22 VAL A 139 6.851 11.971 8.667 1.00 0.00 H new ATOM 0 HG23 VAL A 139 7.132 11.200 10.246 1.00 0.00 H new ATOM 2191 N SER A 140 9.622 10.552 10.082 1.00 0.00 N ATOM 2192 CA SER A 140 10.102 9.393 10.893 1.00 0.00 C ATOM 2193 C SER A 140 10.721 8.332 9.981 1.00 0.00 C ATOM 2194 O SER A 140 10.205 8.027 8.924 1.00 0.00 O ATOM 2195 CB SER A 140 8.922 8.782 11.649 1.00 0.00 C ATOM 2196 OG SER A 140 8.337 9.771 12.486 1.00 0.00 O ATOM 0 H SER A 140 9.255 10.318 9.160 1.00 0.00 H new ATOM 0 HA SER A 140 10.856 9.741 11.599 1.00 0.00 H new ATOM 0 HB2 SER A 140 8.182 8.401 10.945 1.00 0.00 H new ATOM 0 HB3 SER A 140 9.258 7.935 12.247 1.00 0.00 H new ATOM 0 HG SER A 140 7.579 9.383 12.971 1.00 0.00 H new ATOM 2202 N SER A 141 11.820 7.756 10.396 1.00 0.00 N ATOM 2203 CA SER A 141 12.472 6.702 9.567 1.00 0.00 C ATOM 2204 C SER A 141 13.216 5.715 10.471 1.00 0.00 C ATOM 2205 O SER A 141 13.906 6.103 11.394 1.00 0.00 O ATOM 2206 CB SER A 141 13.464 7.350 8.599 1.00 0.00 C ATOM 2207 OG SER A 141 13.090 7.030 7.265 1.00 0.00 O ATOM 0 H SER A 141 12.293 7.971 11.274 1.00 0.00 H new ATOM 0 HA SER A 141 11.707 6.169 9.003 1.00 0.00 H new ATOM 0 HB2 SER A 141 13.473 8.431 8.738 1.00 0.00 H new ATOM 0 HB3 SER A 141 14.474 6.994 8.802 1.00 0.00 H new ATOM 0 HG SER A 141 12.696 6.133 7.242 1.00 0.00 H new ATOM 2213 N ARG A 142 13.095 4.444 10.202 1.00 0.00 N ATOM 2214 CA ARG A 142 13.805 3.424 11.026 1.00 0.00 C ATOM 2215 C ARG A 142 14.519 2.460 10.078 1.00 0.00 C ATOM 2216 O ARG A 142 13.934 1.979 9.129 1.00 0.00 O ATOM 2217 CB ARG A 142 12.791 2.654 11.875 1.00 0.00 C ATOM 2218 CG ARG A 142 13.501 2.025 13.074 1.00 0.00 C ATOM 2219 CD ARG A 142 12.473 1.331 13.969 1.00 0.00 C ATOM 2220 NE ARG A 142 11.640 2.359 14.659 1.00 0.00 N ATOM 2221 CZ ARG A 142 10.805 2.015 15.609 1.00 0.00 C ATOM 2222 NH1 ARG A 142 10.683 0.763 15.972 1.00 0.00 N ATOM 2223 NH2 ARG A 142 10.086 2.931 16.199 1.00 0.00 N ATOM 0 H ARG A 142 12.531 4.065 9.441 1.00 0.00 H new ATOM 0 HA ARG A 142 14.525 3.906 11.688 1.00 0.00 H new ATOM 0 HB2 ARG A 142 12.003 3.325 12.217 1.00 0.00 H new ATOM 0 HB3 ARG A 142 12.312 1.880 11.275 1.00 0.00 H new ATOM 0 HG2 ARG A 142 14.246 1.306 12.733 1.00 0.00 H new ATOM 0 HG3 ARG A 142 14.032 2.791 13.639 1.00 0.00 H new ATOM 0 HD2 ARG A 142 11.839 0.675 13.372 1.00 0.00 H new ATOM 0 HD3 ARG A 142 12.979 0.704 14.704 1.00 0.00 H new ATOM 0 HE ARG A 142 11.721 3.339 14.389 1.00 0.00 H new ATOM 0 HH11 ARG A 142 11.241 0.043 15.514 1.00 0.00 H new ATOM 0 HH12 ARG A 142 10.030 0.508 16.713 1.00 0.00 H new ATOM 0 HH21 ARG A 142 10.176 3.908 15.920 1.00 0.00 H new ATOM 0 HH22 ARG A 142 9.434 2.670 16.939 1.00 0.00 H new ATOM 2237 N THR A 143 15.772 2.172 10.317 1.00 0.00 N ATOM 2238 CA THR A 143 16.507 1.241 9.409 1.00 0.00 C ATOM 2239 C THR A 143 16.636 -0.132 10.070 1.00 0.00 C ATOM 2240 O THR A 143 17.107 -0.252 11.184 1.00 0.00 O ATOM 2241 CB THR A 143 17.906 1.799 9.129 1.00 0.00 C ATOM 2242 OG1 THR A 143 17.823 3.206 8.926 1.00 0.00 O ATOM 2243 CG2 THR A 143 18.488 1.120 7.884 1.00 0.00 C ATOM 0 H THR A 143 16.316 2.539 11.098 1.00 0.00 H new ATOM 0 HA THR A 143 15.956 1.143 8.474 1.00 0.00 H new ATOM 0 HB THR A 143 18.558 1.600 9.979 1.00 0.00 H new ATOM 0 HG1 THR A 143 18.718 3.564 8.749 1.00 0.00 H new ATOM 0 HG21 THR A 143 19.483 1.517 7.685 1.00 0.00 H new ATOM 0 HG22 THR A 143 18.553 0.045 8.053 1.00 0.00 H new ATOM 0 HG23 THR A 143 17.842 1.314 7.028 1.00 0.00 