USER MOD reduce.3.24.130724 H: found=0, std=0, add=1293, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1293 hydrogens (26 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 48 SER OG : rot 180:sc= -0.871 USER MOD Set 1.2: A 170 NDP O2D : rot 180:sc= -1.09 USER MOD Set 2.1: A 112 THR OG1 : rot 180:sc= -0.161 USER MOD Set 2.2: A 159 GLN : amide:sc= -0.328 K(o=-0.49,f=-2.6!) USER MOD Set 3.1: A 89 HIS : no HD1:sc= -0.734 X(o=-2.2,f=-1.7) USER MOD Set 3.2: A 92 GLN : amide:sc= -1.43 K(o=-2.2,f=-7.1!) USER MOD Set 4.1: A 39 MET CE :methyl -145:sc= -0.396 (180deg=-1.57) USER MOD Set 4.2: A 59 ASN : amide:sc= -1.38 X(o=-1.8,f=-1.9) USER MOD Single : A 1 THR N :NH3+ -106:sc= 0.622 (180deg=0) USER MOD Single : A 1 THR OG1 : rot 180:sc= 0.182 USER MOD Single : A 7 GLN :FLIP amide:sc= -1.31 F(o=-2.2,f=-1.3) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 HIS :FLIP no HD1:sc= -0.426 F(o=-1.3,f=-0.43) USER MOD Single : A 22 HIS : no HD1:sc= -0.353 X(o=-0.35,f=-0.14) USER MOD Single : A 28 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 THR OG1 : rot 17:sc= 0.89 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 THR OG1 : rot 130:sc= -0.609 USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 THR OG1 : rot -160:sc= 0.00427 USER MOD Single : A 63 THR OG1 : rot 106:sc= -1.27 USER MOD Single : A 64 HIS :FLIP no HD1:sc= -0.196 F(o=-0.82,f=-0.2) USER MOD Single : A 65 GLN : amide:sc= -0.129 X(o=-0.13,f=-0.036) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 GLN : amide:sc= -0.147 X(o=-0.15,f=-0.0042) USER MOD Single : A 71 GLN : amide:sc= -0.17 X(o=-0.17,f=-0.21) USER MOD Single : A 77 HIS : no HD1:sc= -3.11 K(o=-3.1,f=-6.2!) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 GLN : amide:sc= -0.183 X(o=-0.18,f=-0.13) USER MOD Single : A 101 GLN : amide:sc= -0.157 K(o=-0.16,f=-1.4!) USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot 41:sc= 0.391 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 126 THR OG1 : rot 150:sc= 0 USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 MET CE :methyl -177:sc= -1.07 (180deg=-1.09) USER MOD Single : A 132 ASN : amide:sc= -0.0845 K(o=-0.085,f=-0.76) USER MOD Single : A 137 THR OG1 : rot 180:sc= -0.0957 USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 148 ASN : amide:sc= -0.972 K(o=-0.97,f=-3.4!) USER MOD Single : A 152 THR OG1 : rot 180:sc= -0.859 USER MOD Single : A 153 HIS :FLIP no HE2:sc= -4.95 F(o=-6.8!,f=-4.9) USER MOD Single : A 154 THR OG1 : rot 180:sc= 0 USER MOD Single : A 155 TYR OH : rot 180:sc= -0.0264 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 170 NDP O3B : rot 101:sc= 0.585 USER MOD Single : A 170 NDP O3D : rot -49:sc= -1.4 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -11.780 -4.700 5.065 1.00 1.00 N ATOM 2 CA THR A 1 -10.716 -3.670 4.869 1.00 1.00 C ATOM 3 C THR A 1 -9.488 -4.277 4.194 1.00 1.00 C ATOM 4 O THR A 1 -9.259 -5.481 4.279 1.00 1.00 O ATOM 5 CB THR A 1 -10.320 -3.099 6.228 1.00 1.00 C ATOM 6 OG1 THR A 1 -11.254 -3.496 7.215 1.00 1.00 O ATOM 7 CG2 THR A 1 -10.240 -1.590 6.251 1.00 1.00 C ATOM 0 H1 THR A 1 -12.546 -4.542 4.380 1.00 1.00 H new ATOM 0 H2 THR A 1 -11.377 -5.648 4.921 1.00 1.00 H new ATOM 0 H3 THR A 1 -12.159 -4.628 6.031 1.00 1.00 H new ATOM 0 HA THR A 1 -11.105 -2.880 4.227 1.00 1.00 H new ATOM 0 HB THR A 1 -9.325 -3.494 6.432 1.00 1.00 H new ATOM 0 HG1 THR A 1 -10.990 -3.126 8.083 1.00 1.00 H new ATOM 0 HG21 THR A 1 -9.954 -1.256 7.248 1.00 1.00 H new ATOM 0 HG22 THR A 1 -9.496 -1.254 5.528 1.00 1.00 H new ATOM 0 HG23 THR A 1 -11.212 -1.170 5.993 1.00 1.00 H new ATOM 17 N ALA A 2 -8.706 -3.440 3.527 1.00 1.00 N ATOM 18 CA ALA A 2 -7.509 -3.906 2.842 1.00 1.00 C ATOM 19 C ALA A 2 -6.327 -2.970 3.059 1.00 1.00 C ATOM 20 O ALA A 2 -6.481 -1.743 3.116 1.00 1.00 O ATOM 21 CB ALA A 2 -7.796 -4.054 1.349 1.00 1.00 C ATOM 0 H ALA A 2 -8.878 -2.438 3.446 1.00 1.00 H new ATOM 0 HA ALA A 2 -7.238 -4.874 3.263 1.00 1.00 H new ATOM 0 HB1 ALA A 2 -6.898 -4.403 0.839 1.00 1.00 H new ATOM 0 HB2 ALA A 2 -8.600 -4.775 1.203 1.00 1.00 H new ATOM 0 HB3 ALA A 2 -8.095 -3.089 0.939 1.00 1.00 H new ATOM 27 N PHE A 3 -5.144 -3.545 3.168 1.00 1.00 N ATOM 28 CA PHE A 3 -3.935 -2.782 3.371 1.00 1.00 C ATOM 29 C PHE A 3 -3.005 -2.910 2.161 1.00 1.00 C ATOM 30 O PHE A 3 -2.725 -4.016 1.707 1.00 1.00 O ATOM 31 CB PHE A 3 -3.232 -3.283 4.634 1.00 1.00 C ATOM 32 CG PHE A 3 -3.794 -2.772 5.929 1.00 1.00 C ATOM 33 CD1 PHE A 3 -4.259 -1.471 6.039 1.00 1.00 C ATOM 34 CD2 PHE A 3 -3.825 -3.588 7.049 1.00 1.00 C ATOM 35 CE1 PHE A 3 -4.746 -0.995 7.241 1.00 1.00 C ATOM 36 CE2 PHE A 3 -4.310 -3.117 8.253 1.00 1.00 C ATOM 37 CZ PHE A 3 -4.772 -1.819 8.350 1.00 1.00 C ATOM 0 H PHE A 3 -4.998 -4.553 3.118 1.00 1.00 H new ATOM 0 HA PHE A 3 -4.192 -1.729 3.489 1.00 1.00 H new ATOM 0 HB2 PHE A 3 -3.273 -4.372 4.644 1.00 1.00 H new ATOM 0 HB3 PHE A 3 -2.180 -3.004 4.579 1.00 1.00 H new ATOM 0 HD1 PHE A 3 -4.240 -0.822 5.176 1.00 1.00 H new ATOM 0 HD2 PHE A 3 -3.466 -4.604 6.979 1.00 1.00 H new ATOM 0 HE1 PHE A 3 -5.106 0.021 7.314 1.00 1.00 H new ATOM 0 HE2 PHE A 3 -4.328 -3.763 9.118 1.00 1.00 H new ATOM 0 HZ PHE A 3 -5.153 -1.449 9.290 1.00 1.00 H new ATOM 47 N LEU A 4 -2.527 -1.781 1.653 1.00 1.00 N ATOM 48 CA LEU A 4 -1.619 -1.788 0.509 1.00 1.00 C ATOM 49 C LEU A 4 -0.230 -1.347 0.912 1.00 1.00 C ATOM 50 O LEU A 4 -0.046 -0.247 1.440 1.00 1.00 O ATOM 51 CB LEU A 4 -2.143 -0.870 -0.602 1.00 1.00 C ATOM 52 CG LEU A 4 -3.221 -1.476 -1.496 1.00 1.00 C ATOM 53 CD1 LEU A 4 -2.594 -2.305 -2.604 1.00 1.00 C ATOM 54 CD2 LEU A 4 -4.185 -2.305 -0.678 1.00 1.00 C ATOM 0 H LEU A 4 -2.750 -0.853 2.012 1.00 1.00 H new ATOM 0 HA LEU A 4 -1.568 -2.811 0.137 1.00 1.00 H new ATOM 0 HB2 LEU A 4 -2.541 0.036 -0.144 1.00 1.00 H new ATOM 0 HB3 LEU A 4 -1.303 -0.568 -1.228 1.00 1.00 H new ATOM 0 HG LEU A 4 -3.782 -0.664 -1.959 1.00 1.00 H new ATOM 0 HD11 LEU A 4 -3.379 -2.728 -3.230 1.00 1.00 H new ATOM 0 HD12 LEU A 4 -1.948 -1.671 -3.211 1.00 1.00 H new ATOM 0 HD13 LEU A 4 -2.005 -3.111 -2.166 1.00 1.00 H new ATOM 0 HD21 LEU A 4 -4.946 -2.729 -1.333 1.00 1.00 H new ATOM 0 HD22 LEU A 4 -3.643 -3.111 -0.183 1.00 1.00 H new ATOM 0 HD23 LEU A 4 -4.662 -1.674 0.072 1.00 1.00 H new ATOM 66 N TRP A 5 0.761 -2.181 0.639 1.00 1.00 N ATOM 67 CA TRP A 5 2.135 -1.822 0.974 1.00 1.00 C ATOM 68 C TRP A 5 3.136 -2.448 0.007 1.00 1.00 C ATOM 69 O TRP A 5 2.853 -3.463 -0.645 1.00 1.00 O ATOM 70 CB TRP A 5 2.467 -2.247 2.403 1.00 1.00 C ATOM 71 CG TRP A 5 2.934 -3.658 2.508 1.00 1.00 C ATOM 72 CD1 TRP A 5 4.172 -4.147 2.202 1.00 1.00 C ATOM 73 CD2 TRP A 5 2.159 -4.779 2.947 1.00 1.00 C ATOM 74 NE1 TRP A 5 4.212 -5.501 2.423 1.00 1.00 N ATOM 75 CE2 TRP A 5 2.990 -5.913 2.880 1.00 1.00 C ATOM 76 CE3 TRP A 5 0.841 -4.936 3.393 1.00 1.00 C ATOM 77 CZ2 TRP A 5 2.550 -7.182 3.240 1.00 1.00 C ATOM 78 CZ3 TRP A 5 0.405 -6.199 3.750 1.00 1.00 C ATOM 79 CH2 TRP A 5 1.258 -7.306 3.671 1.00 1.00 C ATOM 0 H TRP A 5 0.647 -3.093 0.196 1.00 1.00 H new ATOM 0 HA TRP A 5 2.214 -0.738 0.890 1.00 1.00 H new ATOM 0 HB2 TRP A 5 3.238 -1.587 2.801 1.00 1.00 H new ATOM 0 HB3 TRP A 5 1.583 -2.117 3.027 1.00 1.00 H new ATOM 0 HD1 TRP A 5 4.999 -3.555 1.839 1.00 1.00 H new ATOM 0 HE1 TRP A 5 5.022 -6.103 2.271 1.00 1.00 H new ATOM 0 HE3 TRP A 5 0.177 -4.087 3.457 1.00 1.00 H new ATOM 0 HZ2 TRP A 5 3.205 -8.039 3.181 1.00 1.00 H new ATOM 0 HZ3 TRP A 5 -0.610 -6.333 4.095 1.00 1.00 H new ATOM 0 HH2 TRP A 5 0.888 -8.279 3.957 1.00 1.00 H new ATOM 90 N ALA A 6 4.316 -1.856 -0.054 1.00 1.00 N ATOM 91 CA ALA A 6 5.382 -2.360 -0.912 1.00 1.00 C ATOM 92 C ALA A 6 6.667 -2.506 -0.122 1.00 1.00 C ATOM 93 O ALA A 6 6.967 -1.680 0.741 1.00 1.00 O ATOM 94 CB ALA A 6 5.582 -1.429 -2.105 1.00 1.00 C ATOM 0 H ALA A 6 4.564 -1.023 0.481 1.00 1.00 H new ATOM 0 HA ALA A 6 5.098 -3.343 -1.287 1.00 1.00 H new ATOM 0 HB1 ALA A 6 6.380 -1.816 -2.738 1.00 1.00 H new ATOM 0 HB2 ALA A 6 4.658 -1.371 -2.680 1.00 1.00 H new ATOM 0 HB3 ALA A 6 5.851 -0.434 -1.749 1.00 1.00 H new ATOM 100 N GLN A 7 7.412 -3.568 -0.399 1.00 1.00 N ATOM 101 CA GLN A 7 8.664 -3.819 0.304 1.00 1.00 C ATOM 102 C GLN A 7 9.725 -4.386 -0.635 1.00 1.00 C ATOM 103 O GLN A 7 9.410 -5.061 -1.624 1.00 1.00 O ATOM 104 CB GLN A 7 8.392 -4.802 1.454 1.00 1.00 C ATOM 105 CG GLN A 7 9.616 -5.253 2.233 1.00 1.00 C ATOM 106 CD GLN A 7 9.814 -6.746 2.201 1.00 1.00 C ATOM 107 OE1 GLN A 7 9.603 -7.354 1.039 1.00 1.00 O flip ATOM 108 NE2 GLN A 7 10.164 -7.351 3.213 1.00 1.00 N flip ATOM 0 H GLN A 7 7.173 -4.267 -1.102 1.00 1.00 H new ATOM 0 HA GLN A 7 9.047 -2.877 0.696 1.00 1.00 H new ATOM 0 HB2 GLN A 7 7.692 -4.337 2.148 1.00 1.00 H new ATOM 0 HB3 GLN A 7 7.898 -5.684 1.046 1.00 1.00 H new ATOM 0 HG2 GLN A 7 10.501 -4.765 1.824 1.00 1.00 H new ATOM 0 HG3 GLN A 7 9.522 -4.926 3.269 1.00 1.00 H new ATOM 0 HE21 GLN A 7 10.315 -6.843 4.084 1.00 1.00 H new ATOM 0 HE22 GLN A 7 10.304 -8.361 3.181 1.00 1.00 H new ATOM 117 N ASP A 8 10.981 -4.124 -0.308 1.00 1.00 N ATOM 118 CA ASP A 8 12.105 -4.612 -1.084 1.00 1.00 C ATOM 119 C ASP A 8 12.305 -6.095 -0.839 1.00 1.00 C ATOM 120 O ASP A 8 11.924 -6.604 0.211 1.00 1.00 O ATOM 121 CB ASP A 8 13.385 -3.868 -0.733 1.00 1.00 C ATOM 122 CG ASP A 8 14.396 -3.935 -1.848 1.00 1.00 C ATOM 123 OD1 ASP A 8 14.006 -3.719 -3.014 1.00 1.00 O ATOM 124 OD2 ASP A 8 15.582 -4.206 -1.561 1.00 1.00 O ATOM 0 H ASP A 8 11.247 -3.567 0.504 1.00 1.00 H new ATOM 0 HA ASP A 8 11.880 -4.439 -2.136 1.00 1.00 H new ATOM 0 HB2 ASP A 8 13.152 -2.826 -0.516 1.00 1.00 H new ATOM 0 HB3 ASP A 8 13.815 -4.293 0.174 1.00 1.00 H new ATOM 129 N ARG A 9 12.888 -6.773 -1.800 1.00 1.00 N ATOM 130 CA ARG A 9 13.122 -8.206 -1.671 1.00 1.00 C ATOM 131 C ARG A 9 14.028 -8.480 -0.484 1.00 1.00 C ATOM 132 O ARG A 9 13.795 -9.419 0.281 1.00 1.00 O ATOM 133 CB ARG A 9 13.732 -8.788 -2.940 1.00 1.00 C ATOM 134 CG ARG A 9 15.203 -8.429 -3.138 1.00 1.00 C ATOM 135 CD ARG A 9 15.800 -9.165 -4.336 1.00 1.00 C ATOM 136 NE ARG A 9 14.847 -10.090 -4.959 1.00 1.00 N ATOM 137 CZ ARG A 9 14.678 -11.360 -4.594 1.00 1.00 C ATOM 138 NH1 ARG A 9 15.379 -11.872 -3.588 1.00 1.00 N ATOM 139 NH2 ARG A 9 13.802 -12.121 -5.233 1.00 1.00 N ATOM 0 H ARG A 9 13.210 -6.365 -2.678 1.00 1.00 H new ATOM 0 HA ARG A 9 12.159 -8.690 -1.510 1.00 1.00 H new ATOM 0 HB2 ARG A 9 13.633 -9.873 -2.915 1.00 1.00 H new ATOM 0 HB3 ARG A 9 13.163 -8.436 -3.800 1.00 1.00 H new ATOM 0 HG2 ARG A 9 15.300 -7.353 -3.285 1.00 1.00 H new ATOM 0 HG3 ARG A 9 15.765 -8.680 -2.238 1.00 1.00 H new ATOM 0 HD2 ARG A 9 16.132 -8.437 -5.077 1.00 1.00 H new ATOM 0 HD3 ARG A 9 16.682 -9.719 -4.015 1.00 1.00 H new ATOM 0 HE ARG A 9 14.274 -9.736 -5.725 1.00 1.00 H new ATOM 0 HH11 ARG A 9 16.053 -11.292 -3.089 1.00 1.00 H new ATOM 0 HH12 ARG A 9 15.243 -12.845 -3.315 1.00 1.00 H new ATOM 0 HH21 ARG A 9 13.257 -11.734 -6.004 1.00 1.00 H new ATOM 0 HH22 ARG A 9 13.672 -13.093 -4.954 1.00 1.00 H new ATOM 153 N ASP A 10 15.065 -7.665 -0.326 1.00 1.00 N ATOM 154 CA ASP A 10 15.995 -7.833 0.781 1.00 1.00 C ATOM 155 C ASP A 10 15.279 -7.678 2.121 1.00 1.00 C ATOM 156 O ASP A 10 15.534 -8.433 3.064 1.00 1.00 O ATOM 157 CB ASP A 10 17.114 -6.799 0.694 1.00 1.00 C ATOM 158 CG ASP A 10 18.355 -7.343 0.019 1.00 1.00 C ATOM 159 OD1 ASP A 10 18.259 -8.400 -0.637 1.00 1.00 O ATOM 160 OD2 ASP A 10 19.420 -6.701 0.132 1.00 1.00 O ATOM 0 H ASP A 10 15.281 -6.886 -0.948 1.00 1.00 H new ATOM 0 HA ASP A 10 16.415 -8.837 0.714 1.00 1.00 H new ATOM 0 HB2 ASP A 10 16.757 -5.928 0.144 1.00 1.00 H new ATOM 0 HB3 ASP A 10 17.370 -6.460 1.698 1.00 1.00 H new ATOM 165 N GLY A 11 14.388 -6.698 2.199 1.00 1.00 N ATOM 166 CA GLY A 11 13.652 -6.454 3.425 1.00 1.00 C ATOM 167 C GLY A 11 13.650 -4.980 3.811 1.00 1.00 C ATOM 168 O GLY A 11 13.968 -4.636 4.958 1.00 1.00 O ATOM 0 H GLY A 11 14.161 -6.065 1.432 1.00 1.00 H new ATOM 0 HA2 GLY A 11 12.625 -6.798 3.305 1.00 1.00 H new ATOM 0 HA3 GLY A 11 14.091 -7.039 4.233 1.00 1.00 H new ATOM 172 N LEU A 12 13.307 -4.126 2.855 1.00 1.00 N ATOM 173 CA LEU A 12 13.275 -2.674 3.090 1.00 1.00 C ATOM 174 C LEU A 12 11.948 -2.064 2.623 1.00 1.00 C ATOM 175 O LEU A 12 11.297 -2.581 1.718 1.00 1.00 O ATOM 176 CB LEU A 12 14.430 -1.998 2.357 1.00 1.00 C ATOM 177 CG LEU A 12 14.775 -0.597 2.853 1.00 1.00 C ATOM 178 CD1 LEU A 12 15.897 -0.653 3.877 1.00 1.00 C ATOM 179 CD2 LEU A 12 15.177 0.300 1.700 1.00 1.00 C ATOM 0 H LEU A 12 13.046 -4.405 1.909 1.00 1.00 H new ATOM 0 HA LEU A 12 13.374 -2.508 4.163 1.00 1.00 H new ATOM 0 HB2 LEU A 12 15.316 -2.627 2.446 1.00 1.00 H new ATOM 0 HB3 LEU A 12 14.185 -1.942 1.296 1.00 1.00 H new ATOM 0 HG LEU A 12 13.885 -0.181 3.325 1.00 1.00 H new ATOM 0 HD11 LEU A 12 16.129 0.356 4.219 1.00 1.00 H new ATOM 0 HD12 LEU A 12 15.585 -1.261 4.726 1.00 1.00 H new ATOM 0 HD13 LEU A 12 16.784 -1.094 3.422 1.00 1.00 H new ATOM 0 HD21 LEU A 12 15.418 1.293 2.079 1.00 1.00 H new ATOM 0 HD22 LEU A 12 16.050 -0.120 1.200 1.00 1.00 H new ATOM 0 HD23 LEU A 12 14.352 0.373 0.991 1.00 1.00 H new ATOM 191 N ILE A 13 11.545 -0.959 3.254 1.00 1.00 N ATOM 192 CA ILE A 13 10.289 -0.286 2.911 1.00 1.00 C ATOM 193 C ILE A 13 10.503 1.152 2.442 1.00 1.00 C ATOM 194 O ILE A 13 9.607 1.763 1.849 1.00 1.00 O ATOM 195 CB ILE A 13 9.310 -0.279 4.095 1.00 1.00 C ATOM 196 CG1 ILE A 13 9.837 0.570 5.246 1.00 1.00 C ATOM 197 CG2 ILE A 13 9.064 -1.709 4.566 1.00 1.00 C ATOM 198 CD1 ILE A 13 8.815 0.805 6.340 1.00 1.00 C ATOM 0 H ILE A 13 12.070 -0.511 4.005 1.00 1.00 H new ATOM 0 HA ILE A 13 9.864 -0.860 2.088 1.00 1.00 H new ATOM 0 HB ILE A 13 8.371 0.161 3.760 1.00 1.00 H new ATOM 0 HG12 ILE A 13 10.712 0.083 5.676 1.00 1.00 H new ATOM 0 HG13 ILE A 13 10.168 1.532 4.856 1.00 1.00 H new ATOM 0 HG21 ILE A 13 8.369 -1.701 5.406 1.00 1.00 H new ATOM 0 HG22 ILE A 13 8.639 -2.293 3.749 1.00 1.00 H new ATOM 0 HG23 ILE A 13 10.007 -2.156 4.880 1.00 1.00 H new ATOM 0 HD11 ILE A 13 9.258 1.416 7.126 1.00 1.00 H new ATOM 0 HD12 ILE A 13 7.949 1.320 5.924 1.00 1.00 H new ATOM 0 HD13 ILE A 13 8.502 -0.152 6.757 1.00 1.00 H new ATOM 210 N GLY A 14 11.682 1.703 2.723 1.00 1.00 N ATOM 211 CA GLY A 14 11.964 3.067 2.310 1.00 1.00 C ATOM 212 C GLY A 14 13.237 3.616 2.927 1.00 1.00 C ATOM 213 O GLY A 14 14.122 2.859 3.332 1.00 1.00 O ATOM 0 H GLY A 14 12.438 1.236 3.223 1.00 1.00 H new ATOM 0 HA2 GLY A 14 12.047 3.103 1.224 1.00 1.00 H new ATOM 0 HA3 GLY A 14 11.126 3.707 2.587 1.00 1.00 H new ATOM 217 N LYS A 15 13.334 4.934 2.994 1.00 1.00 N ATOM 218 CA LYS A 15 14.511 5.592 3.557 1.00 1.00 C ATOM 219 C LYS A 15 14.105 6.601 4.634 1.00 1.00 C ATOM 220 O LYS A 15 13.983 7.796 4.354 1.00 1.00 O ATOM 221 CB LYS A 15 15.304 6.307 2.444 1.00 1.00 C ATOM 222 CG LYS A 15 16.781 6.491 2.778 1.00 1.00 C ATOM 223 CD LYS A 15 17.623 6.680 1.528 1.00 1.00 C ATOM 224 CE LYS A 15 18.070 8.126 1.372 1.00 1.00 C ATOM 225 NZ LYS A 15 19.298 8.238 0.543 1.00 1.00 N ATOM 0 H LYS A 15 12.611 5.574 2.665 1.00 1.00 H new ATOM 0 HA LYS A 15 15.142 4.830 4.014 1.00 1.00 H new ATOM 0 HB2 LYS A 15 15.216 5.735 1.520 1.00 1.00 H new ATOM 0 HB3 LYS A 15 14.856 7.283 2.258 1.00 1.00 H new ATOM 0 HG2 LYS A 15 16.901 7.355 3.431 1.00 1.00 H new ATOM 0 HG3 LYS A 15 17.140 5.622 3.330 1.00 1.00 H new ATOM 0 HD2 LYS A 15 18.497 6.031 1.575 1.00 1.00 H new ATOM 0 HD3 LYS A 15 17.049 6.379 0.652 1.00 1.00 H new ATOM 0 HE2 LYS A 15 17.269 8.707 0.915 1.00 1.00 H new ATOM 0 HE3 LYS A 15 18.255 8.557 2.356 1.00 1.00 H new ATOM 0 HZ1 LYS A 15 19.571 9.238 0.460 1.00 1.00 H new ATOM 0 HZ2 LYS A 15 20.070 7.705 0.992 1.00 1.00 H new ATOM 0 HZ3 LYS A 15 19.114 7.850 -0.404 1.00 1.00 H new ATOM 239 N ASP A 16 13.908 6.115 5.862 1.00 1.00 N ATOM 240 CA ASP A 16 13.527 6.986 6.978 1.00 1.00 C ATOM 241 C ASP A 16 12.351 7.863 6.584 1.00 1.00 C ATOM 242 O ASP A 16 12.288 9.049 6.931 1.00 1.00 O ATOM 243 CB ASP A 16 14.719 7.840 7.402 1.00 1.00 C ATOM 244 CG ASP A 16 14.823 7.986 8.904 1.00 1.00 C ATOM 245 OD1 ASP A 16 13.792 8.287 9.542 1.00 1.00 O ATOM 246 OD2 ASP A 16 15.933 7.801 9.446 1.00 1.00 O ATOM 0 H ASP A 16 14.005 5.130 6.108 1.00 1.00 H new ATOM 0 HA ASP A 16 13.224 6.368 7.823 1.00 1.00 H new ATOM 0 HB2 ASP A 16 15.636 7.393 7.019 1.00 1.00 H new ATOM 0 HB3 ASP A 16 14.633 8.828 6.949 1.00 1.00 H new ATOM 251 N GLY A 17 11.404 7.264 5.867 1.00 1.00 N ATOM 252 CA GLY A 17 10.217 7.992 5.442 1.00 1.00 C ATOM 253 C GLY A 17 10.325 8.514 4.020 1.00 1.00 C ATOM 254 O GLY A 17 10.085 9.692 3.761 1.00 1.00 O ATOM 0 H GLY A 17 11.436 6.288 5.572 1.00 1.00 H new ATOM 0 HA2 GLY A 17 9.348 7.338 5.519 1.00 1.00 H new ATOM 0 HA3 GLY A 17 10.047 8.829 6.120 1.00 1.00 H new ATOM 258 N HIS A 18 10.700 7.640 3.098 1.00 1.00 N ATOM 259 CA HIS A 18 10.838 8.030 1.706 1.00 1.00 C ATOM 260 C HIS A 18 10.850 6.807 0.784 1.00 1.00 C ATOM 261 O HIS A 18 11.102 5.686 1.217 1.00 1.00 O ATOM 262 CB HIS A 18 12.120 8.840 1.511 1.00 1.00 C ATOM 263 CG HIS A 18 12.182 9.559 0.199 1.00 1.00 C ATOM 264 ND1 HIS A 18 12.577 9.139 -1.020 1.00 1.00 N flip ATOM 265 CD2 HIS A 18 11.818 10.880 0.051 1.00 1.00 C flip ATOM 266 CE1 HIS A 18 12.445 10.200 -1.882 1.00 1.00 C flip ATOM 267 NE2 HIS A 18 11.985 11.240 -1.211 1.00 1.00 N flip ATOM 0 H HIS A 18 10.913 6.661 3.289 1.00 1.00 H new ATOM 0 HA HIS A 18 9.977 8.645 1.444 1.00 1.00 H new ATOM 0 HB2 HIS A 18 12.207 9.567 2.318 1.00 1.00 H new ATOM 0 HB3 HIS A 18 12.977 8.172 1.590 1.00 1.00 H new ATOM 0 HD2 HIS A 18 11.454 11.520 0.841 1.00 1.00 H new ATOM 0 HE1 HIS A 18 12.679 10.186 -2.936 1.00 1.00 H new ATOM 0 HE2 HIS A 18 11.791 12.163 -1.599 1.00 1.00 H new ATOM 276 N LEU A 19 10.577 7.027 -0.499 1.00 1.00 N ATOM 277 CA LEU A 19 10.553 5.950 -1.482 1.00 1.00 C ATOM 278 C LEU A 19 11.811 5.971 -2.354 1.00 1.00 C ATOM 279 O LEU A 19 11.925 6.792 -3.261 1.00 1.00 O ATOM 280 CB LEU A 19 9.314 6.072 -2.352 1.00 1.00 C ATOM 281 CG LEU A 19 8.096 5.255 -1.882 1.00 1.00 C ATOM 282 CD1 LEU A 19 6.874 6.133 -1.698 1.00 1.00 C ATOM 283 CD2 LEU A 19 7.807 4.144 -2.871 1.00 1.00 C ATOM 0 H LEU A 19 10.368 7.948 -0.883 1.00 1.00 H new ATOM 0 HA LEU A 19 10.527 5.000 -0.948 1.00 1.00 H new ATOM 0 HB2 LEU A 19 9.028 7.123 -2.403 1.00 1.00 H new ATOM 0 HB3 LEU A 19 9.570 5.762 -3.365 1.00 1.00 H new ATOM 0 HG LEU A 19 8.335 4.819 -0.912 1.00 1.00 H new ATOM 0 HD11 LEU A 19 6.034 5.523 -1.366 1.00 1.00 H new ATOM 0 HD12 LEU A 19 7.085 6.898 -0.950 1.00 1.00 H new ATOM 0 HD13 LEU A 19 6.623 6.611 -2.645 1.00 1.00 H new ATOM 0 HD21 LEU A 19 6.944 3.570 -2.532 1.00 1.00 H new ATOM 0 HD22 LEU A 19 7.595 4.574 -3.850 1.00 1.00 H new ATOM 0 HD23 LEU A 19 8.674 3.487 -2.944 1.00 1.00 H new ATOM 295 N PRO A 20 12.785 5.079 -2.092 1.00 1.00 N ATOM 296 CA PRO A 20 14.031 5.019 -2.876 1.00 1.00 C ATOM 297 C PRO A 20 13.821 4.426 -4.264 1.00 1.00 C ATOM 298 O PRO A 20 14.557 4.737 -5.202 1.00 1.00 O ATOM 299 CB PRO A 20 14.926 4.107 -2.041 1.00 1.00 C ATOM 300 CG PRO A 20 13.984 3.230 -1.305 1.00 1.00 C ATOM 301 CD PRO A 20 12.758 4.059 -1.031 1.00 1.00 C ATOM 0 HA PRO A 20 14.447 6.011 -3.052 1.00 1.00 H new ATOM 0 HB2 PRO A 20 15.598 3.526 -2.672 1.00 1.00 H new ATOM 0 HB3 PRO A 20 15.549 4.682 -1.356 1.00 1.00 H new ATOM 0 HG2 PRO A 20 13.733 2.348 -1.895 1.00 1.00 H new ATOM 0 HG3 PRO A 20 14.429 2.876 -0.375 1.00 1.00 H new ATOM 0 HD2 PRO A 20 11.850 3.458 -1.076 1.00 1.00 H new ATOM 0 HD3 PRO A 20 12.793 4.511 -0.040 1.00 1.00 H new ATOM 309 N TRP A 21 12.807 3.582 -4.391 1.00 1.00 N ATOM 310 CA TRP A 21 12.493 2.956 -5.669 1.00 1.00 C ATOM 311 C TRP A 21 11.295 3.634 -6.330 1.00 1.00 C ATOM 312 O TRP A 21 10.311 3.954 -5.672 1.00 1.00 O ATOM 313 CB TRP A 21 12.215 1.463 -5.483 1.00 1.00 C ATOM 314 CG TRP A 21 10.879 1.183 -4.862 1.00 1.00 C ATOM 315 CD1 TRP A 21 9.662 1.217 -5.483 1.00 1.00 C ATOM 316 CD2 TRP A 21 10.626 0.825 -3.503 1.00 1.00 C ATOM 317 NE1 TRP A 21 8.668 0.907 -4.587 1.00 1.00 N ATOM 318 CE2 TRP A 21 9.236 0.661 -3.364 1.00 1.00 C ATOM 319 CE3 TRP A 21 11.443 0.628 -2.390 1.00 1.00 C ATOM 320 CZ2 TRP A 21 8.647 0.310 -2.153 1.00 1.00 C ATOM 321 CZ3 TRP A 21 10.859 0.281 -1.188 1.00 1.00 C ATOM 322 CH2 TRP A 21 9.471 0.125 -1.079 1.00 1.00 C ATOM 0 H TRP A 21 12.188 3.315 -3.626 1.00 1.00 H new ATOM 0 HA TRP A 21 13.358 3.074 -6.321 1.00 1.00 H