H new ATOM 2251 N VAL A 144 16.232 -1.170 9.387 1.00 0.00 N ATOM 2252 CA VAL A 144 16.338 -2.536 9.974 1.00 0.00 C ATOM 2253 C VAL A 144 17.090 -3.455 9.003 1.00 0.00 C ATOM 2254 O VAL A 144 16.762 -3.547 7.832 1.00 0.00 O ATOM 2255 CB VAL A 144 14.932 -3.088 10.232 1.00 0.00 C ATOM 2256 CG1 VAL A 144 14.172 -3.193 8.911 1.00 0.00 C ATOM 2257 CG2 VAL A 144 15.032 -4.475 10.874 1.00 0.00 C ATOM 0 H VAL A 144 15.834 -1.130 8.449 1.00 0.00 H new ATOM 0 HA VAL A 144 16.885 -2.489 10.916 1.00 0.00 H new ATOM 0 HB VAL A 144 14.400 -2.415 10.905 1.00 0.00 H new ATOM 0 HG11 VAL A 144 13.172 -3.586 9.097 1.00 0.00 H new ATOM 0 HG12 VAL A 144 14.095 -2.206 8.456 1.00 0.00 H new ATOM 0 HG13 VAL A 144 14.706 -3.863 8.237 1.00 0.00 H new ATOM 0 HG21 VAL A 144 14.030 -4.865 11.056 1.00 0.00 H new ATOM 0 HG22 VAL A 144 15.567 -5.148 10.204 1.00 0.00 H new ATOM 0 HG23 VAL A 144 15.570 -4.401 11.819 1.00 0.00 H new ATOM 2267 N GLU A 145 18.099 -4.132 9.484 1.00 0.00 N ATOM 2268 CA GLU A 145 18.888 -5.043 8.606 1.00 0.00 C ATOM 2269 C GLU A 145 18.255 -6.436 8.606 1.00 0.00 C ATOM 2270 O GLU A 145 17.474 -6.775 9.473 1.00 0.00 O ATOM 2271 CB GLU A 145 20.323 -5.136 9.129 1.00 0.00 C ATOM 2272 CG GLU A 145 21.113 -3.907 8.673 1.00 0.00 C ATOM 2273 CD GLU A 145 22.611 -4.212 8.731 1.00 0.00 C ATOM 2274 OE1 GLU A 145 23.038 -5.117 8.033 1.00 0.00 O ATOM 2275 OE2 GLU A 145 23.305 -3.535 9.472 1.00 0.00 O ATOM 0 H GLU A 145 18.412 -4.092 10.454 1.00 0.00 H new ATOM 0 HA GLU A 145 18.894 -4.650 7.590 1.00 0.00 H new ATOM 0 HB2 GLU A 145 20.321 -5.197 10.217 1.00 0.00 H new ATOM 0 HB3 GLU A 145 20.798 -6.045 8.759 1.00 0.00 H new ATOM 0 HG2 GLU A 145 20.826 -3.633 7.658 1.00 0.00 H new ATOM 0 HG3 GLU A 145 20.880 -3.054 9.311 1.00 0.00 H new ATOM 2282 N ASP A 146 18.591 -7.245 7.637 1.00 0.00 N ATOM 2283 CA ASP A 146 18.016 -8.619 7.573 1.00 0.00 C ATOM 2284 C ASP A 146 19.125 -9.621 7.237 1.00 0.00 C ATOM 2285 O ASP A 146 20.113 -9.281 6.616 1.00 0.00 O ATOM 2286 CB ASP A 146 16.935 -8.668 6.490 1.00 0.00 C ATOM 2287 CG ASP A 146 15.771 -9.541 6.966 1.00 0.00 C ATOM 2288 OD1 ASP A 146 15.051 -9.104 7.848 1.00 0.00 O ATOM 2289 OD2 ASP A 146 15.620 -10.631 6.439 1.00 0.00 O ATOM 0 H ASP A 146 19.240 -7.012 6.886 1.00 0.00 H new ATOM 0 HA ASP A 146 17.576 -8.876 8.537 1.00 0.00 H new ATOM 0 HB2 ASP A 146 16.581 -7.661 6.269 1.00 0.00 H new ATOM 0 HB3 ASP A 146 17.350 -9.070 5.566 1.00 0.00 H new ATOM 2294 N THR A 147 18.966 -10.855 7.639 1.00 0.00 N ATOM 2295 CA THR A 147 20.006 -11.886 7.343 1.00 0.00 C ATOM 2296 C THR A 147 20.178 -12.039 5.825 1.00 0.00 C ATOM 2297 O THR A 147 21.159 -12.581 5.355 1.00 0.00 O ATOM 2298 CB THR A 147 19.568 -13.226 7.941 1.00 0.00 C ATOM 2299 OG1 THR A 147 18.178 -13.417 7.707 1.00 0.00 O ATOM 2300 CG2 THR A 147 19.835 -13.225 9.447 1.00 0.00 C ATOM 0 H THR A 147 18.158 -11.195 8.161 1.00 0.00 H new ATOM 0 HA THR A 147 20.955 -11.575 7.779 1.00 0.00 H new ATOM 0 HB THR A 147 20.131 -14.034 7.473 1.00 0.00 H new ATOM 0 HG1 THR A 147 17.897 -14.275 8.088 1.00 0.00 H new ATOM 0 HG21 THR A 147 19.523 -14.179 9.872 1.00 0.00 H new ATOM 0 HG22 THR A 147 20.900 -13.078 9.628 1.00 0.00 H new ATOM 0 HG23 THR A 147 19.273 -12.417 9.916 1.00 0.00 H new ATOM 2308 N ASN A 148 19.236 -11.557 5.059 1.00 0.00 N ATOM 2309 CA ASN A 148 19.352 -11.667 3.577 1.00 0.00 C ATOM 2310 C ASN A 148 19.764 -10.307 3.000 1.00 0.00 C ATOM 2311 O ASN A 148 19.187 -9.294 3.343 1.00 0.00 O ATOM 2312 CB ASN A 148 18.012 -12.090 2.978 1.00 0.00 C ATOM 2313 CG ASN A 148 18.255 -12.989 1.765 1.00 0.00 C ATOM 2314 OD1 ASN A 148 18.331 -14.195 1.893 1.00 0.00 O ATOM 2315 ND2 ASN A 148 18.380 -12.449 0.583 1.00 0.00 N ATOM 0 H ASN A 148 18.393 -11.093 5.395 1.00 0.00 H new ATOM 0 HA ASN A 148 20.104 -12.416 3.329 1.00 0.00 H new ATOM 0 HB2 ASN A 148 17.420 -12.620 3.724 1.00 0.00 H new ATOM 0 HB3 ASN A 148 17.440 -11.210 2.683 1.00 0.00 H new ATOM 0 HD21 ASN A 148 18.541 -13.039 -0.233 1.00 0.00 H new ATOM 0 HD22 ASN A 148 18.316 -11.437 0.475 1.00 0.00 H new ATOM 2322 N PRO A 149 20.756 -10.323 2.144 1.00 0.00 N ATOM 2323 CA PRO A 149 21.328 -9.112 1.459 1.00 0.00 C ATOM 2324 C PRO A 149 20.204 -8.283 0.831 1.00 0.00 C ATOM 2325 O PRO A 149 20.131 -7.083 1.008 1.00 0.00 O ATOM 2326 CB PRO A 149 22.272 -9.617 0.369 1.00 0.00 C ATOM 2327 CG PRO A 149 22.312 -11.128 0.454 1.00 0.00 C ATOM 2328 CD PRO A 149 21.509 -11.541 1.681 1.00 0.00 C ATOM 0 HA PRO A 149 21.857 -8.479 2.171 1.00 0.00 H new ATOM 0 HB2 PRO A 149 21.925 -9.299 -0.614 1.00 0.00 H new ATOM 0 HB3 PRO A 149 23.270 -9.200 0.505 1.00 0.00 H new ATOM 0 HG2 PRO A 149 21.891 -11.574 -0.447 1.00 0.00 H new ATOM 0 HG3 PRO A 149 23.341 -11.480 0.533 1.00 0.00 H new ATOM 0 HD2 PRO A 149 20.821 -12.350 1.437 1.00 0.00 H new ATOM 0 HD3 PRO A 149 22.168 -11.909 2.467 1.00 0.00 H new ATOM 2336 N ALA A 150 19.347 -8.913 0.074 1.00 0.00 N ATOM 2337 CA ALA A 150 18.245 -8.165 -0.597 1.00 0.00 C ATOM 2338 C ALA A 150 17.101 -7.885 0.383 1.00 0.00 C ATOM 2339 O ALA A 150 16.396 -6.904 0.251 1.00 0.00 O ATOM 2340 CB ALA A 150 17.712 -9.001 -1.763 1.00 0.00 C ATOM 0 H ALA A 150 19.363 -9.916 -0.109 1.00 0.00 H new ATOM 0 HA ALA A 150 18.636 -7.214 -0.957 1.00 0.00 H new ATOM 0 HB1 ALA A 150 16.906 -8.461 -2.259 1.00 0.00 H new ATOM 0 HB2 ALA A 150 18.516 -9.187 -2.475 1.00 0.00 H new ATOM 0 HB3 ALA A 150 17.334 -9.952 -1.386 1.00 0.00 H new ATOM 2346 N LEU A 151 16.892 -8.738 1.351 1.00 0.00 N ATOM 2347 CA LEU A 151 15.770 -8.511 2.310 1.00 0.00 C ATOM 2348 C LEU A 151 16.062 -7.321 3.231 1.00 0.00 C ATOM 2349 O LEU A 151 15.205 -6.892 3.976 1.00 0.00 O ATOM 2350 CB LEU A 151 15.545 -9.767 3.151 1.00 0.00 C ATOM 2351 CG LEU A 151 15.117 -10.922 2.240 1.00 0.00 C ATOM 2352 CD1 LEU A 151 14.979 -12.202 3.066 1.00 0.00 C ATOM 2353 CD2 LEU A 151 13.771 -10.593 1.586 1.00 0.00 C ATOM 0 H LEU A 151 17.446 -9.578 1.519 1.00 0.00 H new ATOM 0 HA LEU A 151 14.872 -8.288 1.735 1.00 0.00 H new ATOM 0 HB2 LEU A 151 16.459 -10.029 3.684 1.00 0.00 H new ATOM 0 HB3 LEU A 151 14.779 -9.581 3.904 1.00 0.00 H new ATOM 0 HG LEU A 151 15.871 -11.066 1.466 1.00 0.00 H new ATOM 0 HD11 LEU A 151 14.674 -13.023 2.417 1.00 0.00 H new ATOM 0 HD12 LEU A 151 15.936 -12.441 3.529 1.00 0.00 H new ATOM 0 HD13 LEU A 151 14.228 -12.055 3.842 1.00 0.00 H new ATOM 0 HD21 LEU A 151 13.470 -11.417 0.939 1.00 0.00 H new ATOM 0 HD22 LEU A 151 13.017 -10.445 2.359 1.00 0.00 H new ATOM 0 HD23 LEU A 151 13.867 -9.683 0.994 1.00 0.00 H new ATOM 2365 N THR A 152 17.245 -6.764 3.183 1.00 0.00 N ATOM 2366 CA THR A 152 17.535 -5.588 4.055 1.00 0.00 C ATOM 2367 C THR A 152 16.639 -4.435 3.601 1.00 0.00 C ATOM 2368 O THR A 152 16.381 -4.283 2.422 1.00 0.00 O ATOM 2369 CB THR A 152 19.006 -5.187 3.913 1.00 0.00 C ATOM 2370 OG1 THR A 152 19.824 -6.341 4.047 1.00 0.00 O ATOM 2371 CG2 THR A 152 19.374 -4.169 4.996 1.00 0.00 C ATOM 0 H THR A 