new ATOM 0 HB2 TRP A 21 12.269 0.967 -6.452 1.00 1.00 H new ATOM 0 HB3 TRP A 21 12.996 1.030 -4.859 1.00 1.00 H new ATOM 0 HD1 TRP A 21 9.505 1.453 -6.525 1.00 1.00 H new ATOM 0 HE1 TRP A 21 7.671 0.867 -4.797 1.00 1.00 H new ATOM 0 HE3 TRP A 21 12.514 0.745 -2.467 1.00 1.00 H new ATOM 0 HZ2 TRP A 21 7.577 0.188 -2.065 1.00 1.00 H new ATOM 0 HZ3 TRP A 21 11.481 0.128 -0.319 1.00 1.00 H new ATOM 0 HH2 TRP A 21 9.043 -0.147 -0.125 1.00 1.00 H new ATOM 333 N HIS A 22 11.402 3.826 -7.639 1.00 1.00 N ATOM 334 CA HIS A 22 10.341 4.447 -8.417 1.00 1.00 C ATOM 335 C HIS A 22 9.705 3.439 -9.370 1.00 1.00 C ATOM 336 O HIS A 22 10.377 2.883 -10.240 1.00 1.00 O ATOM 337 CB HIS A 22 10.879 5.642 -9.204 1.00 1.00 C ATOM 338 CG HIS A 22 10.096 6.900 -8.992 1.00 1.00 C ATOM 339 ND1 HIS A 22 10.611 8.159 -9.223 1.00 1.00 N ATOM 340 CD2 HIS A 22 8.821 7.088 -8.576 1.00 1.00 C ATOM 341 CE1 HIS A 22 9.687 9.065 -8.958 1.00 1.00 C ATOM 342 NE2 HIS A 22 8.593 8.442 -8.565 1.00 1.00 N ATOM 0 H HIS A 22 12.220 3.558 -8.186 1.00 1.00 H new ATOM 0 HA HIS A 22 9.578 4.798 -7.723 1.00 1.00 H new ATOM 0 HB2 HIS A 22 11.916 5.817 -8.919 1.00 1.00 H new ATOM 0 HB3 HIS A 22 10.877 5.397 -10.266 1.00 1.00 H new ATOM 0 HD2 HIS A 22 8.115 6.317 -8.304 1.00 1.00 H new ATOM 0 HE1 HIS A 22 9.807 10.135 -9.048 1.00 1.00 H new ATOM 0 HE2 HIS A 22 7.719 8.893 -8.296 1.00 1.00 H new ATOM 351 N LEU A 23 8.400 3.209 -9.197 1.00 1.00 N ATOM 352 CA LEU A 23 7.674 2.262 -10.042 1.00 1.00 C ATOM 353 C LEU A 23 6.476 2.937 -10.691 1.00 1.00 C ATOM 354 O LEU A 23 5.353 2.841 -10.195 1.00 1.00 O ATOM 355 CB LEU A 23 7.223 1.055 -9.213 1.00 1.00 C ATOM 356 CG LEU A 23 7.887 -0.272 -9.565 1.00 1.00 C ATOM 357 CD1 LEU A 23 9.399 -0.129 -9.620 1.00 1.00 C ATOM 358 CD2 LEU A 23 7.496 -1.335 -8.551 1.00 1.00 C ATOM 0 H LEU A 23 7.830 3.663 -8.484 1.00 1.00 H new ATOM 0 HA LEU A 23 8.342 1.916 -10.831 1.00 1.00 H new ATOM 0 HB2 LEU A 23 7.413 1.268 -8.161 1.00 1.00 H new ATOM 0 HB3 LEU A 23 6.145 0.942 -9.326 1.00 1.00 H new ATOM 0 HG LEU A 23 7.540 -0.576 -10.553 1.00 1.00 H new ATOM 0 HD11 LEU A 23 9.846 -1.090 -9.873 1.00 1.00 H new ATOM 0 HD12 LEU A 23 9.668 0.607 -10.378 1.00 1.00 H new ATOM 0 HD13 LEU A 23 9.769 0.199 -8.649 1.00 1.00 H new ATOM 0 HD21 LEU A 23 7.975 -2.279 -8.811 1.00 1.00 H new ATOM 0 HD22 LEU A 23 7.819 -1.026 -7.557 1.00 1.00 H new ATOM 0 HD23 LEU A 23 6.414 -1.463 -8.557 1.00 1.00 H new ATOM 370 N PRO A 24 6.701 3.652 -11.805 1.00 1.00 N ATOM 371 CA PRO A 24 5.638 4.364 -12.525 1.00 1.00 C ATOM 372 C PRO A 24 4.456 3.458 -12.836 1.00 1.00 C ATOM 373 O PRO A 24 3.311 3.906 -12.825 1.00 1.00 O ATOM 374 CB PRO A 24 6.324 4.821 -13.814 1.00 1.00 C ATOM 375 CG PRO A 24 7.764 4.896 -13.460 1.00 1.00 C ATOM 376 CD PRO A 24 8.012 3.815 -12.446 1.00 1.00 C ATOM 0 HA PRO A 24 5.223 5.185 -11.941 1.00 1.00 H new ATOM 0 HB2 PRO A 24 6.151 4.116 -14.627 1.00 1.00 H new ATOM 0 HB3 PRO A 24 5.945 5.788 -14.144 1.00 1.00 H new ATOM 0 HG2 PRO A 24 8.388 4.751 -14.342 1.00 1.00 H new ATOM 0 HG3 PRO A 24 8.012 5.875 -13.051 1.00 1.00 H new ATOM 0 HD2 PRO A 24 8.348 2.891 -12.916 1.00 1.00 H new ATOM 0 HD3 PRO A 24 8.779 4.105 -11.727 1.00 1.00 H new ATOM 384 N ASP A 25 4.739 2.189 -13.116 1.00 1.00 N ATOM 385 CA ASP A 25 3.686 1.235 -13.431 1.00 1.00 C ATOM 386 C ASP A 25 2.867 0.911 -12.195 1.00 1.00 C ATOM 387 O ASP A 25 1.639 0.905 -12.240 1.00 1.00 O ATOM 388 CB ASP A 25 4.274 -0.050 -14.021 1.00 1.00 C ATOM 389 CG ASP A 25 4.857 0.157 -15.404 1.00 1.00 C ATOM 390 OD1 ASP A 25 5.103 1.324 -15.780 1.00 1.00 O ATOM 391 OD2 ASP A 25 5.074 -0.850 -16.111 1.00 1.00 O ATOM 0 H ASP A 25 5.682 1.802 -13.131 1.00 1.00 H new ATOM 0 HA ASP A 25 3.032 1.692 -14.174 1.00 1.00 H new ATOM 0 HB2 ASP A 25 5.051 -0.428 -13.356 1.00 1.00 H new ATOM 0 HB3 ASP A 25 3.496 -0.812 -14.069 1.00 1.00 H new ATOM 396 N ASP A 26 3.547 0.642 -11.077 1.00 1.00 N ATOM 397 CA ASP A 26 2.863 0.319 -9.833 1.00 1.00 C ATOM 398 C ASP A 26 2.048 1.507 -9.337 1.00 1.00 C ATOM 399 O ASP A 26 0.969 1.336 -8.776 1.00 1.00 O ATOM 400 CB ASP A 26 3.895 -0.098 -8.775 1.00 1.00 C ATOM 401 CG ASP A 26 3.283 -0.933 -7.659 1.00 1.00 C ATOM 402 OD1 ASP A 26 2.070 -0.795 -7.396 1.00 1.00 O ATOM 403 OD2 ASP A 26 4.031 -1.719 -7.041 1.00 1.00 O ATOM 0 H ASP A 26 4.565 0.643 -11.013 1.00 1.00 H new ATOM 0 HA ASP A 26 2.176 -0.507 -10.014 1.00 1.00 H new ATOM 0 HB2 ASP A 26 4.692 -0.667 -9.254 1.00 1.00 H new ATOM 0 HB3 ASP A 26 4.353 0.794 -8.347 1.00 1.00 H new ATOM 408 N LEU A 27 2.560 2.717 -9.561 1.00 1.00 N ATOM 409 CA LEU A 27 1.863 3.929 -9.139 1.00 1.00 C ATOM 410 C LEU A 27 0.516 4.071 -9.853 1.00 1.00 C ATOM 411 O LEU A 27 -0.485 4.431 -9.232 1.00 1.00 O ATOM 412 CB LEU A 27 2.727 5.162 -9.413 1.00 1.00 C ATOM 413 CG LEU A 27 3.559 5.662 -8.229 1.00 1.00 C ATOM 414 CD1 LEU A 27 2.714 6.520 -7.298 1.00 1.00 C ATOM 415 CD2 LEU A 27 4.158 4.486 -7.466 1.00 1.00 C ATOM 0 H LEU A 27 3.451 2.883 -10.030 1.00 1.00 H new ATOM 0 HA LEU A 27 1.677 3.850 -8.068 1.00 1.00 H new ATOM 0 HB2 LEU A 27 3.402 4.935 -10.238 1.00 1.00 H new ATOM 0 HB3 LEU A 27 2.078 5.972 -9.746 1.00 1.00 H new ATOM 0 HG LEU A 27 4.371 6.277 -8.619 1.00 1.00 H new ATOM 0 HD11 LEU A 27 3.326 6.864 -6.464 1.00 1.00 H new ATOM 0 HD12 LEU A 27 2.330 7.381 -7.845 1.00 1.00 H new ATOM 0 HD13 LEU A 27 1.880 5.931 -6.917 1.00 1.00 H new ATOM 0 HD21 LEU A 27 4.747 4.858 -6.627 1.00 1.00 H new ATOM 0 HD22 LEU A 27 3.357 3.849 -7.092 1.00 1.00 H new ATOM 0 HD23 LEU A 27 4.800 3.909 -8.132 1.00 1.00 H new ATOM 427 N HIS A 28 0.491 3.782 -11.144 1.00 1.00 N ATOM 428 CA HIS A 28 -0.739 3.881 -11.924 1.00 1.00 C ATOM 429 C HIS A 28 -1.813 2.992 -11.327 1.00 1.00 C ATOM 430 O HIS A 28 -2.969 3.390 -11.192 1.00 1.00 O ATOM 431 CB HIS A 28 -0.490 3.480 -13.379 1.00 1.00 C ATOM 432 CG HIS A 28 -1.241 4.320 -14.365 1.00 1.00 C ATOM 433 ND1 HIS A 28 -2.427 3.921 -14.945 1.00 1.00 N ATOM 434 CD2 HIS A 28 -0.965 5.542 -14.880 1.00 1.00 C ATOM 435 CE1 HIS A 28 -2.848 4.860 -15.774 1.00 1.00 C ATOM 436 NE2 HIS A 28 -1.980 5.854 -15.751 1.00 1.00 N ATOM 0 H HIS A 28 1.306 3.477 -11.676 1.00 1.00 H new ATOM 0 HA HIS A 28 -1.075 4.918 -11.898 1.00 1.00 H new ATOM 0 HB2 HIS A 28 0.577 3.552 -13.590 1.00 1.00 H new ATOM 0 HB3 HIS A 28 -0.772 2.436 -13.514 1.00 1.00 H new ATOM 0 HD2 HIS A 28 -0.107 6.156 -14.649 1.00 1.00 H new ATOM 0 HE1 HIS A 28 -3.749 4.821 -16.369 1.00 1.00 H new ATOM 0 HE2 HIS A 28 -2.052 6.715 -16.293 1.00 1.00 H new ATOM 445 N TYR A 29 -1.406 1.784 -10.960 1.00 1.00 N ATOM 446 CA TYR A 29 -2.312 0.831 -10.350 1.00 1.00 C ATOM 447 C TYR A 29 -2.850 1.401 -9.049 1.00 1.00 C ATOM 448 O TYR A 29 -4.050 1.331 -8.769 1.00 1.00 O ATOM 449 CB TYR A 29 -1.603 -0.498 -10.083 1.00 1.00 C ATOM 450 CG TYR A 29 -2.487 -1.543 -9.431 1.00 1.00 C ATOM 451 CD1 TYR A 29 -3.356 -2.317 -10.190 1.00 1.00 C ATOM 452 CD2 TYR A 29 -2.451 -1.753 -8.058 1.00 1.00 C ATOM 453 CE1 TYR A 29 -4.164 -3.271 -9.600 1.00 1.00 C ATOM 454 CE2 TYR A 29 -3.256 -2.705 -7.460 1.00 1.00 C ATOM 455 CZ TYR A 29 -4.109 -3.462 -8.235 1.00 1.00 C ATOM 456 OH TYR A 29 -4.909 -4.420 -7.648 1.00 1.00 O ATOM 0 H TYR A 29 -0.451 1.444 -11.076 1.00 1.00 H new ATOM 0 HA TYR A 29 -3.138 0.646 -11.037 1.00 1.00 H new ATOM 0 HB2 TYR A 29 -1.224 -0.893 -11.026 1.00 1.00 H new ATOM 0 HB3 TYR A 29 -0.739 -0.316 -9.444 1.00 1.00 H new ATOM 0 HD1 TYR A 29 -3.401 -2.171 -11.259 1.00 1.00 H new ATOM 0 HD2 TYR A 29 -1.783 -1.163 -7.448 1.00 1.00 H new ATOM 0 HE1 TYR A 29 -4.835 -3.864 -10.205 1.00 1.00 H new ATOM 0 HE2 TYR A 29 -3.217 -2.855 -6.391 1.00 1.00 H new ATOM 0 HH TYR A 29 -4.751 -4.430 -6.681 1.00 1.00 H new ATOM 466 N PHE A 30 -1.947 1.976 -8.252 1.00 1.00 N ATOM 467 CA PHE A 30 -2.316 2.571 -6.967 1.00 1.00 C ATOM 468 C PHE A 30 -3.308 3.718 -7.160 1.00 1.00 C ATOM 469 O PHE A 30 -4.313 3.805 -6.458 1.00 1.00 O ATOM 470 CB PHE A 30 -1.069 3.092 -6.252 1.00 1.00 C ATOM 471 CG PHE A 30 -1.322 3.632 -4.882 1.00 1.00 C ATOM 472 CD1 PHE A 30 -1.667 2.780 -3.847 1.00 1.00 C ATOM 473 CD2 PHE A 30 -1.214 4.989 -4.622 1.00 1.00 C ATOM 474 CE1 PHE A 30 -1.899 3.268 -2.576 1.00 1.00 C ATOM 475 CE2 PHE A 30 -1.446 5.484 -3.351 1.00 1.00 C ATOM 476 CZ PHE A 30 -1.789 4.623 -2.327 1.00 1.00 C ATOM 0 H PHE A 30 -0.954 2.042 -8.475 1.00 1.00 H new ATOM 0 HA PHE A 30 -2.789 1.798 -6.361 1.00 1.00 H new ATOM 0 HB2 PHE A 30 -0.341 2.284 -6.182 1.00 1.00 H new ATOM 0 HB3 PHE A 30 -0.617 3.876 -6.860 1.00 1.00 H new ATOM 0 HD1 PHE A 30 -1.756 1.720 -4.036 1.00 1.00 H new ATOM 0 HD2 PHE A 30 -0.946 5.667 -5.419 1.00 1.00 H new ATOM 0 HE1 PHE A 30 -2.166 2.592 -1.778 1.00 1.00 H new ATOM 0 HE2 PHE A 30 -1.359 6.543 -3.160 1.00 1.00 H new ATOM 0 HZ PHE A 30 -1.971 5.008 -1.334 1.00 1.00 H new ATOM 486 N ARG A 31 -3.015 4.591 -8.110 1.00 1.00 N ATOM 487 CA ARG A 31 -3.889 5.732 -8.383 1.00 1.00 C ATOM 488 C ARG A 31 -5.275 5.263 -8.813 1.00 1.00 C ATOM 489 O ARG A 31 -6.290 5.804 -8.359 1.00 1.00 O ATOM 490 CB ARG A 31 -3.290 6.617 -9.466 1.00 1.00 C ATOM 491 CG ARG A 31 -3.701 8.071 -9.367 1.00 1.00 C ATOM 492 CD ARG A 31 -2.780 8.975 -10.177 1.00 1.00 C ATOM 493 NE ARG A 31 -3.515 10.005 -10.899 1.00 1.00 N ATOM 494 CZ ARG A 31 -4.351 9.766 -11.909 1.00 1.00 C ATOM 495 NH1 ARG A 31 -4.609 8.520 -12.292 1.00 1.00 N ATOM 496 NH2 ARG A 31 -4.932 10.776 -12.541 1.00 1.00 N ATOM 0 H ARG A 31 -2.187 4.537 -8.703 1.00 1.00 H new ATOM 0 HA ARG A 31 -3.983 6.309 -7.463 1.00 1.00 H new ATOM 0 HB2 ARG A 31 -2.203 6.552 -9.414 1.00 1.00 H new ATOM 0 HB3 ARG A 31 -3.586 6.231 -10.442 1.00 1.00 H new ATOM 0 HG2 ARG A 31 -4.725 8.184 -9.722 1.00 1.00 H new ATOM 0 HG3 ARG A 31 -3.689 8.382 -8.322 1.00 1.00 H new ATOM 0 HD2 ARG A 31 -2.058 9.446 -9.510 1.00 1.00 H new ATOM 0 HD3 ARG A 31 -2.213 8.372 -10.886 1.00 1.00 H new ATOM 0 HE ARG A 31 -3.381 10.975 -10.612 1.00 1.00 H new ATOM 0 HH11 ARG A 31 -4.166 7.737 -11.812 1.00 1.00 H new ATOM 0 HH12 ARG A 31 -5.250 8.347 -13.066 1.00 1.00 H new ATOM 0 HH21 ARG A 31 -4.739 11.736 -12.254 1.00 1.00 H new ATOM 0 HH22 ARG A 31 -5.572 10.593 -13.314 1.00 1.00 H new ATOM 510 N