152 18.014 -7.068 2.585 1.00 0.00 H new ATOM 0 HA THR A 152 17.342 -5.832 5.099 1.00 0.00 H new ATOM 0 HB THR A 152 19.165 -4.738 2.932 1.00 0.00 H new ATOM 0 HG1 THR A 152 20.018 -6.709 3.160 1.00 0.00 H new ATOM 0 HG21 THR A 152 20.422 -3.888 4.890 1.00 0.00 H new ATOM 0 HG22 THR A 152 18.748 -3.283 4.890 1.00 0.00 H new ATOM 0 HG23 THR A 152 19.215 -4.611 5.980 1.00 0.00 H new ATOM 2379 N HIS A 153 16.153 -3.620 4.503 1.00 0.00 N ATOM 2380 CA HIS A 153 15.271 -2.500 4.059 1.00 0.00 C ATOM 2381 C HIS A 153 15.130 -1.439 5.150 1.00 0.00 C ATOM 2382 O HIS A 153 15.470 -1.652 6.297 1.00 0.00 O ATOM 2383 CB HIS A 153 13.887 -3.053 3.704 1.00 0.00 C ATOM 2384 CG HIS A 153 13.357 -3.879 4.845 1.00 0.00 C ATOM 2385 ND1 HIS A 153 13.961 -5.061 5.246 1.00 0.00 N ATOM 2386 CD2 HIS A 153 12.277 -3.710 5.676 1.00 0.00 C ATOM 2387 CE1 HIS A 153 13.248 -5.552 6.277 1.00 0.00 C ATOM 2388 NE2 HIS A 153 12.210 -4.767 6.579 1.00 0.00 N ATOM 0 H HIS A 153 16.324 -3.679 5.507 1.00 0.00 H new ATOM 0 HA HIS A 153 15.725 -2.033 3.185 1.00 0.00 H new ATOM 0 HB2 HIS A 153 13.202 -2.233 3.489 1.00 0.00 H new ATOM 0 HB3 HIS A 153 13.949 -3.661 2.802 1.00 0.00 H new ATOM 0 HD1 HIS A 153 14.794 -5.482 4.835 1.00 0.00 H new ATOM 0 HD2 HIS A 153 11.584 -2.882 5.635 1.00 0.00 H new ATOM 0 HE1 HIS A 153 13.486 -6.468 6.796 1.00 0.00 H new ATOM 2396 N THR A 154 14.613 -0.295 4.784 1.00 0.00 N ATOM 2397 CA THR A 154 14.424 0.809 5.766 1.00 0.00 C ATOM 2398 C THR A 154 12.995 1.351 5.636 1.00 0.00 C ATOM 2399 O THR A 154 12.385 1.255 4.589 1.00 0.00 O ATOM 2400 CB THR A 154 15.428 1.924 5.456 1.00 0.00 C ATOM 2401 OG1 THR A 154 16.741 1.381 5.429 1.00 0.00 O ATOM 2402 CG2 THR A 154 15.348 3.008 6.528 1.00 0.00 C ATOM 0 H THR A 154 14.311 -0.078 3.834 1.00 0.00 H new ATOM 0 HA THR A 154 14.584 0.444 6.781 1.00 0.00 H new ATOM 0 HB THR A 154 15.191 2.362 4.486 1.00 0.00 H new ATOM 0 HG1 THR A 154 17.387 2.095 5.245 1.00 0.00 H new ATOM 0 HG21 THR A 154 16.065 3.798 6.301 1.00 0.00 H new ATOM 0 HG22 THR A 154 14.342 3.426 6.548 1.00 0.00 H new ATOM 0 HG23 THR A 154 15.581 2.575 7.501 1.00 0.00 H new ATOM 2410 N TYR A 155 12.451 1.912 6.686 1.00 0.00 N ATOM 2411 CA TYR A 155 11.059 2.451 6.608 1.00 0.00 C ATOM 2412 C TYR A 155 11.103 3.981 6.595 1.00 0.00 C ATOM 2413 O TYR A 155 11.643 4.597 7.492 1.00 0.00 O ATOM 2414 CB TYR A 155 10.258 1.997 7.831 1.00 0.00 C ATOM 2415 CG TYR A 155 10.204 0.490 7.890 1.00 0.00 C ATOM 2416 CD1 TYR A 155 9.288 -0.210 7.095 1.00 0.00 C ATOM 2417 CD2 TYR A 155 11.063 -0.207 8.748 1.00 0.00 C ATOM 2418 CE1 TYR A 155 9.231 -1.607 7.159 1.00 0.00 C ATOM 2419 CE2 TYR A 155 11.007 -1.604 8.810 1.00 0.00 C ATOM 2420 CZ TYR A 155 10.091 -2.304 8.017 1.00 0.00 C ATOM 2421 OH TYR A 155 10.034 -3.681 8.081 1.00 0.00 O ATOM 0 H TYR A 155 12.909 2.020 7.591 1.00 0.00 H new ATOM 0 HA TYR A 155 10.587 2.081 5.698 1.00 0.00 H new ATOM 0 HB2 TYR A 155 10.716 2.387 8.740 1.00 0.00 H new ATOM 0 HB3 TYR A 155 9.247 2.403 7.784 1.00 0.00 H new ATOM 0 HD1 TYR A 155 8.626 0.328 6.433 1.00 0.00 H new ATOM 0 HD2 TYR A 155 11.769 0.333 9.362 1.00 0.00 H new ATOM 0 HE1 TYR A 155 8.524 -2.147 6.547 1.00 0.00 H new ATOM 0 HE2 TYR A 155 11.671 -2.142 9.470 1.00 0.00 H new ATOM 0 HH TYR A 155 10.776 -4.063 7.568 1.00 0.00 H new ATOM 2431 N GLU A 156 10.539 4.601 5.592 1.00 0.00 N ATOM 2432 CA GLU A 156 10.552 6.092 5.537 1.00 0.00 C ATOM 2433 C GLU A 156 9.117 6.620 5.628 1.00 0.00 C ATOM 