ALA A 32 -5.315 4.250 -9.662 1.00 1.00 N ATOM 511 CA ALA A 32 -6.574 3.701 -10.140 1.00 1.00 C ATOM 512 C ALA A 32 -7.369 3.092 -8.985 1.00 1.00 C ATOM 513 O ALA A 32 -8.593 3.177 -8.948 1.00 1.00 O ATOM 514 CB ALA A 32 -6.319 2.656 -11.208 1.00 1.00 C ATOM 0 H ALA A 32 -4.486 3.789 -10.036 1.00 1.00 H new ATOM 0 HA ALA A 32 -7.160 4.511 -10.573 1.00 1.00 H new ATOM 0 HB1 ALA A 32 -7.270 2.253 -11.557 1.00 1.00 H new ATOM 0 HB2 ALA A 32 -5.789 3.112 -12.044 1.00 1.00 H new ATOM 0 HB3 ALA A 32 -5.714 1.850 -10.792 1.00 1.00 H new ATOM 520 N GLN A 33 -6.652 2.471 -8.056 1.00 1.00 N ATOM 521 CA GLN A 33 -7.254 1.834 -6.893 1.00 1.00 C ATOM 522 C GLN A 33 -7.944 2.861 -5.988 1.00 1.00 C ATOM 523 O GLN A 33 -9.012 2.617 -5.447 1.00 1.00 O ATOM 524 CB GLN A 33 -6.182 1.098 -6.091 1.00 1.00 C ATOM 525 CG GLN A 33 -6.314 -0.422 -6.161 1.00 1.00 C ATOM 526 CD GLN A 33 -7.235 -0.988 -5.096 1.00 1.00 C ATOM 527 OE1 GLN A 33 -8.442 -1.123 -5.302 1.00 1.00 O ATOM 528 NE2 GLN A 33 -6.660 -1.344 -3.953 1.00 1.00 N ATOM 0 H GLN A 33 -5.635 2.395 -8.089 1.00 1.00 H new ATOM 0 HA GLN A 33 -8.004 1.128 -7.250 1.00 1.00 H new ATOM 0 HB2 GLN A 33 -5.198 1.388 -6.460 1.00 1.00 H new ATOM 0 HB3 GLN A 33 -6.237 1.413 -5.049 1.00 1.00 H new ATOM 0 HG2 GLN A 33 -6.689 -0.703 -7.145 1.00 1.00 H new ATOM 0 HG3 GLN A 33 -5.327 -0.872 -6.056 1.00 1.00 H new ATOM 0 HE21 GLN A 33 -5.656 -1.214 -3.825 1.00 1.00 H new ATOM 0 HE22 GLN A 33 -7.222 -1.747 -3.203 1.00 1.00 H new ATOM 537 N THR A 34 -7.336 4.015 -5.841 1.00 1.00 N ATOM 538 CA THR A 34 -7.890 5.066 -4.989 1.00 1.00 C ATOM 539 C THR A 34 -9.042 5.809 -5.664 1.00 1.00 C ATOM 540 O THR A 34 -9.607 6.740 -5.082 1.00 1.00 O ATOM 541 CB THR A 34 -6.789 6.052 -4.616 1.00 1.00 C ATOM 542 OG1 THR A 34 -6.056 6.423 -5.753 1.00 1.00 O ATOM 543 CG2 THR A 34 -5.820 5.506 -3.595 1.00 1.00 C ATOM 0 H THR A 34 -6.457 4.259 -6.296 1.00 1.00 H new ATOM 0 HA THR A 34 -8.289 4.590 -4.093 1.00 1.00 H new ATOM 0 HB THR A 34 -7.299 6.910 -4.179 1.00 1.00 H new ATOM 0 HG1 THR A 34 -6.566 6.198 -6.559 1.00 1.00 H new ATOM 0 HG21 THR A 34 -5.062 6.258 -3.374 1.00 1.00 H new ATOM 0 HG22 THR A 34 -6.358 5.254 -2.681 1.00 1.00 H new ATOM 0 HG23 THR A 34 -5.339 4.612 -3.992 1.00 1.00 H new ATOM 551 N VAL A 35 -9.407 5.405 -6.880 1.00 1.00 N ATOM 552 CA VAL A 35 -10.502 6.050 -7.585 1.00 1.00 C ATOM 553 C VAL A 35 -11.813 5.368 -7.220 1.00 1.00 C ATOM 554 O VAL A 35 -11.955 4.154 -7.356 1.00 1.00 O ATOM 555 CB VAL A 35 -10.311 6.007 -9.112 1.00 1.00 C ATOM 556 CG1 VAL A 35 -11.194 7.027 -9.801 1.00 1.00 C ATOM 557 CG2 VAL A 35 -8.857 6.227 -9.475 1.00 1.00 C ATOM 0 H VAL A 35 -8.963 4.641 -7.389 1.00 1.00 H new ATOM 0 HA VAL A 35 -10.521 7.097 -7.281 1.00 1.00 H new ATOM 0 HB VAL A 35 -10.607 5.017 -9.460 1.00 1.00 H new ATOM 0 HG11 VAL A 35 -11.038 6.974 -10.879 1.00 1.00 H new ATOM 0 HG12 VAL A 35 -12.239 6.816 -9.575 1.00 1.00 H new ATOM 0 HG13 VAL A 35 -10.941 8.026 -9.446 1.00 1.00 H new ATOM 0 HG21 VAL A 35 -8.743 6.193 -10.559 1.00 1.00 H new ATOM 0 HG22 VAL A 35 -8.533 7.200 -9.107 1.00 1.00 H new ATOM 0 HG23 VAL A 35 -8.247 5.446 -9.021 1.00 1.00 H new ATOM 567 N GLY A 36 -12.754 6.168 -6.726 1.00 1.00 N ATOM 568 CA GLY A 36 -14.043 5.630 -6.319 1.00 1.00 C ATOM 569 C GLY A 36 -13.974 4.927 -4.982 1.00 1.00 C ATOM 570 O GLY A 36 -14.855 4.137 -4.639 1.00 1.00 O ATOM 0 H GLY A 36 -12.649 7.175 -6.600 1.00 1.00 H new ATOM 0 HA2 GLY A 36 -14.771 6.439 -6.265 1.00 1.00 H new ATOM 0 HA3 GLY A 36 -14.398 4.932 -7.077 1.00 1.00 H new ATOM 574 N LYS A 37 -12.920 5.211 -4.220 1.00 1.00 N ATOM 575 CA LYS A 37 -12.722 4.595 -2.916 1.00 1.00 C ATOM 576 C LYS A 37 -12.086 5.583 -1.955 1.00 1.00 C ATOM 577 O LYS A 37 -11.437 6.542 -2.382 1.00 1.00 O ATOM 578 CB LYS A 37 -11.849 3.350 -3.041 1.00 1.00 C ATOM 579 CG LYS A 37 -11.963 2.652 -4.388 1.00 1.00 C ATOM 580 CD LYS A 37 -11.202 1.329 -4.406 1.00 1.00 C ATOM 581 CE LYS A 37 -11.969 0.237 -3.677 1.00 1.00 C ATOM 582 NZ LYS A 37 -12.674 -0.674 -4.620 1.00 1.00 N ATOM 0 H LYS A 37 -12.188 5.868 -4.488 1.00 1.00 H new ATOM 0 HA LYS A 37 -13.696 4.301 -2.524 1.00 1.00 H new ATOM 0 HB2 LYS A 37 -10.809 3.629 -2.874 1.00 1.00 H new ATOM 0 HB3 LYS A 37 -12.121 2.647 -2.254 1.00 1.00 H new ATOM 0 HG2 LYS A 37 -13.013 2.470 -4.616 1.00 1.00 H new ATOM 0 HG3 LYS A 37 -11.576 3.305 -5.170 1.00 1.00 H new ATOM 0 HD2 LYS A 37 -11.024 1.024 -5.437 1.00 1.00 H new ATOM 0 HD3 LYS A 37 -10.226 1.463 -3.940 1.00 1.00 H new ATOM 0 HE2 LYS A 37 -11.280 -0.341 -3.062 1.00 1.00 H new ATOM 0 HE3 LYS A 37 -12.694 0.692 -3.002 1.00 1.00 H new ATOM 0 HZ1 LYS A 37 -13.184 -1.403 -4.082 1.00 1.00 H new ATOM 0 HZ2 LYS A 37 -13.351 -0.127 -5.190 1.00 1.00 H new ATOM 0 HZ3 LYS A 37 -11.980 -1.128 -5.248 1.00 1.00 H new ATOM 596 N ILE A 38 -12.269 5.357 -0.659 1.00 1.00 N ATOM 597 CA ILE A 38 -11.716 6.244 0.364 1.00 1.00 C ATOM 598 C ILE A 38 -10.536 5.580 1.063 1.00 1.00 C ATOM 599 O ILE A 38 -10.640 4.456 1.547 1.00 1.00 O ATOM 600 CB ILE A 38 -12.778 6.626 1.413 1.00 1.00 C ATOM 601 CG1 ILE A 38 -13.869 7.505 0.795 1.00 1.00 C ATOM 602 CG2 ILE A 38 -12.121 7.342 2.587 1.00 1.00 C ATOM 603 CD1 ILE A 38 -15.256 7.232 1.348 1.00 1.00 C ATOM 0 H ILE A 38 -12.797 4.566 -0.289 1.00 1.00 H new ATOM 0 HA ILE A 38 -11.381 7.151 -0.139 1.00 1.00 H new ATOM 0 HB ILE A 38 -13.247 5.711 1.774 1.00 1.00 H new ATOM 0 HG12 ILE A 38 -13.619 8.552 0.964 1.00 1.00 H new ATOM 0 HG13 ILE A 38 -13.880 7.351 -0.284 1.00 1.00 H new ATOM 0 HG21 ILE A 38 -12.880 7.607 3.322 1.00 1.00 H new ATOM 0 HG22 ILE A 38 -11.384 6.684 3.048 1.00 1.00 H new ATOM 0 HG23 ILE A 38 -11.628 8.247 2.232 1.00 1.00 H new ATOM 0 HD11 ILE A 38 -15.977 7.891 0.864 1.00 1.00 H new ATOM 0 HD12 ILE A 38 -15.527 6.194 1.155 1.00 1.00 H new ATOM 0 HD13 ILE A 38 -15.262 7.415 2.423 1.00 1.00 H new ATOM 615 N MET A 39 -9.405 6.285 1.104 1.00 1.00 N ATOM 616 CA MET A 39 -8.202 5.752 1.721 1.00 1.00 C ATOM 617 C MET A 39 -7.621 6.734 2.733 1.00 1.00 C ATOM 618 O MET A 39 -7.740 7.951 2.586 1.00 1.00 O ATOM 619 CB MET A 39 -7.157 5.405 0.662 1.00 1.00 C ATOM 620 CG MET A 39 -5.749 5.845 1.038 1.00 1.00 C ATOM 621 SD MET A 39 -4.507 5.294 -0.152 1.00 1.00 S ATOM 622 CE MET A 39 -3.863 6.867 -0.743 1.00 1.00 C ATOM 0 H MET A 39 -9.302 7.223 0.717 1.00 1.00 H new ATOM 0 HA MET A 39 -8.478 4.840 2.250 1.00 1.00 H new ATOM 0 HB2 MET A 39 -7.161 4.328 0.497 1.00 1.00 H new ATOM 0 HB3 MET A 39 -7.437 5.873 -0.282 1.00 1.00 H new ATOM 0 HG2 MET A 39 -5.720 6.932 1.111 1.00 1.00 H new ATOM 0 HG3 MET A 39 -5.501 5.453 2.024 1.00 1.00 H new ATOM 0 HE1 MET A 39 -3.609 6.782 -1.800 1.00 1.00 H new ATOM 0 HE2 MET A 39 -4.619 7.642 -0.612 1.00 1.00 H new ATOM 0 HE3 MET A 39 -2.971 7.131 -0.176 1.00 1.00 H new ATOM 632 N VAL A 40 -6.996 6.171 3.756 1.00 1.00 N ATOM 633 CA VAL A 40 -6.373 6.951 4.814 1.00 1.00 C ATOM 634 C VAL A 40 -4.878 6.670 4.903 1.00 1.00 C ATOM 635 O VAL A 40 -4.461 5.510 4.948 1.00 1.00 O ATOM 636 CB VAL A 40 -7.007 6.652 6.179 1.00 1.00 C ATOM 637 CG1 VAL A 40 -6.631 7.732 7.185 1.00 1.00 C ATOM 638 CG2 VAL A 40 -8.518 6.529 6.053 1.00 1.00 C ATOM 0 H VAL A 40 -6.907 5.162 3.876 1.00 1.00 H new ATOM 0 HA VAL A 40 -6.533 7.999 4.561 1.00 1.00 H new ATOM 0 HB VAL A 40 -6.621 5.699 6.540 1.00 1.00 H new ATOM 0 HG11 VAL A 40 -7.088 7.507 8.149 1.00 1.00 H new ATOM 0 HG12 VAL A 40 -5.547 7.764 7.296 1.00 1.00 H new ATOM 0 HG13 VAL A 40 -6.989 8.699 6.831 1.00 1.00 H new ATOM 0 HG21 VAL A 40 -8.949 6.317 7.032 1.00 1.00 H new ATOM 0 HG22 VAL A 40 -8.929 7.464 5.671 1.00 1.00 H new ATOM 0 HG23 VAL A 40 -8.761 5.718 5.366 1.00 1.00 H new ATOM 648 N VAL A 41 -4.088 7.731 4.923 1.00 1.00 N ATOM 649 CA VAL A 41 -2.638 7.607 5.004 1.00 1.00 C ATOM 650 C VAL A 41 -2.085 8.335 6.228 1.00 1.00 C ATOM 651 O VAL A 41 -2.434 9.479 6.493 1.00 1.00 O ATOM 652 CB VAL A 41 -1.949 8.168 3.741 1.00 1.00 C ATOM 653 CG1 VAL A 41 -2.219 7.282 2.532 1.00 1.00 C ATOM 654 CG2 VAL A 41 -2.409 9.590 3.483 1.00 1.00 C ATOM 0 H VAL A 41 -4.426 8.693 4.884 1.00 1.00 H new ATOM 0 HA VAL A 41 -2.423 6.542 5.087 1.00 1.00 H new ATOM 0 HB VAL A 41 -0.872 8.177 3.911 1.00 1.00 H new ATOM 0 HG11 VAL A 41 -1.722 7.700 1.656 1.00 1.00 H new ATOM 0 HG12 VAL A 41 -1.836 6.280 2.723 1.00 1.00 H new ATOM 0 HG13 VAL A 41 -3.293 7.231 2.351 1.00 1.00 H new ATOM 0 HG21 VAL A 41 -1.917 9.975 2.590 1.00 1.00 H new ATOM 0 HG22 VAL A 41 -3.489 9.602 3.336 1.00 1.00 H new ATOM 0 HG23 VAL A 41 -2.152 10.216 4.338 1.00 1.00 H new ATOM 664 N GLY A 42 -1.227 7.643 6.978 1.00 1.00 N ATOM 665 CA GLY A 42 -0.647 8.238 8.173 1.00 1.00 C ATOM 666 C GLY A 42 0.265 9.406 7.850 1.00 1.00 C ATOM 667 O GLY A 42 0.701 9.566 6.702 1.00 1.00 O ATOM 0 H GLY A 42 -0.925 6.689 6.782 1.00 1.00 H new ATOM 0 HA2 GLY A 42 -1.446 8.576 8.833 1.00 1.00 H new ATOM 0 HA3 GLY A 42 -0.084 7.480 8.717 1.00 1.00 H new ATOM 671 N ARG A 43 0.521 10.243 8.854 1.00 1.00 N ATOM 672 CA ARG A 43 1.354 11.422 8.667 1.00 1.00 C ATOM 673 C ARG A 43 2.768 11.067 8.237 1.00 1.00 C ATOM 674 O ARG A 43 3.309 11.667 7.331 1.00 1.00 O ATOM 675 CB ARG A 43 1.400 12.244 9.948 1.00 1.00 C ATOM 676 CG ARG A 43 1.513 13.740 9.698 1.00 1.00 C ATOM 677 CD ARG A 43 2.568 14.366 10.588 1.00 1.00 C ATOM 678 NE ARG A 43 3.791 14.685 9.852 1.00 1.00 N ATOM 679 CZ ARG A 43 4.792 15.417 10.342 1.00 1.00 C ATOM 680 NH1 ARG A 43 4.729 15.901 11.576 1.00 1.00 N ATOM 681 NH2 ARG A 43 5.860 15.668 9.597 1.00 1.00 N ATOM 0 H ARG A 43 0.163 10.124 9.802 1.00 1.00 H new ATOM 0 HA ARG A 43 0.902 12.009 7.867 1.00 1.00 H new ATOM 0 HB2 ARG A 43 0.500 12.047 10.531 1.00 1.00 H new ATOM 0 HB3 ARG A 43 2.248 11.918 10.551 1.00 1.00 H new ATOM 0 HG2 ARG A 43 1.763 13.919 8.652 1.00 1.00 H new ATOM 0 HG3 ARG A 43 0.550 14.216 9.881 1.00 1.00 H new ATOM 0 HD2 ARG A 43 2.169 15.275 11.038 1.00 1.00 H new ATOM 0 HD3 ARG A 43 2.804 13.683 11.404 1.00 1.00 H new ATOM 0 HE ARG A 43 3.884 14.324 8.903 1.00 1.00 H new ATOM 0 HH11 ARG A 43 3.911 15.714 12.156 1.00 1.00 H new ATOM 0 HH12 ARG A 43 5.498 16.460 11.944 1.00 1.00 H new ATOM 0 HH21 ARG A 43 5.917 15.301 