2434 O GLU A 156 8.266 6.271 4.832 1.00 0.00 O ATOM 2435 CB GLU A 156 11.179 6.550 4.218 1.00 0.00 C ATOM 2436 CG GLU A 156 12.661 6.174 4.194 1.00 0.00 C ATOM 2437 CD GLU A 156 13.271 6.593 2.855 1.00 0.00 C ATOM 2438 OE1 GLU A 156 13.040 5.899 1.878 1.00 0.00 O ATOM 2439 OE2 GLU A 156 13.957 7.601 2.828 1.00 0.00 O ATOM 0 H GLU A 156 10.071 4.141 4.811 1.00 0.00 H new ATOM 0 HA GLU A 156 11.136 6.479 6.372 1.00 0.00 H new ATOM 0 HB2 GLU A 156 10.662 6.086 3.378 1.00 0.00 H new ATOM 0 HB3 GLU A 156 11.066 7.628 4.105 1.00 0.00 H new ATOM 0 HG2 GLU A 156 13.185 6.665 5.014 1.00 0.00 H new ATOM 0 HG3 GLU A 156 12.777 5.100 4.339 1.00 0.00 H new ATOM 2446 N VAL A 157 8.842 7.461 6.592 1.00 0.00 N ATOM 2447 CA VAL A 157 7.463 8.017 6.739 1.00 0.00 C ATOM 2448 C VAL A 157 7.468 9.491 6.330 1.00 0.00 C ATOM 2449 O VAL A 157 8.221 10.281 6.860 1.00 0.00 O ATOM 2450 CB VAL A 157 7.018 7.910 8.202 1.00 0.00 C ATOM 2451 CG1 VAL A 157 5.502 8.092 8.290 1.00 0.00 C ATOM 2452 CG2 VAL A 157 7.399 6.537 8.763 1.00 0.00 C ATOM 0 H VAL A 157 9.515 7.787 7.286 1.00 0.00 H new ATOM 0 HA VAL A 157 6.778 7.455 6.105 1.00 0.00 H new ATOM 0 HB VAL A 157 7.514 8.687 8.784 1.00 0.00 H new ATOM 0 HG11 VAL A 157 5.186 8.016 9.330 1.00 0.00 H new ATOM 0 HG12 VAL A 157 5.230 9.072 7.899 1.00 0.00 H new ATOM 0 HG13 VAL A 157 5.008 7.318 7.703 1.00 0.00 H new ATOM 0 HG21 VAL A 157 7.080 6.468 9.803 1.00 0.00 H new ATOM 0 HG22 VAL A 157 6.909 5.757 8.180 1.00 0.00 H new ATOM 0 HG23 VAL A 157 8.480 6.408 8.706 1.00 0.00 H new ATOM 2462 N TRP A 158 6.630 9.877 5.402 1.00 0.00 N ATOM 2463 CA TRP A 158 6.604 11.309 4.981 1.00 0.00 C ATOM 2464 C TRP A 158 5.246 11.930 5.311 1.00 0.00 C ATOM 2465 O TRP A 158 4.257 11.245 5.483 1.00 0.00 O ATOM 2466 CB TRP A 158 6.835 11.416 3.472 1.00 0.00 C ATOM 2467 CG TRP A 158 8.195 10.907 3.117 1.00 0.00 C ATOM 2468 CD1 TRP A 158 8.591 9.617 3.202 1.00 0.00 C ATOM 2469 CD2 TRP A 158 9.339 11.654 2.612 1.00 0.00 C ATOM 2470 NE1 TRP A 158 9.906 9.525 2.779 1.00 0.00 N ATOM 2471 CE2 TRP A 158 10.411 10.755 2.408 1.00 0.00 C ATOM 2472 CE3 TRP A 158 9.548 13.011 2.316 1.00 0.00 C ATOM 2473 CZ2 TRP A 158 11.647 11.188 1.926 1.00 0.00 C ATOM 2474 CZ3 TRP A 158 10.789 13.452 1.831 1.00 0.00 C ATOM 2475 CH2 TRP A 158 11.837 12.542 1.636 1.00 0.00 C ATOM 0 H TRP A 158 5.968 9.268 4.921 1.00 0.00 H new ATOM 0 HA TRP A 158 7.392 11.838 5.516 1.00 0.00 H new ATOM 0 HB2 TRP A 158 6.075 10.844 2.940 1.00 0.00 H new ATOM 0 HB3 TRP A 158 6.734 12.454 3.155 1.00 0.00 H new ATOM 0 HD1 TRP A 158 7.982 8.794 3.544 1.00 0.00 H new ATOM 0 HE1 TRP A 158 10.437 8.655 2.746 1.00 0.00 H new ATOM 0 HE3 TRP A 158 8.747 13.721 2.463 1.00 0.00 H new ATOM 0 HZ2 TRP A 158 12.451 10.482 1.778 1.00 0.00 H new ATOM 0 HZ3 TRP A 158 10.937 14.498 1.607 1.00 0.00 H new ATOM 0 HH2 TRP A 158 12.790 12.887 1.262 1.00 0.00 H new ATOM 2486 N GLN A 159 5.195 13.232 5.362 1.00 0.00 N ATOM 2487 CA GLN A 159 3.915 13.941 5.641 1.00 0.00 C ATOM 2488 C GLN A 159 3.806 15.103 4.655 1.00 0.00 C ATOM 2489 O GLN A 159 4.794 15.741 4.345 1.00 0.00 O ATOM 2490 CB GLN A 159 3.926 14.481 7.073 1.00 0.00 C ATOM 2491 CG GLN A 159 3.634 13.343 8.053 1.00 0.00 C ATOM 2492 CD GLN A 159 3.358 13.924 9.441 1.00 0.00 C ATOM 2493 OE1 GLN A 159 4.263 14.091 10.234 1.00 0.00 O ATOM 2494 NE2 GLN A 159 2.138 14.245 9.770 1.00 0.00 N ATOM 0 H GLN A 159 5.999 13.844 5.220 1.00 0.00 H new ATOM 0 HA GLN A 159 3.069 13.263 5.531 1.00 0.00 H new ATOM 0 HB2 GLN A 159 4.895 14.927 7.297 1.00 0.00 H new ATOM 0 HB3 GLN A 159 3.180 15.268 7.181 1.00 0.00 H new ATOM 0 HG2 GLN A 159 2.775 12.766 7.711 1.00 0.00 H new ATOM 0 HG3 GLN A 159 4.481 12.659 8.095 1.00 0.00 H new ATOM 0 HE21 GLN A 159 1.377 14.105 9.105 1.00 0.00 H new ATOM 0 HE22 GLN A 159 1.944 14.636 10.692 1.00 0.00 H new ATOM 2503 N LYS A 160 2.639 15.392 4.142 1.00 0.00 N ATOM 2504 CA LYS A 160 2.519 16.514 3.169 1.00 0.00 C ATOM 2505 C LYS A 160 2.575 17.854 3.905 1.00 0.00 C ATOM 2506 O LYS A 160 1.866 18.074 4.867 1.00 0.00 O ATOM 2507 CB LYS A 160 1.184 16.393 2.433 1.00 0.00 C ATOM 2508 CG LYS A 160 1.230 17.211 1.141 1.00 0.00 C ATOM 2509 CD LYS A 160 -0.175 17.286 0.540 1.00 0.00 C ATOM 2510 CE LYS A 160 -0.111 17.942 -0.841 1.00 0.00 C ATOM 2511 NZ LYS A 160 -0.760 19.283 -0.782 1.00 0.00 N ATOM 0 H LYS A 160 1.770 14.902 4.354 1.00 0.00 H new ATOM 0 HA LYS A 160 3.343 16.466 2.457 1.00 0.00 H new ATOM 0 HB2 LYS A 160 0.977 15.347 2.205 1.00 0.00 H new ATOM 0 HB3 LYS A 160 0.373 16.747 3.070 1.00 0.00 H new ATOM 0 HG2 LYS A 160 1.605 18.214 1.345 1.00 0.00 H new ATOM 0 HG3 LYS A 160 1.918 16.752 0.431 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -0.600 16.286 0.459 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -0.831 17.859 1.195 1.00 0.00 H new ATOM 0 HE2 LYS A 160 0.926 18.041 -1.161 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -0.613 17.315 -1.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -0.718 19.731 -1.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -1.754 19.175 -0.494 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -0.262 19.880 -0.091 1.00 0.00 H new ATOM 2525 N LYS A 161 3.411 18.750 3.455 1.00 0.00 N ATOM 2526 CA LYS A 161 3.516 20.079 4.120 1.00 0.00 C ATOM 2527 C LYS A 161 2.242 20.884 3.853 1.00 0.00 C ATOM 2528 O LYS A 161 1.628 20.765 2.811 1.00 0.00 O ATOM 2529 CB LYS A 161 4.722 20.836 3.560 1.00 0.00 C ATOM 2530 CG LYS A 161 6.017 20.189 4.063 1.00 0.00 C ATOM 2531 CD LYS A 161 6.783 21.185 4.938 1.00 0.00 C ATOM 2532 CE LYS A 161 7.400 22.271 4.054 1.00 0.00 C ATOM 2533 NZ LYS A 161 8.735 21.821 3.563 1.00 0.00 N ATOM 0 H LYS A 161 4.027 18.618 2.653 1.00 0.00 H new ATOM 0 HA LYS A 161 3.641 19.939 5.194 1.00 0.00 H new ATOM 0 HB2 LYS A 161 4.697 20.824 2.470 1.00 0.00 H new ATOM 0 HB3 LYS A 161 4.683 21.881 3.868 1.00 0.00 H new ATOM 0 HG2 LYS A 161 5.788 19.289 4.634 1.00 0.00 H new ATOM 0 HG3 LYS A 161 6.634 19.882 3.218 1.00 0.00 H new ATOM 0 HD2 LYS A 161 6.111 21.635 5.669 1.00 0.00 H new ATOM 0 HD3 LYS A 161 7.564 20.669 5.497 1.00 0.00 H new ATOM 0 HE2 LYS A 161 6.744 22.483 3.210 1.00 0.00 H new ATOM 0 HE3 LYS A 161 7.503 23.198 4.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 161 9.152 22.561 2.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 161 9.360 21.640 4.374 1.00 0.00 H new ATOM 0 HZ3 LYS A 161 8.625 20.947 3.009 1.00 0.00 H new ATOM 2547 N ALA A 162 1.841 21.703 4.788 1.00 0.00 N ATOM 2548 CA ALA A 162 0.607 22.517 4.592 1.00 0.00 C ATOM 2549 C ALA A 162 0.914 23.988 4.881 1.00 0.00 C ATOM 2550 O ALA A 162 1.603 24.249 5.853 1.00 0.00 O ATOM 2551 CB ALA A 162 -0.484 22.026 5.545 1.00 0.00 C ATOM 2552 OXT ALA A 162 0.455 24.827 4.124 1.00 0.00 O ATOM 0 H ALA A 162 2.315 21.843 5.680 1.00 0.00 H new ATOM 0 HA ALA A 162 0.263 22.414 3.563 1.00 0.00 H new ATOM 0 HB1 ALA A 162 -1.386 22.621 5.402 1.00 0.00 H new ATOM 0 HB2 ALA