8.647 1.00 1.00 H new ATOM 0 HH22 ARG A 43 6.625 16.228 9.974 1.00 1.00 H new ATOM 695 N ARG A 44 3.348 10.067 8.854 1.00 1.00 N ATOM 696 CA ARG A 44 4.703 9.663 8.494 1.00 1.00 C ATOM 697 C ARG A 44 4.757 9.256 7.029 1.00 1.00 C ATOM 698 O ARG A 44 5.750 9.503 6.334 1.00 1.00 O ATOM 699 CB ARG A 44 5.186 8.521 9.380 1.00 1.00 C ATOM 700 CG ARG A 44 5.739 8.970 10.730 1.00 1.00 C ATOM 701 CD ARG A 44 6.979 9.835 10.555 1.00 1.00 C ATOM 702 NE ARG A 44 6.758 11.198 11.033 1.00 1.00 N ATOM 703 CZ ARG A 44 7.656 12.176 10.938 1.00 1.00 C ATOM 704 NH1 ARG A 44 8.843 11.944 10.392 1.00 1.00 N ATOM 705 NH2 ARG A 44 7.366 13.388 11.391 1.00 1.00 N ATOM 0 H ARG A 44 2.918 9.519 9.599 1.00 1.00 H new ATOM 0 HA ARG A 44 5.366 10.514 8.649 1.00 1.00 H new ATOM 0 HB2 ARG A 44 4.359 7.832 9.549 1.00 1.00 H new ATOM 0 HB3 ARG A 44 5.959 7.966 8.849 1.00 1.00 H new ATOM 0 HG2 ARG A 44 4.976 9.529 11.271 1.00 1.00 H new ATOM 0 HG3 ARG A 44 5.984 8.097 11.335 1.00 1.00 H new ATOM 0 HD2 ARG A 44 7.813 9.390 11.097 1.00 1.00 H new ATOM 0 HD3 ARG A 44 7.260 9.860 9.502 1.00 1.00 H new ATOM 0 HE ARG A 44 5.860 11.413 11.466 1.00 1.00 H new ATOM 0 HH11 ARG A 44 9.071 11.013 10.043 1.00 1.00 H new ATOM 0 HH12 ARG A 44 9.528 12.697 10.321 1.00 1.00 H new ATOM 0 HH21 ARG A 44 6.455 13.571 11.812 1.00 1.00 H new ATOM 0 HH22 ARG A 44 8.054 14.138 11.318 1.00 1.00 H new ATOM 719 N THR A 45 3.683 8.639 6.571 1.00 1.00 N ATOM 720 CA THR A 45 3.578 8.195 5.178 1.00 1.00 C ATOM 721 C THR A 45 3.594 9.391 4.234 1.00 1.00 C ATOM 722 O THR A 45 4.281 9.384 3.204 1.00 1.00 O ATOM 723 CB THR A 45 2.311 7.358 4.964 1.00 1.00 C ATOM 724 OG1 THR A 45 2.354 6.194 5.754 1.00 1.00 O ATOM 725 CG2 THR A 45 2.099 6.925 3.524 1.00 1.00 C ATOM 0 H THR A 45 2.863 8.430 7.140 1.00 1.00 H new ATOM 0 HA THR A 45 4.441 7.567 4.956 1.00 1.00 H new ATOM 0 HB THR A 45 1.485 8.010 5.249 1.00 1.00 H new ATOM 0 HG1 THR A 45 1.516 6.108 6.255 1.00 1.00 H new ATOM 0 HG21 THR A 45 1.184 6.337 3.452 1.00 1.00 H new ATOM 0 HG22 THR A 45 2.016 7.806 2.888 1.00 1.00 H new ATOM 0 HG23 THR A 45 2.945 6.320 3.198 1.00 1.00 H new ATOM 733 N TYR A 46 2.825 10.419 4.581 1.00 1.00 N ATOM 734 CA TYR A 46 2.743 11.625 3.756 1.00 1.00 C ATOM 735 C TYR A 46 4.138 12.113 3.378 1.00 1.00 C ATOM 736 O TYR A 46 4.412 12.419 2.222 1.00 1.00 O ATOM 737 CB TYR A 46 1.981 12.734 4.497 1.00 1.00 C ATOM 738 CG TYR A 46 1.077 13.551 3.588 1.00 1.00 C ATOM 739 CD1 TYR A 46 1.311 13.624 2.221 1.00 1.00 C ATOM 740 CD2 TYR A 46 -0.011 14.241 4.106 1.00 1.00 C ATOM 741 CE1 TYR A 46 0.486 14.362 1.395 1.00 1.00 C ATOM 742 CE2 TYR A 46 -0.839 14.983 3.287 1.00 1.00 C ATOM 743 CZ TYR A 46 -0.587 15.041 1.933 1.00 1.00 C ATOM 744 OH TYR A 46 -1.413 15.772 1.118 1.00 1.00 O ATOM 0 H TYR A 46 2.251 10.444 5.424 1.00 1.00 H new ATOM 0 HA TYR A 46 2.201 11.376 2.844 1.00 1.00 H new ATOM 0 HB2 TYR A 46 1.380 12.286 5.289 1.00 1.00 H new ATOM 0 HB3 TYR A 46 2.698 13.399 4.978 1.00 1.00 H new ATOM 0 HD1 TYR A 46 2.152 13.095 1.797 1.00 1.00 H new ATOM 0 HD2 TYR A 46 -0.213 14.197 5.166 1.00 1.00 H new ATOM 0 HE1 TYR A 46 0.680 14.407 0.334 1.00 1.00 H new ATOM 0 HE2 TYR A 46 -1.680 15.516 3.705 1.00 1.00 H new ATOM 0 HH TYR A 46 -2.120 16.187 1.656 1.00 1.00 H new ATOM 754 N GLU A 47 5.018 12.166 4.366 1.00 1.00 N ATOM 755 CA GLU A 47 6.389 12.604 4.155 1.00 1.00 C ATOM 756 C GLU A 47 7.105 11.766 3.092 1.00 1.00 C ATOM 757 O GLU A 47 8.099 12.197 2.520 1.00 1.00 O ATOM 758 CB GLU A 47 7.159 12.546 5.477 1.00 1.00 C ATOM 759 CG GLU A 47 7.372 13.903 6.113 1.00 1.00 C ATOM 760 CD GLU A 47 8.394 14.744 5.375 1.00 1.00 C ATOM 761 OE1 GLU A 47 8.251 14.928 4.149 1.00 1.00 O ATOM 762 OE2 GLU A 47 9.349 15.210 6.032 1.00 1.00 O ATOM 0 H GLU A 47 4.804 11.909 5.330 1.00 1.00 H new ATOM 0 HA GLU A 47 6.357 13.631 3.791 1.00 1.00 H new ATOM 0 HB2 GLU A 47 6.618 11.907 6.175 1.00 1.00 H new ATOM 0 HB3 GLU A 47 8.128 12.079 5.303 1.00 1.00 H new ATOM 0 HG2 GLU A 47 6.423 14.438 6.144 1.00 1.00 H new ATOM 0 HG3 GLU A 47 7.696 13.769 7.145 1.00 1.00 H new ATOM 769 N SER A 48 6.598 10.564 2.838 1.00 1.00 N ATOM 770 CA SER A 48 7.207 9.666 1.858 1.00 1.00 C ATOM 771 C SER A 48 6.610 9.865 0.471 1.00 1.00 C ATOM 772 O SER A 48 7.255 9.557 -0.534 1.00 1.00 O ATOM 773 CB SER A 48 7.023 8.212 2.284 1.00 1.00 C ATOM 774 OG SER A 48 6.607 7.411 1.192 1.00 1.00 O ATOM 0 H SER A 48 5.768 10.188 3.296 1.00 1.00 H new ATOM 0 HA SER A 48 8.270 9.904 1.814 1.00 1.00 H new ATOM 0 HB2 SER A 48 7.960 7.826 2.686 1.00 1.00 H new ATOM 0 HB3 SER A 48 6.285 8.154 3.084 1.00 1.00 H new ATOM 0 HG SER A 48 6.498 6.484 1.489 1.00 1.00 H new ATOM 780 N PHE A 49 5.371 10.356 0.412 1.00 1.00 N ATOM 781 CA PHE A 49 4.688 10.575 -0.865 1.00 1.00 C ATOM 782 C PHE A 49 5.609 11.276 -1.859 1.00 1.00 C ATOM 783 O PHE A 49 5.865 12.465 -1.717 1.00 1.00 O ATOM 784 CB PHE A 49 3.421 11.408 -0.641 1.00 1.00 C ATOM 785 CG PHE A 49 2.222 10.588 -0.292 1.00 1.00 C ATOM 786 CD1 PHE A 49 2.350 9.408 0.426 1.00 1.00 C ATOM 787 CD2 PHE A 49 0.956 10.989 -0.685 1.00 1.00 C ATOM 788 CE1 PHE A 49 1.239 8.647 0.743 1.00 1.00 C ATOM 789 CE2 PHE A 49 -0.157 10.235 -0.370 1.00 1.00 C ATOM 790 CZ PHE A 49 -0.016 9.062 0.343 1.00 1.00 C ATOM 0 H PHE A 49 4.820 10.609 1.232 1.00 1.00 H new ATOM 0 HA PHE A 49 4.412 9.606 -1.281 1.00 1.00 H new ATOM 0 HB2 PHE A 49 3.605 12.127 0.158 1.00 1.00 H new ATOM 0 HB3 PHE A 49 3.209 11.982 -1.543 1.00 1.00 H new ATOM 0 HD1 PHE A 49 3.329 9.079 0.741 1.00 1.00 H new ATOM 0 HD2 PHE A 49 0.838 11.904 -1.246 1.00 1.00 H new ATOM 0 HE1 PHE A 49 1.353 7.730 1.302 1.00 1.00 H new ATOM 0 HE2 PHE A 49 -1.138 10.563 -0.682 1.00 1.00 H new ATOM 0 HZ PHE A 49 -0.885 8.470 0.588 1.00 1.00 H new ATOM 800 N PRO A 50 6.128 10.550 -2.868 1.00 1.00 N ATOM 801 CA PRO A 50 7.040 11.127 -3.865 1.00 1.00 C ATOM 802 C PRO A 50 6.319 12.018 -4.874 1.00 1.00 C ATOM 803 O PRO A 50 6.908 12.928 -5.440 1.00 1.00 O ATOM 804 CB PRO A 50 7.613 9.895 -4.559 1.00 1.00 C ATOM 805 CG PRO A 50 6.561 8.860 -4.435 1.00 1.00 C ATOM 806 CD PRO A 50 5.885 9.115 -3.115 1.00 1.00 C ATOM 0 HA PRO A 50 7.790 11.772 -3.408 1.00 1.00 H new ATOM 0 HB2 PRO A 50 7.842 10.102 -5.604 1.00 1.00 H new ATOM 0 HB3 PRO A 50 8.541 9.573 -4.087 1.00 1.00 H new ATOM 0 HG2 PRO A 50 5.849 8.926 -5.258 1.00 1.00 H new ATOM 0 HG3 PRO A 50 6.992 7.859 -4.466 1.00 1.00 H new ATOM 0 HD2 PRO A 50 4.819 8.892 -3.161 1.00 1.00 H new ATOM 0 HD3 PRO A 50 6.306 8.496 -2.323 1.00 1.00 H new ATOM 814 N LYS A 51 5.033 11.752 -5.074 1.00 1.00 N ATOM 815 CA LYS A 51 4.227 12.535 -6.001 1.00 1.00 C ATOM 816 C LYS A 51 3.026 13.143 -5.281 1.00 1.00 C ATOM 817 O LYS A 51 1.911 12.632 -5.369 1.00 1.00 O ATOM 818 CB LYS A 51 3.748 11.666 -7.175 1.00 1.00 C ATOM 819 CG LYS A 51 4.463 11.961 -8.487 1.00 1.00 C ATOM 820 CD LYS A 51 3.619 11.523 -9.682 1.00 1.00 C ATOM 821 CE LYS A 51 2.529 12.537 -9.996 1.00 1.00 C ATOM 822 NZ LYS A 51 2.192 12.549 -11.439 1.00 1.00 N ATOM 0 H LYS A 51 4.527 11.000 -4.606 1.00 1.00 H new ATOM 0 HA LYS A 51 4.849 13.339 -6.394 1.00 1.00 H new ATOM 0 HB2 LYS A 51 3.893 10.616 -6.921 1.00 1.00 H new ATOM 0 HB3 LYS A 51 2.677 11.816 -7.313 1.00 1.00 H new ATOM 0 HG2 LYS A 51 4.674 13.028 -8.558 1.00 1.00 H new ATOM 0 HG3 LYS A 51 5.423 11.444 -8.506 1.00 1.00 H new ATOM 0 HD2 LYS A 51 4.260 11.395 -10.554 1.00 1.00 H new ATOM 0 HD3 LYS A 51 3.166 10.554 -9.473 1.00 1.00 H new ATOM 0 HE2 LYS A 51 1.636 12.304 -9.416 1.00 1.00 H new ATOM 0 HE3 LYS A 51 2.857 13.531 -9.690 1.00 1.00 H new ATOM 0 HZ1 LYS A 51 1.446 13.252 -11.615 1.00 1.00 H new ATOM 0 HZ2 LYS A 51 3.038 12.796 -11.991 1.00 1.00 H new ATOM 0 HZ3 LYS A 51 1.855 11.607 -11.725 1.00 1.00 H new ATOM 836 N ARG A 52 3.269 14.229 -4.558 1.00 1.00 N ATOM 837 CA ARG A 52 2.224 14.907 -3.818 1.00 1.00 C ATOM 838 C ARG A 52 2.194 16.394 -4.175 1.00 1.00 C ATOM 839 O ARG A 52 3.190 16.947 -4.641 1.00 1.00 O ATOM 840 CB ARG A 52 2.445 14.736 -2.313 1.00 1.00 C ATOM 841 CG ARG A 52 2.728 16.039 -1.591 1.00 1.00 C ATOM 842 CD ARG A 52 3.091 15.803 -0.133 1.00 1.00 C ATOM 843 NE ARG A 52 4.527 15.714 0.050 1.00 1.00 N ATOM 844 CZ ARG A 52 5.349 16.751 -0.083 1.00 1.00 C ATOM 845 NH1 ARG A 52 4.868 17.956 -0.366 1.00 1.00 N ATOM 846 NH2 ARG A 52 6.655 16.584 0.069 1.00 1.00 N ATOM 0 H ARG A 52 4.190 14.658 -4.471 1.00 1.00 H new ATOM 0 HA ARG A 52 1.266 14.463 -4.089 1.00 1.00 H new ATOM 0 HB2 ARG A 52 1.562 14.271 -1.875 1.00 1.00 H new ATOM 0 HB3 ARG A 52 3.278 14.052 -2.152 1.00 1.00 H new ATOM 0 HG2 ARG A 52 3.544 16.562 -2.090 1.00 1.00 H new ATOM 0 HG3 ARG A 52 1.852 16.685 -1.649 1.00 1.00 H new ATOM 0 HD2 ARG A 52 2.695 16.615 0.477 1.00 1.00 H new ATOM 0 HD3 ARG A 52 2.621 14.883 0.216 1.00 1.00 H new ATOM 0 HE ARG A 52 4.928 14.808 0.294 1.00 1.00 H new ATOM 0 HH11 ARG A 52 3.864 18.090 -0.482 1.00 1.00 H new ATOM 0 HH12 ARG A 52 5.503 18.748 -0.467 1.00 1.00 H new ATOM 0 HH21 ARG A 52 7.029 15.661 0.288 1.00 1.00 H new ATOM 0 HH22 ARG A 52 7.286 17.379 -0.033 1.00 1.00 H new ATOM 860 N PRO A 53 1.043 17.049 -3.949 1.00 1.00 N ATOM 861 CA PRO A 53 -0.144 16.404 -3.392 1.00 1.00 C ATOM 862 C PRO A 53 -0.945 15.655 -4.451 1.00 1.00 C ATOM 863 O PRO A 53 -0.549 15.588 -5.613 1.00 1.00 O ATOM 864 CB PRO A 53 -0.947 17.583 -2.862 1.00 1.00 C ATOM 865 CG PRO A 53 -0.601 18.709 -3.771 1.00 1.00 C ATOM 866 CD PRO A 53 0.820 18.474 -4.222 1.00 1.00 C ATOM 0 HA PRO A 53 0.105 15.655 -2.640 1.00 1.00 H new ATOM 0 HB2 PRO A 53 -2.017 17.374 -2.879 1.00 1.00 H new ATOM 0 HB3 PRO A 53 -0.683 17.811 -1.829 1.00 1.00 H new ATOM 0 HG2 PRO A 53 -1.279 18.741 -4.624 1.00 1.00 H new ATOM 0 HG3 PRO A 53 -0.691 19.665 -3.256 1.00 1.00 H new ATOM 0 HD2 PRO A 53 0.947 18.703 -5.280 1.00 1.00 H new ATOM 0 HD3 PRO A 53 1.523 19.101 -3.673 1.00 1.00 H new ATOM 874 N LEU A 54 -2.095 15.110 -4.048 1.00 1.00 N ATOM 875 CA LEU A 54 -2.961 14.370 -4.951 1.00 1.00 C ATOM 876 C LEU A 54 -3.838 15.322 -5.760 1.00 1.00 C ATOM 877 O LEU A 54 -4.122 16.437 -5.328 1.00 1.00 O ATOM 878 CB LEU A 54 -3.834 13.393 -4.177 1.00 1.00 C ATOM 879 CG LEU A 54 -3.122 12.125 -3.705 1.00 1.00 C ATOM 880 CD1 LEU A 54 -3.337 11.923 -2.209 1.00 1.00 C ATOM 881 CD2 LEU A 54 -3.610 10.921 -4.489 1.00 1.00 C ATOM 0 H LEU A 54 -2.445 15.172 -3.092 1.00 1.00 H new ATOM 0 HA LEU A 54 -2.328 13.808 -5.638 1.00 1.00 H new ATOM 0 HB2 LEU A 54 -4.245 13.906 -3.307 1.00 1.00 H new ATOM 0 HB3 LEU A 54 -4.677 13.106 -4.805 1.00 1.00 H new ATOM 0 HG LEU A 54 -2.053 12.236 -3.884 1.00 1.00 H new ATOM 0 HD11 LEU A 54 -2.824 11.017 -1.887 1.00 1.00 H new ATOM 0 HD12 LEU A 54 -2.937 12.779 -1.665 1.00 1.00 H new ATOM 0 HD13 LEU A 54 -4.403 11.829 -2.004 1.00 1.00 H new ATOM 0 HD21 LEU A 54 -3.093 10.026 -4.141 1.00 1.00 H new ATOM 0 HD22 LEU A 54 -4.683 10.801 -4.341 1.00 1.00 H new ATOM 0 HD23 LEU A 54 -3.404 11.069 -5.549 1.00 1.00 H new ATOM 893 N PRO A 55 -4.292 14.891 -6.948 1.00 1.00 N ATOM 894 CA PRO A 55 -5.148 15.701 -7.819 1.00 1.00 C ATOM 895 C PRO A 55 -6.445 16.119 -7.124 1.00 1.00 C ATOM 896 O PRO A 55 -6.728 17.309 -6.963 1.00 1.00 O ATOM 897 CB PRO A 55 -5.459 14.777 -8.999 1.00 1.00 C ATOM 898 CG PRO A 55 -4.397 13.730 -8.960 1.00 1.00 C ATOM 899 CD PRO A 55 -4.009 13.568 -7.522 1.00 1.00 C ATOM 0 HA PRO A 55 -4.657 16.629 -8.111 1.00 1.00 H new ATOM 0 HB2 PRO A 55 -6.451 14.336 -8.904 1.00 1.00 H new ATOM 0 HB3 PRO A 55 -5.441 15.322 -9.943 1.00 1.00 H new ATOM 0 HG2 PRO A 55 -4.765 12.790 -9.371 1.00 1.00 H new ATOM 0 HG3 PRO A 55 -3.538 14.027 -9.562 1.00 1.00 H new ATOM 0 HD2 PRO A 55 -4.589 12.785 -7.034 1.00 1.00 H new ATOM 0 HD3 PRO A 55 -2.958 13.299 -7.416 1.00 1.00 H new ATOM 907 N GLU A 56 -7.222 15.128 -6.708 1.00 1.00 N ATOM 908 CA GLU A 56 -8.484 15.368 -6.016 1.00 1.00 C ATOM 909 C GLU A 56 -9.122 14.039 -5.625 1.00 1.00 C ATOM 910 O GLU A 56 -10.099 13.607 -6.241 1.00 1.00 O ATOM 911 CB GLU A 56 -9.436 16.172 -6.911 1.00 1.00 C ATOM 912 CG GLU A 56 -10.472 16.968 -6.140 1.00 1.00 C ATOM 913 CD GLU A 56 -11.061 18.089 -6.970 1.00 1.00 C ATOM 914 OE1 GLU A 56 -10.316 18.686 -7.776 1.00 1.00 O ATOM 915 OE2 GLU A 56 -12.266 18.378 -6.809 1.00 1.00 O ATOM 0 H GLU A 56 -6.999 14.141 -6.839 1.00 1.00 H new ATOM 0 HA GLU A 56 -8.288 15.945 -5.112 1.00 1.00 H new ATOM 0 HB2 GLU A 56 -8.851 16.855 -7.527 1.00 1.00 H new ATOM 0 HB3 GLU A 56 -9.947 15.488 -7.589 1.00 1.00 H new ATOM 0 HG2 GLU A 56 -11.270 16.302 -5.812 1.00 1.00 H new ATOM 0 HG3 GLU A 56 -10.015 17.384 -5.242 1.00 1.00 H new ATOM 922 N ARG A 57 -8.560 13.381 -4.623 1.00 1.00 N ATOM 923 CA ARG A 57 -9.069 12.106 -4.165 1.00 1.00 C ATOM 924 C ARG A 57 -9.431 12.176 -2.689 1.00 1.00 C ATOM 925 O ARG A 57 -8.863 12.969 -1.940 1.00 1.00 O ATOM 926 CB ARG A 57 -8.033 10.997 -4.382 1.00 1.00 C ATOM 927 CG ARG A 57 -8.620 9.678 -4.869 1.00 1.00 C ATOM 928 CD ARG A 57 -9.397 9.859 -6.164 1.00 1.00 C ATOM 929 NE ARG A 57 -8.690 10.735 -7.104 1.00 1.00 N ATOM 930 CZ ARG A 57 -9.278 11.410 -8.090 1.00 1.00 C ATOM 931 NH1 ARG A 57 -10.591 11.335 -8.265 1.00 1.00 N ATOM 932 NH2 ARG A 57 -8.550 12.168 -8.900 1.00 1.00 N ATOM 0 H ARG A 57 -7.744 13.716 -4.110 1.00 1.00 H new ATOM 0 HA ARG A 57 -9.963 11.876 -4.745 1.00 1.00 H new ATOM 0 HB2 ARG A 57 -7.295 11.342 -5.106 1.00 1.00 H new ATOM 0 HB3 ARG A 57 -7.504 10.822 -3.445 1.00 1.00 H new ATOM 0 HG2 ARG A 57 -7.818 8.956 -5.022 1.00 1.00 H new ATOM 0 HG3 ARG A 57 -9.277 9.266 -4.103 1.00 1.00 H new ATOM 0 HD2 ARG A 57 -9.563 8.887 -6.628 1.00 1.00 H new ATOM 0 HD3 ARG A 57 -10.379 10.279 -5.944 1.00 1.00 H new ATOM 0 HE ARG A 57 -7.681 10.834 -6.995 1.00 1.00 H new ATOM 0 HH11 ARG A 57 -11.156 10.758 -7.642 1.00 1.00 H new ATOM 0 HH12 ARG A 57 -11.035 11.855 -9.022 1.00 1.00 H new ATOM 0 HH21 ARG A 57 -7.541 12.233 -8.767 1.00 1.00 H new ATOM 0 HH22 ARG A 57 -9.000 12.685 -9.655 1.00 1.00 H new ATOM 946 N THR A 58 -10.383 11.345 -2.266 1.00 1.00 N ATOM 947 CA THR A 58 -10.803 11.330 -0.867 1.00 1.00 C ATOM 948 C THR A 58 -9.697 10.766 0.008 1.00 1.00 C ATOM 949 O THR A 58 -9.741 9.609 0.417 1.00 1.00 O ATOM 950 CB THR A 58 -12.074 10.501 -0.709 1.00 1.00 C ATOM 951 OG1 THR A 58 -11.950 9.271 -1.406 1.00 1.00 O ATOM 952 CG2 THR A 58 -13.312 11.219 -1.221 1.00 1.00 C ATOM 0 H THR A 58 -10.873 10.681 -2.865 1.00 1.00 H new ATOM 0 HA THR A 58 -11.010 12.353 -0.552 1.00 1.00 H new ATOM 0 HB THR A 58 -12.196 10.330 0.361 1.00 1.00 H new ATOM 0 HG1 THR A 58 -12.841 8.897 -1.571 1.00 1.00 H new ATOM 0 HG21 THR A 58 -14.185 10.582 -1.083 1.00 1.00 H new ATOM 0 HG22 THR A 58 -13.449 12.148 -0.667 1.00 1.00 H new ATOM 0 HG23 THR A 58 -13.190 11.443 -2.281 1.00 1.00 H new ATOM 960 N ASN A 59 -8.704 11.595 0.306 1.00 1.00 N ATOM 961 CA ASN A 59 -7.582 11.185 1.135 1.00 1.00 C ATOM 962 C ASN A 59 -7.733 11.734 2.554 1.00 1.00 C ATOM 963 O ASN A 59 -8.198 12.860 2.741 1.00 1.00 O ATOM 964 CB ASN A 59 -6.268 11.671 0.516 1.00 1.00 C ATOM 965 CG ASN A 59 -5.497 10.551 -0.143 1.00 1.00 C ATOM 966 OD1 ASN A 59 -4.390 10.220 0.279 1.00 1.00 O ATOM 967 ND2 ASN A 59 -6.069 9.957 -1.183 1.00 1.00 N ATOM 0 H ASN A 59 -8.655 12.561 -0.018 1.00 1.00 H new ATOM 0 HA ASN A 59 -7.568 10.096 1.187 1.00 1.00 H new ATOM 0 HB2 ASN A 59 -6.480 12.446 -0.221 1.00 1.00 H new ATOM 0 HB3 ASN A 59 -5.651 12.128 1.290 1.00 1.00 H new ATOM 0 HD21 ASN A 59 -5.589 9.196 -1.663 1.00 1.00 H new ATOM 0 HD22 ASN A 59 -6.989 10.262 -1.502 1.00 1.00 H new ATOM 974 N VAL A 60 -7.363 10.941 3.551 1.00 1.00 N ATOM 975 CA VAL A 60 -7.480 11.380 4.939 1.00 1.00 C ATOM 976 C VAL A 60 -6.132 11.334 5.657 1.00 1.00 C ATOM 977 O VAL A 60 -5.448 10.307 5.625 1.00 1.00 O ATOM 978 CB VAL A 60 -8.484 10.498 5.700 1.00 1.00 C ATOM 979 CG1 VAL A 60 -8.693 11.007 7.119 1.00 1.00 C ATOM 980 CG2 VAL A 60 -9.806 10.442 4.950 1.00 1.00 C ATOM 0 H VAL A 60 -6.984 10.002 3.430 1.00 1.00 H new ATOM 0 HA VAL A 60 -7.833 12.411 4.923 1.00 1.00 H new ATOM 0 HB VAL A 60 -8.075 9.490 5.764 1.00 1.00 H new ATOM 0 HG11 VAL A 60 -9.407 10.365 7.634 1.00 1.00 H new ATOM 0 HG12 VAL A 60 -7.743 10.995 7.653 1.00 1.00 H new ATOM 0 HG13 VAL A 60 -9.078 12.026 7.087 1.00 1.00 H new ATOM 0 HG21 VAL A 60 -10.509 9.815 5.498 1.00 1.00 H new ATOM 0 HG22 VAL A 60 -10.214 11.448 4.856 1.00 1.00 H new ATOM 0 HG23 VAL A 60 -9.644 10.023 3.957 1.00 1.00 H new ATOM 990 N VAL A 61 -5.758 12.429 6.305 1.00 1.00 N ATOM 991 CA VAL A 61 -4.490 12.466 7.032 1.00 1.00 C ATOM 992 C VAL A 61 -4.672 11.921 8.448 1.00 1.00 C ATOM 993 O VAL A 61 -5.580 12.329 9.153 1.00 1.00 O ATOM 994 CB VAL A 61 -3.899 13.890 7.109 1.00 1.00 C ATOM 995 CG1 VAL A 61 -3.352 14.177 8.500 1.00 1.00 C ATOM 996 CG2 VAL A 61 -2.793 14.064 6.069 1.00 1.00 C ATOM 0 H VAL A 61 -6.302 13.291 6.345 1.00 1.00 H new ATOM 0 HA VAL A 61 -3.791 11.840 6.477 1.00 1.00 H new ATOM 0 HB VAL A 61 -4.700 14.599 6.899 1.00 1.00 H new ATOM 0 HG11 VAL A 61 -2.941 15.186 8.528 1.00 1.00 H new ATOM 0 HG12 VAL A 61 -4.155 14.091 9.232 1.00 1.00 H new ATOM 0 HG13 VAL A 61 -2.567 13.459 8.738 1.00 1.00 H new ATOM 0 HG21 VAL A 61 -2.386 15.073 6.136 1.00 1.00 H new ATOM 0 HG22 VAL A 61 -2.000 13.340 6.257 1.00 1.00 H new ATOM 0 HG23 VAL A 61 -3.203 13.903 5.072 1.00 1.00 H new ATOM 1006 N LEU A 62 -3.819 10.997 8.867 1.00 1.00 N ATOM 1007 CA LEU A 62 -3.936 10.441 10.214 1.00 1.00 C ATOM 1008 C LEU A 62 -2.914 11.087 11.132 1.00 1.00 C ATOM 1009 O LEU A 62 -1.716 11.061 10.860 1.00 1.00 O ATOM 1010 CB LEU A 62 -3.745 8.934 10.183 1.00 1.00 C ATOM 1011 CG LEU A 62 -4.919 8.122 10.712 1.00 1.00 C ATOM 1012 CD1 LEU A 62 -4.922 6.742 10.084 1.00 1.00 C ATOM 1013 CD2 LEU A 62 -4.846 8.014 12.239 1.00 1.00 C ATOM 0 H LEU A 62 -3.052 10.620 8.310 1.00 1.00 H new ATOM 0 HA LEU A 62 -4.934 10.652 10.597 1.00 1.00 H new ATOM 0 HB2 LEU A 62 -3.547 8.630 9.155 1.00 1.00 H new ATOM 0 HB3 LEU A 62 -2.859 8.684 10.766 1.00 1.00 H new ATOM 0 HG LEU A 62 -5.846 8.630 10.446 1.00 1.00 H new ATOM 0 HD11 LEU A 62 -5.766 6.169 10.469 1.00 1.00 H new ATOM 0 HD12 LEU A 62 -5.010 6.835 9.002 1.00 1.00 H new ATOM 0 HD13 LEU A 62 -3.992 6.229 10.329 1.00 1.00 H new ATOM 0 HD21 LEU A 62 -5.692 7.431 12.603 1.00 1.00 H new ATOM 0 HD22 LEU A 62 -3.916 7.522 12.525 1.00 1.00 H new ATOM 0 HD23 LEU A 62 -4.878 9.012 12.676 1.00 1.00 H new ATOM 1025 N THR A 63 -3.399 11.669 12.220 1.00 1.00 N ATOM 1026 CA THR A 63 -2.514 12.331 13.170 1.00 1.00 C ATOM 1027 C THR A 63 -2.855 11.958 14.600 1.00 1.00 C ATOM 1028 O THR A 63 -3.960 11.501 14.884 1.00 1.00 O ATOM 1029 CB THR A 63 -2.591 13.852 12.978 1.00 1.00 C ATOM 1030 OG1 THR A 63 -3.724 14.398 13.630 1.00 1.00 O ATOM 1031 CG2 THR A 63 -2.652 14.279 11.521 1.00 1.00 C ATOM 0 H THR A 63 -4.389 11.697 12.466 1.00 1.00 H new ATOM 0 HA THR A 63 -1.495 11.995 12.978 1.00 1.00 H new ATOM 0 HB THR A 63 -1.667 14.231 13.415 1.00 1.00 H new ATOM 0 HG1 THR A 63 -3.439 14.874 14.438 1.00 1.00 H new ATOM 0 HG21 THR A 63 -2.705 15.366 11.462 1.00 1.00 H new ATOM 0 HG22 THR A 63 -1.759 13.931 11.002 1.00 1.00 H new ATOM 0 HG23 THR A 63 -3.536 13.847 11.052 1.00 1.00 H new ATOM 1039 N HIS A 64 -1.888 12.150 15.490 1.00 1.00 N ATOM 1040 CA HIS A 64 -2.068 11.843 16.900 1.00 1.00 C ATOM 1041 C HIS A 64 -3.105 12.754 17.528 1.00 1.00 C ATOM 1042 O HIS A 64 -3.921 12.311 18.342 1.00 1.00 O ATOM 1043 CB HIS A 64 -0.736 11.988 17.648 1.00 1.00 C ATOM 1044 CG HIS A 64 0.055 10.719 17.734 1.00 1.00 C ATOM 1045 ND1 HIS A 64 -0.064 9.548 17.065 1.00 1.00 N flip ATOM 1046 CD2 HIS A 64 1.115 10.556 18.602 1.00 1.00 C flip ATOM 1047 CE1 HIS A 64 0.915 8.708 17.536 1.00 1.00 C flip ATOM 1048 NE2 HIS A 64 1.613 9.339 18.461 1.00 1.00 N flip ATOM 0 H HIS A 64 -0.967 12.519 15.256 1.00 1.00 H new ATOM 0 HA HIS A 64 -2.418 10.814 16.977 1.00 1.00 H new ATOM 0 HB2 HIS A 64 -0.133 12.747 17.151 1.00 1.00 H new ATOM 0 HB3 HIS A 64 -0.935 12.349 18.657 1.00 1.00 H new ATOM 0 HD2 HIS A 64 1.481 11.305 19.289 1.00 1.00 H new ATOM 0 HE1 HIS A 64 1.086 7.695 17.203 1.00 1.00 H new ATOM 0 HE2 HIS A 64 2.403 8.954 18.979 1.00 1.00 H new ATOM 1057 N GLN A 65 -3.059 14.034 17.172 1.00 1.00 N ATOM 1058 CA GLN A 65 -3.993 15.010 17.720 1.00 1.00 C ATOM 1059 C GLN A 65 -5.072 15.402 16.703 1.00 1.00 C ATOM 1060 O GLN A 65 -4.774 15.771 15.563 1.00 1.00 O