A 162 -0.703 20.978 5.338 1.00 0.00 H new ATOM 0 HB3 ALA A 162 -0.141 22.129 6.575 1.00 0.00 H new TER 2558 ALA A 162 HETATM 2559 PA NDP A 168 -3.334 -4.230 -9.601 1.00 0.00 P HETATM 2560 O1A NDP A 168 -3.404 -4.317 -8.126 1.00 0.00 O HETATM 2561 O2A NDP A 168 -2.815 -5.406 -10.327 1.00 0.00 O HETATM 2562 O5B NDP A 168 -4.716 -3.734 -10.215 1.00 0.00 O HETATM 2563 C5B NDP A 168 -5.541 -2.791 -9.509 1.00 0.00 C HETATM 2564 C4B NDP A 168 -6.973 -2.911 -9.970 1.00 0.00 C HETATM 2565 O4B NDP A 168 -7.841 -2.149 -9.092 1.00 0.00 O HETATM 2566 C3B NDP A 168 -7.276 -2.383 -11.361 1.00 0.00 C HETATM 2567 O3B NDP A 168 -6.972 -3.363 -12.359 1.00 0.00 O HETATM 2568 C2B NDP A 168 -8.773 -2.120 -11.275 1.00 0.00 C HETATM 2569 O2B NDP A 168 -9.543 -3.293 -11.431 1.00 0.00 O HETATM 2570 C1B NDP A 168 -8.906 -1.593 -9.844 1.00 0.00 C HETATM 2571 N9A NDP A 168 -8.811 -0.138 -9.749 1.00 0.00 N HETATM 2572 C8A NDP A 168 -7.673 0.617 -9.610 1.00 0.00 C HETATM 2573 N7A NDP A 168 -7.899 1.907 -9.548 1.00 0.00 N HETATM 2574 C5A NDP A 168 -9.279 2.008 -9.651 1.00 0.00 C HETATM 2575 C6A NDP A 168 -10.152 3.113 -9.647 1.00 0.00 C HETATM 2576 N6A NDP A 168 -9.744 4.379 -9.532 1.00 0.00 N HETATM 2577 N1A NDP A 168 -11.478 2.869 -9.768 1.00 0.00 N HETATM 2578 C2A NDP A 168 -11.888 1.598 -9.883 1.00 0.00 C HETATM 2579 N3A NDP A 168 -11.165 0.478 -9.900 1.00 0.00 N HETATM 2580 C4A NDP A 168 -9.854 0.756 -9.778 1.00 0.00 C HETATM 2581 O3 NDP A 168 -2.412 -2.926 -10.012 1.00 0.00 O HETATM 2582 PN NDP A 168 -0.894 -2.720 -10.623 1.00 0.00 P HETATM 2583 O1N NDP A 168 -0.671 -1.279 -10.849 1.00 0.00 O HETATM 2584 O2N NDP A 168 -0.733 -3.625 -11.777 1.00 0.00 O HETATM 2585 O5D NDP A 168 -0.087 -3.244 -9.354 1.00 0.00 O HETATM 2586 C5D NDP A 168 -0.591 -4.337 -8.564 1.00 0.00 C HETATM 2587 C4D NDP A 168 0.540 -5.237 -8.129 1.00 0.00 C HETATM 2588 O4D NDP A 168 1.517 -4.469 -7.378 1.00 0.00 O HETATM 2589 C3D NDP A 168 0.159 -6.369 -7.189 1.00 0.00 C HETATM 2590 O3D NDP A 168 -0.334 -7.496 -7.919 1.00 0.00 O HETATM 2591 C2D NDP A 168 1.488 -6.686 -6.513 1.00 0.00 C HETATM 2592 O2D NDP A 168 2.332 -7.528 -7.301 1.00 0.00 O HETATM 2593 C1D NDP A 168 2.105 -5.290 -6.383 1.00 0.00 C HETATM 2594 N1N NDP A 168 1.904 -4.655 -5.080 1.00 0.00 N HETATM 2595 C2N NDP A 168 2.763 -3.981 -4.326 1.00 0.00 C HETATM 2596 C3N NDP A 168 2.518 -3.382 -3.207 1.00 0.00 C HETATM 2597 C7N NDP A 168 3.717 -2.780 -2.699 1.00 0.00 C HETATM 2598 O7N NDP A 168 3.341 -2.229 -1.566 1.00 0.00 O HETATM 2599 N7N NDP A 168 4.979 -2.754 -3.196 1.00 0.00 N HETATM 2600 C4N NDP A 168 1.116 -3.437 -2.676 1.00 0.00 C HETATM 2601 C5N NDP A 168 0.126 -4.159 -3.430 1.00 0.00 C HETATM 2602 C6N NDP A 168 0.433 -4.801 -4.637 1.00 0.00 C HETATM 2603 P2B NDP A 168 -10.791 -3.569 -12.499 1.00 0.00 P HETATM 2604 O1X NDP A 168 -11.707 -4.411 -11.527 1.00 0.00 O HETATM 2605 O2X NDP A 168 -11.351 -2.154 -12.632 1.00 0.00 O HETATM 2606 O3X NDP A 168 -10.103 -4.506 -13.490 1.00 0.00 O HETATM 0 HO3N NDP A 168 -1.094 -7.889 -7.441 1.00 0.00 H new HETATM 0 HO3A NDP A 168 -6.277 -3.016 -12.957 1.00 0.00 H new HETATM 0 HO2N NDP A 168 2.143 -8.467 -7.093 1.00 0.00 H new HETATM 0 H72N NDP A 168 5.718 -2.268 -2.687 1.00 0.00 H new HETATM 0 H71N NDP A 168 5.189 -3.221 -4.078 1.00 0.00 H new HETATM 0 H62A NDP A 168 -10.426 5.137 -9.536 1.00 0.00 H new HETATM 0 H61A NDP A 168 -8.750 4.588 -9.440 1.00 0.00 H new HETATM 0 H52N NDP A 168 -1.114 -3.951 -7.689 