ATOM 1061 CB GLN A 65 -3.230 16.261 18.164 1.00 1.00 C ATOM 1062 CG GLN A 65 -3.607 16.741 19.560 1.00 1.00 C ATOM 1063 CD GLN A 65 -3.183 15.784 20.657 1.00 1.00 C ATOM 1064 OE1 GLN A 65 -3.997 15.370 21.481 1.00 1.00 O ATOM 1065 NE2 GLN A 65 -1.906 15.417 20.666 1.00 1.00 N ATOM 0 H GLN A 65 -2.387 14.418 16.508 1.00 1.00 H new ATOM 0 HA GLN A 65 -4.490 14.550 18.574 1.00 1.00 H new ATOM 0 HB2 GLN A 65 -2.160 16.053 18.137 1.00 1.00 H new ATOM 0 HB3 GLN A 65 -3.417 17.063 17.450 1.00 1.00 H new ATOM 0 HG2 GLN A 65 -3.149 17.714 19.739 1.00 1.00 H new ATOM 0 HG3 GLN A 65 -4.687 16.884 19.609 1.00 1.00 H new ATOM 0 HE21 GLN A 65 -1.265 15.785 19.963 1.00 1.00 H new ATOM 0 HE22 GLN A 65 -1.567 14.767 21.376 1.00 1.00 H new ATOM 1074 N GLU A 66 -6.323 15.340 17.158 1.00 1.00 N ATOM 1075 CA GLU A 66 -7.494 15.699 16.349 1.00 1.00 C ATOM 1076 C GLU A 66 -7.479 17.186 16.031 1.00 1.00 C ATOM 1077 O GLU A 66 -7.910 17.612 14.966 1.00 1.00 O ATOM 1078 CB GLU A 66 -8.786 15.343 17.084 1.00 1.00 C ATOM 1079 CG GLU A 66 -8.975 16.092 18.389 1.00 1.00 C ATOM 1080 CD GLU A 66 -10.310 15.796 19.046 1.00 1.00 C ATOM 1081 OE1 GLU A 66 -11.351 16.114 18.435 1.00 1.00 O ATOM 1082 OE2 GLU A 66 -10.317 15.237 20.164 1.00 1.00 O ATOM 0 H GLU A 66 -6.557 15.038 18.104 1.00 1.00 H new ATOM 0 HA GLU A 66 -7.451 15.133 15.418 1.00 1.00 H new ATOM 0 HB2 GLU A 66 -9.633 15.551 16.431 1.00 1.00 H new ATOM 0 HB3 GLU A 66 -8.794 14.272 17.286 1.00 1.00 H new ATOM 0 HG2 GLU A 66 -8.170 15.827 19.075 1.00 1.00 H new ATOM 0 HG3 GLU A 66 -8.896 17.163 18.203 1.00 1.00 H new ATOM 1089 N ASP A 67 -6.994 17.972 16.985 1.00 1.00 N ATOM 1090 CA ASP A 67 -6.931 19.423 16.859 1.00 1.00 C ATOM 1091 C ASP A 67 -5.986 19.848 15.747 1.00 1.00 C ATOM 1092 O ASP A 67 -6.205 20.868 15.105 1.00 1.00 O ATOM 1093 CB ASP A 67 -6.469 20.047 18.178 1.00 1.00 C ATOM 1094 CG ASP A 67 -6.902 21.496 18.315 1.00 1.00 C ATOM 1095 OD1 ASP A 67 -7.411 22.057 17.321 1.00 1.00 O ATOM 1096 OD2 ASP A 67 -6.722 22.072 19.408 1.00 1.00 O ATOM 0 H ASP A 67 -6.632 17.619 17.871 1.00 1.00 H new ATOM 0 HA ASP A 67 -7.933 19.774 16.612 1.00 1.00 H new ATOM 0 HB2 ASP A 67 -6.871 19.470 19.011 1.00 1.00 H new ATOM 0 HB3 ASP A 67 -5.383 19.987 18.244 1.00 1.00 H new ATOM 1101 N TYR A 68 -4.922 19.090 15.534 1.00 1.00 N ATOM 1102 CA TYR A 68 -3.953 19.438 14.510 1.00 1.00 C ATOM 1103 C TYR A 68 -4.609 19.433 13.125 1.00 1.00 C ATOM 1104 O TYR A 68 -5.415 18.567 12.809 1.00 1.00 O ATOM 1105 CB TYR A 68 -2.780 18.459 14.542 1.00 1.00 C ATOM 1106 CG TYR A 68 -1.429 19.127 14.528 1.00 1.00 C ATOM 1107 CD1 TYR A 68 -0.905 19.654 13.352 1.00 1.00 C ATOM 1108 CD2 TYR A 68 -0.674 19.236 15.691 1.00 1.00 C ATOM 1109 CE1 TYR A 68 0.332 20.268 13.335 1.00 1.00 C ATOM 1110 CE2 TYR A 68 0.564 19.850 15.682 1.00 1.00 C ATOM 1111 CZ TYR A 68 1.063 20.364 14.502 1.00 1.00 C ATOM 1112 OH TYR A 68 2.298 20.974 14.486 1.00 1.00 O ATOM 0 H TYR A 68 -4.709 18.237 16.052 1.00 1.00 H new ATOM 0 HA TYR A 68 -3.580 20.442 14.712 1.00 1.00 H new ATOM 0 HB2 TYR A 68 -2.860 17.840 15.436 1.00 1.00 H new ATOM 0 HB3 TYR A 68 -2.853 17.791 13.684 1.00 1.00 H new ATOM 0 HD1 TYR A 68 -1.475 19.582 12.437 1.00 1.00 H new ATOM 0 HD2 TYR A 68 -1.061 18.834 16.616 1.00 1.00 H new ATOM 0 HE1 TYR A 68 0.725 20.671 12.413 1.00 1.00 H new ATOM 0 HE2 TYR A 68 1.138 19.927 16.593 1.00 1.00 H new ATOM 0 HH TYR A 68 2.681 20.960 15.388 1.00 1.00 H new ATOM 1122 N GLN A 69 -4.277 20.451 12.317 1.00 1.00 N ATOM 1123 CA GLN A 69 -4.860 20.604 10.988 1.00 1.00 C ATOM 1124 C GLN A 69 -3.899 20.167 9.891 1.00 1.00 C ATOM 1125 O GLN A 69 -2.719 20.486 9.911 1.00 1.00 O ATOM 1126 CB GLN A 69 -5.278 22.060 10.756 1.00 1.00 C ATOM 1127 CG GLN A 69 -4.114 23.039 10.710 1.00 1.00 C ATOM 1128 CD GLN A 69 -4.566 24.482 10.861 1.00 1.00 C ATOM 1129 OE1 GLN A 69 -4.290 25.319 10.003 1.00 1.00 O ATOM 1130 NE2 GLN A 69 -5.247 24.780 11.961 1.00 1.00 N ATOM 0 H GLN A 69 -3.607 21.178 12.567 1.00 1.00 H new ATOM 0 HA GLN A 69 -5.737 19.958 10.943 1.00 1.00 H new ATOM 0 HB2 GLN A 69 -5.830 22.124 9.818 1.00 1.00 H new ATOM 0 HB3 GLN A 69 -5.962 22.362 11.549 1.00 1.00 H new ATOM 0 HG2 GLN A 69 -3.408 22.797 11.504 1.00 1.00 H new ATOM 0 HG3 GLN A 69 -3.583 22.924 9.765 1.00 1.00 H new ATOM 0 HE21 GLN A 69 -5.453 24.053 12.646 1.00 1.00 H new ATOM 0 HE22 GLN A 69 -5.564 25.736 12.121 1.00 1.00 H new ATOM 1139 N ALA A 70 -4.434 19.425 8.927 1.00 1.00 N ATOM 1140 CA ALA A 70 -3.657 18.938 7.809 1.00 1.00 C ATOM 1141 C ALA A 70 -4.321 19.334 6.490 1.00 1.00 C ATOM 1142 O ALA A 70 -5.534 19.476 6.397 1.00 1.00 O ATOM 1143 CB ALA A 70 -3.484 17.429 7.889 1.00 1.00 C ATOM 0 H ALA A 70 -5.416 19.149 8.905 1.00 1.00 H new ATOM 0 HA ALA A 70 -2.668 19.395 7.852 1.00 1.00 H new ATOM 0 HB1 ALA A 70 -2.896 17.085 7.038 1.00 1.00 H new ATOM 0 HB2 ALA A 70 -2.969 17.170 8.814 1.00 1.00 H new ATOM 0 HB3 ALA A 70 -4.463 16.949 7.872 1.00 1.00 H new ATOM 1149 N GLN A 71 -3.489 19.546 5.476 1.00 1.00 N ATOM 1150 CA GLN A 71 -3.971 19.965 4.174 1.00 1.00 C ATOM 1151 C GLN A 71 -3.979 18.822 3.167 1.00 1.00 C ATOM 1152 O GLN A 71 -3.027 18.059 3.075 1.00 1.00 O ATOM 1153 CB GLN A 71 -3.114 21.118 3.640 1.00 1.00 C ATOM 1154 CG GLN A 71 -3.437 22.446 4.306 1.00 1.00 C ATOM 1155 CD GLN A 71 -2.806 22.583 5.685 1.00 1.00 C ATOM 1156 OE1 GLN A 71 -3.466 22.399 6.708 1.00 1.00 O ATOM 1157 NE2 GLN A 71 -1.524 22.931 5.714 1.00 1.00 N ATOM 0 H GLN A 71 -2.477 19.433 5.535 1.00 1.00 H new ATOM 0 HA GLN A 71 -5.001 20.298 4.304 1.00 1.00 H new ATOM 0 HB2 GLN A 71 -2.061 20.885 3.796 1.00 1.00 H new ATOM 0 HB3 GLN A 71 -3.265 21.209 2.564 1.00 1.00 H new ATOM 0 HG2 GLN A 71 -3.090 23.260 3.670 1.00 1.00 H new ATOM 0 HG3 GLN A 71 -4.518 22.550 4.394 1.00 1.00 H new ATOM 0 HE21 GLN A 71 -1.014 23.073 4.842 1.00 1.00 H new ATOM 0 HE22 GLN A 71 -1.049 23.056 6.608 1.00 1.00 H new ATOM 1166 N GLY A 72 -5.064 18.705 2.425 1.00 1.00 N ATOM 1167 CA GLY A 72 -5.168 17.663 1.425 1.00 1.00 C ATOM 1168 C GLY A 72 -5.839 16.409 1.948 1.00 1.00 C ATOM 1169 O GLY A 72 -6.330 15.598 1.172 1.00 1.00 O ATOM 0 H GLY A 72 -5.879 19.314 2.496 1.00 1.00 H new ATOM 0 HA2 GLY A 72 -5.730 18.041 0.571 1.00 1.00 H new ATOM 0 HA3 GLY A 72 -4.171 17.412 1.064 1.00 1.00 H new ATOM 1173 N ALA A 73 -5.861 16.244 3.273 1.00 1.00 N ATOM 1174 CA ALA A 73 -6.494 15.065 3.847 1.00 1.00 C ATOM 1175 C ALA A 73 -7.080 15.339 5.233 1.00 1.00 C ATOM 1176 O ALA A 73 -6.476 16.034 6.034 1.00 1.00 O ATOM 1177 CB ALA A 73 -5.483 13.936 3.889 1.00 1.00 C ATOM 0 H ALA A 73 -5.459 16.894 3.948 1.00 1.00 H new ATOM 0 HA ALA A 73 -7.335 14.779 3.215 1.00 1.00 H new ATOM 0 HB1 ALA A 73 -5.947 13.048 4.317 1.00 1.00 H new ATOM 0 HB2 ALA A 73 -5.142 13.715 2.878 1.00 1.00 H new ATOM 0 HB3 ALA A 73 -4.632 14.232 4.502 1.00 1.00 H new ATOM 1183 N VAL A 74 -8.247 14.760 5.529 1.00 1.00 N ATOM 1184 CA VAL A 74 -8.911 14.961 6.828 1.00 1.00 C ATOM 1185 C VAL A 74 -8.102 14.408 7.996 1.00 1.00 C ATOM 1186 O VAL A 74 -7.519 13.331 7.909 1.00 1.00 O ATOM 1187 CB VAL A 74 -10.319 14.320 6.849 1.00 1.00 C ATOM 1188 CG1 VAL A 74 -10.689 13.872 8.256 1.00 1.00 C ATOM 1189 CG2 VAL A 74 -11.362 15.291 6.315 1.00 1.00 C ATOM 0 H VAL A 74 -8.754 14.148 4.890 1.00 1.00 H new ATOM 0 HA VAL A 74 -8.995 16.041 6.949 1.00 1.00 H new ATOM 0 HB VAL A 74 -10.298 13.443 6.202 1.00 1.00 H new ATOM 0 HG11 VAL A 74 -11.683 13.425 8.246 1.00 1.00 H new ATOM 0 HG12 VAL A 74 -9.964 13.137 8.606 1.00 1.00 H new ATOM 0 HG13 VAL A 74 -10.686 14.733 8.925 1.00 1.00 H new ATOM 0 HG21 VAL A 74 -12.344 14.819 6.339 1.00 1.00 H new ATOM 0 HG22 VAL A 74 -11.375 16.188 6.934 1.00 1.00 H new ATOM 0 HG23 VAL A 74 -11.115 15.562 5.289 1.00 1.00 H new ATOM 1199 N VAL A 75 -8.039 15.159 9.091 1.00 1.00 N ATOM 1200 CA VAL A 75 -7.261 14.735 10.249 1.00 1.00 C ATOM 1201 C VAL A 75 -8.130 14.072 11.310 1.00 1.00 C ATOM 1202 O VAL A 75 -8.984 14.702 11.912 1.00 1.00 O ATOM 1203 CB VAL A 75 -6.536 15.939 10.876 1.00 1.00 C ATOM 1204 CG1 VAL A 75 -5.686 15.513 12.067 1.00 1.00 C ATOM 1205 CG2 VAL A 75 -5.661 16.635 9.841 1.00 1.00 C ATOM 0 H VAL A 75 -8.512 16.056 9.201 1.00 1.00 H new ATOM 0 HA VAL A 75 -6.535 14.003 9.894 1.00 1.00 H new ATOM 0 HB VAL A 75 -7.297 16.636 11.227 1.00 1.00 H new ATOM 0 HG11 VAL A 75 -5.187 16.385 12.488 1.00 1.00 H new ATOM 0 HG12 VAL A 75 -6.324 15.059 12.825 1.00 1.00 H new ATOM 0 HG13 VAL A 75 -4.939 14.790 11.741 1.00 1.00 H new ATOM 0 HG21 VAL A 75 -5.156 17.484 10.303 1.00 1.00 H new ATOM 0 HG22 VAL A 75 -4.918 15.933 9.462 1.00 1.00 H new ATOM 0 HG23 VAL A 75 -6.282 16.986 9.017 1.00 1.00 H new ATOM 1215 N VAL A 76 -7.865 12.784 11.537 1.00 1.00 N ATOM 1216 CA VAL A 76 -8.587 12.010 12.539 1.00 1.00 C ATOM 1217 C VAL A 76 -7.614 11.335 13.488 1.00 1.00 C ATOM 1218 O VAL A 76 -6.668 10.693 13.043 1.00 1.00 O ATOM 1219 CB VAL A 76 -9.471 10.925 11.877 1.00 1.00 C ATOM 1220 CG1 VAL A 76 -10.487 11.563 10.939 1.00 1.00 C ATOM 1221 CG2 VAL A 76 -8.611 9.914 11.125 1.00 1.00 C ATOM 0 H VAL A 76 -7.151 12.256 11.035 1.00 1.00 H new ATOM 0 HA VAL A 76 -9.224 12.702 13.090 1.00 1.00 H new ATOM 0 HB VAL A 76 -10.011 10.397 12.663 1.00 1.00 H new ATOM 0 HG11 VAL A 76 -11.099 10.785 10.483 1.00 1.00 H new ATOM 0 HG12 VAL A 76 -11.125 12.244 11.503 1.00 1.00 H new ATOM 0 HG13 VAL A 76 -9.965 12.117 10.159 1.00 1.00 H new ATOM 0 HG21 VAL A 76 -9.252 9.160 10.667 1.00 1.00 H new ATOM 0 HG22 VAL A 76 -8.042 10.426 10.349 1.00 1.00 H new ATOM 0 HG23 VAL A 76 -7.924 9.432 11.821 1.00 1.00 H new ATOM 1231 N HIS A 77 -7.836 11.468 14.798 1.00 1.00 N ATOM 1232 CA HIS A 77 -6.950 10.841 15.769 1.00 1.00 C ATOM 1233 C HIS A 77 -7.558 9.565 16.371 1.00 1.00 C ATOM 1234 O HIS A 77 -6.882 8.844 17.109 1.00 1.00 O ATOM 1235 CB HIS A 77 -6.568 11.818 16.882 1.00 1.00 C ATOM 1236 CG HIS A 77 -7.676 12.139 17.846 1.00 1.00 C ATOM 1237 ND1 HIS A 77 -9.004 11.846 17.614 1.00 1.00 N ATOM 1238 CD2 HIS A 77 -7.633 12.751 19.052 1.00 1.00 C ATOM 1239 CE1 HIS A 77 -9.729 12.264 18.635 1.00 1.00 C ATOM 1240 NE2 HIS A 77 -8.922 12.816 19.522 1.00 1.00 N ATOM 0 H HIS A 