1.00 0.00 H new HETATM 0 H52A NDP A 168 -5.479 -2.973 -8.436 1.00 0.00 H new HETATM 0 H51N NDP A 168 -1.317 -4.908 -9.143 1.00 0.00 H new HETATM 0 H51A NDP A 168 -5.179 -1.778 -9.682 1.00 0.00 H new HETATM 0 H42N NDP A 168 1.156 -3.873 -1.678 1.00 0.00 H new HETATM 0 H41N NDP A 168 0.764 -2.412 -2.562 1.00 0.00 H new HETATM 0 H8A NDP A 168 -6.674 0.184 -9.556 1.00 0.00 H new HETATM 0 H6N NDP A 168 -0.305 -5.357 -5.215 1.00 0.00 H new HETATM 0 H5N NDP A 168 -0.895 -4.208 -3.050 1.00 0.00 H new HETATM 0 H4D NDP A 168 0.902 -5.658 -9.067 1.00 0.00 H new HETATM 0 H4B NDP A 168 -7.144 -3.988 -9.964 1.00 0.00 H new HETATM 0 H3D NDP A 168 -0.636 -6.112 -6.489 1.00 0.00 H new HETATM 0 H3B NDP A 168 -6.693 -1.506 -11.642 1.00 0.00 H new HETATM 0 H2N NDP A 168 3.789 -3.926 -4.691 1.00 0.00 H new HETATM 0 H2D NDP A 168 1.363 -7.231 -5.577 1.00 0.00 H new HETATM 0 H2B NDP A 168 -9.130 -1.449 -12.056 1.00 0.00 H new HETATM 0 H2A NDP A 168 -12.965 1.461 -9.976 1.00 0.00 H new HETATM 0 H1D NDP A 168 3.183 -5.405 -6.500 1.00 0.00 H new HETATM 0 H1B NDP A 168 -9.891 -1.876 -9.474 1.00 0.00 H new HETATM 2633 N1 TRR A 170 3.990 -4.688 1.669 1.00 0.00 N HETATM 2634 C2 TRR A 170 4.009 -3.333 1.906 1.00 0.00 C HETATM 2635 N2 TRR A 170 5.131 -2.748 2.453 1.00 0.00 N HETATM 2636 N3 TRR A 170 2.905 -2.563 1.597 1.00 0.00 N HETATM 2637 C4 TRR A 170 1.780 -3.151 1.052 1.00 0.00 C HETATM 2638 N4 TRR A 170 0.679 -2.383 0.744 1.00 0.00 N HETATM 2639 C5 TRR A 170 1.757 -4.517 0.813 1.00 0.00 C HETATM 2640 C6 TRR A 170 2.877 -5.284 1.127 1.00 0.00 C HETATM 2641 C7 TRR A 170 0.519 -5.153 0.223 1.00 0.00 C HETATM 2642 C11 TRR A 170 0.631 -6.639 0.030 1.00 0.00 C HETATM 2643 C12 TRR A 170 1.041 -7.150 -1.198 1.00 0.00 C HETATM 2644 C13 TRR A 170 1.143 -8.534 -1.382 1.00 0.00 C HETATM 2645 C14 TRR A 170 0.833 -9.399 -0.332 1.00 0.00 C HETATM 2646 C15 TRR A 170 0.422 -8.889 0.899 1.00 0.00 C HETATM 2647 C16 TRR A 170 0.322 -7.502 1.078 1.00 0.00 C HETATM 2648 O13 TRR A 170 1.551 -9.059 -2.606 1.00 0.00 O HETATM 2649 O14 TRR A 170 0.932 -10.764 -0.513 1.00 0.00 O HETATM 2650 O15 TRR A 170 0.120 -9.768 1.938 1.00 0.00 O HETATM 2651 C17 TRR A 170 1.857 -8.178 -3.658 1.00 0.00 C HETATM 2652 C18 TRR A 170 2.145 -11.387 -0.190 1.00 0.00 C HETATM 2653 C19 TRR A 170 -0.286 -9.249 3.181 1.00 0.00 C HETATM 0 H193 TRR A 170 0.502 -8.613 3.585 1.00 0.00 H new HETATM 0 H192 TRR A 170 -1.195 -8.662 3.051 1.00 0.00 H new HETATM 0 H191 TRR A 170 -0.480 -10.069 3.872 1.00 0.00 H new HETATM 0 H183 TRR A 170 2.945 -10.964 -0.798 1.00 0.00 H new HETATM 0 H182 TRR A 170 2.367 -11.226 0.865 1.00 0.00 H new HETATM 0 H181 TRR A 170 2.068 -12.457 -0.385 1.00 0.00 H new HETATM 0 H173 TRR A 170 0.979 -7.578 -3.897 1.00 0.00 H new HETATM 0 H172 TRR A 170 2.673 -7.522 -3.357 1.00 0.00 H new HETATM 0 H171 TRR A 170 2.156 -8.750 -4.536 1.00 0.00 H new HETATM 0 H72 TRR A 170 -0.330 -4.944 0.874 1.00 0.00 H new HETATM 0 H71 TRR A 170 0.306 -4.687 -0.739 1.00 0.00 H new HETATM 0 H6 TRR A 170 2.870 -6.358 0.942 1.00 0.00 H new HETATM 0 H42 TRR A 170 -0.151 -2.819 0.342 1.00 0.00 H new HETATM 0 H41 TRR A 170 0.693 -1.378 0.918 1.00 0.00 H new HETATM 0 H22 TRR A 170 5.148 -1.744 2.630 1.00 0.00 H new HETATM 0 H21 TRR A 170 5.944 -3.320 2.681 1.00 0.00 H new HETATM 0 H16 TRR A 170 0.002 -7.099 2.039 1.00 0.00 H new HETATM 0 H12 TRR A 170 1.283 -6.472 -2.017 1.00 0.00 H new HETATM 0 H1 TRR A 170 4.807 -5.254 1.897 1.00 0.00 H new