77 -8.610 11.996 15.201 1.00 1.00 H new ATOM 0 HA HIS A 77 -6.048 10.556 15.228 1.00 1.00 H new ATOM 0 HB2 HIS A 77 -5.729 11.402 17.440 1.00 1.00 H new ATOM 0 HB3 HIS A 77 -6.220 12.746 16.428 1.00 1.00 H new ATOM 0 HD2 HIS A 77 -6.750 13.120 19.552 1.00 1.00 H new ATOM 0 HE1 HIS A 77 -10.801 12.170 18.729 1.00 1.00 H new ATOM 0 HE2 HIS A 77 -9.209 13.224 20.412 1.00 1.00 H new ATOM 1249 N ASP A 78 -8.826 9.280 16.076 1.00 1.00 N ATOM 1250 CA ASP A 78 -9.472 8.085 16.620 1.00 1.00 C ATOM 1251 C ASP A 78 -9.491 6.953 15.601 1.00 1.00 C ATOM 1252 O ASP A 78 -10.234 6.996 14.632 1.00 1.00 O ATOM 1253 CB ASP A 78 -10.900 8.414 17.072 1.00 1.00 C ATOM 1254 CG ASP A 78 -11.655 9.258 16.063 1.00 1.00 C ATOM 1255 OD1 ASP A 78 -11.165 9.422 14.926 1.00 1.00 O ATOM 1256 OD2 ASP A 78 -12.745 9.757 16.415 1.00 1.00 O ATOM 0 H ASP A 78 -9.419 9.850 15.473 1.00 1.00 H new ATOM 0 HA ASP A 78 -8.892 7.753 17.481 1.00 1.00 H new ATOM 0 HB2 ASP A 78 -11.445 7.486 17.243 1.00 1.00 H new ATOM 0 HB3 ASP A 78 -10.862 8.942 18.025 1.00 1.00 H new ATOM 1261 N VAL A 79 -8.676 5.940 15.851 1.00 1.00 N ATOM 1262 CA VAL A 79 -8.600 4.781 14.971 1.00 1.00 C ATOM 1263 C VAL A 79 -9.921 4.031 14.908 1.00 1.00 C ATOM 1264 O VAL A 79 -10.362 3.595 13.839 1.00 1.00 O ATOM 1265 CB VAL A 79 -7.502 3.793 15.417 1.00 1.00 C ATOM 1266 CG1 VAL A 79 -6.139 4.460 15.330 1.00 1.00 C ATOM 1267 CG2 VAL A 79 -7.765 3.286 16.819 1.00 1.00 C ATOM 0 H VAL A 79 -8.055 5.896 16.659 1.00 1.00 H new ATOM 0 HA VAL A 79 -8.357 5.173 13.983 1.00 1.00 H new ATOM 0 HB VAL A 79 -7.515 2.933 14.747 1.00 1.00 H new ATOM 0 HG11 VAL A 79 -5.369 3.757 15.646 1.00 1.00 H new ATOM 0 HG12 VAL A 79 -5.949 4.767 14.302 1.00 1.00 H new ATOM 0 HG13 VAL A 79 -6.120 5.335 15.980 1.00 1.00 H new ATOM 0 HG21 VAL A 79 -6.976 2.591 17.109 1.00 1.00 H new ATOM 0 HG22 VAL A 79 -7.781 4.127 17.513 1.00 1.00 H new ATOM 0 HG23 VAL A 79 -8.727 2.774 16.846 1.00 1.00 H new ATOM 1277 N ALA A 80 -10.521 3.858 16.074 1.00 1.00 N ATOM 1278 CA ALA A 80 -11.779 3.132 16.189 1.00 1.00 C ATOM 1279 C ALA A 80 -12.903 3.834 15.430 1.00 1.00 C ATOM 1280 O ALA A 80 -13.739 3.173 14.822 1.00 1.00 O ATOM 1281 CB ALA A 80 -12.141 2.954 17.647 1.00 1.00 C ATOM 0 H ALA A 80 -10.157 4.211 16.959 1.00 1.00 H new ATOM 0 HA ALA A 80 -11.648 2.149 15.735 1.00 1.00 H new ATOM 0 HB1 ALA A 80 -13.083 2.410 17.724 1.00 1.00 H new ATOM 0 HB2 ALA A 80 -11.355 2.392 18.151 1.00 1.00 H new ATOM 0 HB3 ALA A 80 -12.247 3.931 18.118 1.00 1.00 H new ATOM 1287 N ALA A 81 -12.923 5.158 15.454 1.00 1.00 N ATOM 1288 CA ALA A 81 -13.971 5.907 14.753 1.00 1.00 C ATOM 1289 C ALA A 81 -13.886 5.667 13.253 1.00 1.00 C ATOM 1290 O ALA A 81 -14.912 5.556 12.575 1.00 1.00 O ATOM 1291 CB ALA A 81 -13.845 7.391 15.063 1.00 1.00 C ATOM 0 H ALA A 81 -12.238 5.735 15.942 1.00 1.00 H new ATOM 0 HA ALA A 81 -14.943 5.557 15.100 1.00 1.00 H new ATOM 0 HB1 ALA A 81 -14.627 7.940 14.538 1.00 1.00 H new ATOM 0 HB2 ALA A 81 -13.949 7.549 16.137 1.00 1.00 H new ATOM 0 HB3 ALA A 81 -12.869 7.749 14.736 1.00 1.00 H new ATOM 1297 N VAL A 82 -12.667 5.583 12.724 1.00 1.00 N ATOM 1298 CA VAL A 82 -12.459 5.351 11.302 1.00 1.00 C ATOM 1299 C VAL A 82 -13.025 3.992 10.915 1.00 1.00 C ATOM 1300 O VAL A 82 -13.703 3.852 9.897 1.00 1.00 O ATOM 1301 CB VAL A 82 -10.969 5.405 10.925 1.00 1.00 C ATOM 1302 CG1 VAL A 82 -10.774 5.178 9.429 1.00 1.00 C ATOM 1303 CG2 VAL A 82 -10.357 6.726 11.357 1.00 1.00 C ATOM 0 H VAL A 82 -11.807 5.673 13.264 1.00 1.00 H new ATOM 0 HA VAL A 82 -12.975 6.144 10.760 1.00 1.00 H new ATOM 0 HB VAL A 82 -10.456 4.601 11.453 1.00 1.00 H new ATOM 0 HG11 VAL A 82 -9.711 5.221 9.190 1.00 1.00 H new ATOM 0 HG12 VAL A 82 -11.168 4.199 9.155 1.00 1.00 H new ATOM 0 HG13 VAL A 82 -11.303 5.951 8.872 1.00 1.00 H new ATOM 0 HG21 VAL A 82 -9.302 6.746 11.082 1.00 1.00 H new ATOM 0 HG22 VAL A 82 -10.876 7.547 10.862 1.00 1.00 H new ATOM 0 HG23 VAL A 82 -10.452 6.835 12.437 1.00 1.00 H new ATOM 1313 N PHE A 83 -12.762 2.993 11.748 1.00 1.00 N ATOM 1314 CA PHE A 83 -13.251 1.636 11.521 1.00 1.00 C ATOM 1315 C PHE A 83 -14.773 1.601 11.515 1.00 1.00 C ATOM 1316 O PHE A 83 -15.386 0.985 10.652 1.00 1.00 O ATOM 1317 CB PHE A 83 -12.724 0.694 12.598 1.00 1.00 C ATOM 1318 CG PHE A 83 -11.426 0.033 12.222 1.00 1.00 C ATOM 1319 CD1 PHE A 83 -10.552 0.635 11.330 1.00 1.00 C ATOM 1320 CD2 PHE A 83 -11.085 -1.197 12.764 1.00 1.00 C ATOM 1321 CE1 PHE A 83 -9.360 0.024 10.989 1.00 1.00 C ATOM 1322 CE2 PHE A 83 -9.896 -1.813 12.425 1.00 1.00 C ATOM 1323 CZ PHE A 83 -9.032 -1.201 11.536 1.00 1.00 C ATOM 0 H PHE A 83 -12.206 3.098 12.597 1.00 1.00 H new ATOM 0 HA PHE A 83 -12.888 1.308 10.547 1.00 1.00 H new ATOM 0 HB2 PHE A 83 -12.585 1.252 13.524 1.00 1.00 H new ATOM 0 HB3 PHE A 83 -13.471 -0.074 12.798 1.00 1.00 H new ATOM 0 HD1 PHE A 83 -10.805 1.591 10.897 1.00 1.00 H new ATOM 0 HD2 PHE A 83 -11.757 -1.679 13.459 1.00 1.00 H new ATOM 0 HE1 PHE A 83 -8.686 0.504 10.295 1.00 1.00 H new ATOM 0 HE2 PHE A 83 -9.642 -2.771 12.854 1.00 1.00 H new ATOM 0 HZ PHE A 83 -8.102 -1.680 11.270 1.00 1.00 H new ATOM 1333 N ALA A 84 -15.373 2.256 12.509 1.00 1.00 N ATOM 1334 CA ALA A 84 -16.827 2.289 12.639 1.00 1.00 C ATOM 1335 C ALA A 84 -17.483 2.975 11.454 1.00 1.00 C ATOM 1336 O ALA A 84 -18.553 2.563 10.992 1.00 1.00 O ATOM 1337 CB ALA A 84 -17.204 2.975 13.939 1.00 1.00 C ATOM 0 H ALA A 84 -14.874 2.770 13.235 1.00 1.00 H new ATOM 0 HA ALA A 84 -17.194 1.263 12.654 1.00 1.00 H new ATOM 0 HB1 ALA A 84 -18.289 3.000 14.036 1.00 1.00 H new ATOM 0 HB2 ALA A 84 -16.777 2.425 14.778 1.00 1.00 H new ATOM 0 HB3 ALA A 84 -16.817 3.994 13.938 1.00 1.00 H new ATOM 1343 N TYR A 85 -16.848 4.035 10.960 1.00 1.00 N ATOM 1344 CA TYR A 85 -17.399 4.775 9.821 1.00 1.00 C ATOM 1345 C TYR A 85 -17.517 3.862 8.603 1.00 1.00 C ATOM 1346 O TYR A 85 -18.557 3.821 7.933 1.00 1.00 O ATOM 1347 CB TYR A 85 -16.495 5.977 9.497 1.00 1.00 C ATOM 1348 CG TYR A 85 -16.941 7.273 10.147 1.00 1.00 C ATOM 1349 CD1 TYR A 85 -18.170 7.848 9.849 1.00 1.00 C ATOM 1350 CD2 TYR A 85 -16.122 7.916 11.066 1.00 1.00 C ATOM 1351 CE1 TYR A 85 -18.571 9.027 10.448 1.00 1.00 C ATOM 1352 CE2 TYR A 85 -16.516 9.095 11.670 1.00 1.00 C ATOM 1353 CZ TYR A 85 -17.740 9.646 11.358 1.00 1.00 C ATOM 1354 OH TYR A 85 -18.121 10.825 11.943 1.00 1.00 O ATOM 0 H TYR A 85 -15.966 4.399 11.321 1.00 1.00 H new ATOM 0 HA TYR A 85 -18.394 5.136 10.081 1.00 1.00 H new ATOM 0 HB2 TYR A 85 -15.478 5.752 9.818 1.00 1.00 H new ATOM 0 HB3 TYR A 85 -16.464 6.115 8.416 1.00 1.00 H new ATOM 0 HD1 TYR A 85 -18.823 7.365 9.137 1.00 1.00 H new ATOM 0 HD2 TYR A 85 -15.162 7.488 11.313 1.00 1.00 H new ATOM 0 HE1 TYR A 85 -19.530 9.461 10.205 1.00 1.00 H new ATOM 0 HE2 TYR A 85 -15.868 9.582 12.383 1.00 1.00 H new ATOM 0 HH TYR A 85 -17.421 11.125 12.560 1.00 1.00 H new ATOM 1364 N ALA A 86 -16.462 3.112 8.326 1.00 1.00 N ATOM 1365 CA ALA A 86 -16.456 2.182 7.197 1.00 1.00 C ATOM 1366 C ALA A 86 -17.499 1.080 7.384 1.00 1.00 C ATOM 1367 O ALA A 86 -18.139 0.652 6.430 1.00 1.00 O ATOM 1368 CB ALA A 86 -15.067 1.565 7.021 1.00 1.00 C ATOM 0 H ALA A 86 -15.596 3.126 8.865 1.00 1.00 H new ATOM 0 HA ALA A 86 -16.711 2.745 6.299 1.00 1.00 H new ATOM 0 HB1 ALA A 86 -15.079 0.875 6.177 1.00 1.00 H new ATOM 0 HB2 ALA A 86 -14.339 2.355 6.834 1.00 1.00 H new ATOM 0 HB3 ALA A 86 -14.791 1.025 7.927 1.00 1.00 H new ATOM 1374 N LYS A 87 -17.657 0.636 8.624 1.00 1.00 N ATOM 1375 CA LYS A 87 -18.614 -0.419 8.958 1.00 1.00 C ATOM 1376 C LYS A 87 -20.041 0.030 8.625 1.00 1.00 C ATOM 1377 O LYS A 87 -20.850 -0.761 8.157 1.00 1.00 O ATOM 1378 CB LYS A 87 -18.499 -0.794 10.433 1.00 1.00 C ATOM 1379 CG LYS A 87 -19.444 -1.922 10.852 1.00 1.00 C ATOM 1380 CD LYS A 87 -20.197 -1.567 12.126 1.00 1.00 C ATOM 1381 CE LYS A 87 -19.533 -2.186 13.349 1.00 1.00 C ATOM 1382 NZ LYS A 87 -19.982 -3.584 13.580 1.00 1.00 N ATOM 0 H LYS A 87 -17.132 0.991 9.423 1.00 1.00 H new ATOM 0 HA LYS A 87 -18.383 -1.301 8.360 1.00 1.00 H new ATOM 0 HB2 LYS A 87 -17.473 -1.093 10.644 1.00 1.00 H new ATOM 0 HB3 LYS A 87 -18.706 0.087 11.041 1.00 1.00 H new ATOM 0 HG2 LYS A 87 -20.155 -2.121 10.050 1.00 1.00 H new ATOM 0 HG3 LYS A 87 -18.874 -2.838 11.007 1.00 1.00 H new ATOM 0 HD2 LYS A 87 -20.235 -0.484 12.239 1.00 1.00 H new ATOM 0 HD3 LYS A 87 -21.227 -1.916 12.052 1.00 1.00 H new ATOM 0 HE2 LYS A 87 -18.451 -2.170 13.221 1.00 1.00 H new ATOM 0 HE3 LYS A 87 -19.759 -1.583 14.228 1.00 1.00 H new ATOM 0 HZ1 LYS A 87 -19.506 -3.967 14.422 1.00 1.00 H new ATOM 0 HZ2 LYS A 87 -21.011 -3.598 13.728 1.00 1.00 H new ATOM 0 HZ3 LYS A 87 -19.743 -4.167 12.752 1.00 1.00 H new ATOM 1396 N GLN A 88 -20.310 1.304 8.881 1.00 1.00 N ATOM 1397 CA GLN A 88 -21.612 1.866 8.624 1.00 1.00 C ATOM 1398 C GLN A 88 -21.916 1.830 7.136 1.00 1.00 C ATOM 1399 O GLN A 88 -23.036 1.538 6.718 1.00 1.00 O ATOM 1400 CB GLN A 88 -21.692 3.316 9.139 1.00 1.00 C ATOM 1401 CG GLN A 88 -21.727 3.416 10.642 1.00 1.00 C ATOM 1402 CD GLN A 88 -22.996 2.840 11.233 1.00 1.00 C ATOM 1403 OE1 GLN A 88 -24.032 3.505 11.262 1.00 1.00 O ATOM 1404 NE2 GLN A 88 -22.926 1.604 11.712 1.00 1.00 N ATOM 0 H GLN A 88 -19.634 1.963 9.268 1.00 1.00 H new ATOM 0 HA GLN A 88 -22.352 1.267 9.154 1.00 1.00 H new ATOM 0 HB2 GLN A 88 -20.834 3.874 8.765 1.00 1.00 H new ATOM 0 HB3 GLN A 88 -22.584 3.790 8.730 1.00 1.00 H new ATOM 0 HG2 GLN A 88 -20.866 2.892 11.058 1.00 1.00 H new ATOM 0 HG3 GLN A 88 -21.636 4.462 10.935 1.00 1.00 H new ATOM 0 HE21 GLN A 88 -22.047 1.089 11.667 1.00 1.00 H new ATOM 0 HE22 GLN A 88 -23.751 1.169 12.125 1.00 1.00 H new ATOM 1413 N HIS A 89 -20.893 2.131 6.332 1.00 1.00 N ATOM 1414 CA HIS A 89 -21.030 2.137 4.882 1.00 1.00 C ATOM 1415 C HIS A 89 -20.373 0.916 4.266 1.00 1.00 C ATOM 1416 O HIS A 89 -19.225 0.978 3.828 1.00 1.00 O ATOM 1417 CB HIS A 89 -20.417 3.405 4.295 1.00 1.00 C ATOM 1418 CG HIS A 89 -21.107 4.662 4.735 1.00 1.00 C ATOM 1419 ND1 HIS A 89 -21.605 5.594 3.848 1.00 1.00 N ATOM 1420 CD2 HIS A 89 -21.402 5.126 5.971 1.00 1.00 C ATOM 1421 CE1 HIS A 89 -22.174 6.578 4.520 1.00 1.00 C ATOM 1422 NE2 HIS A 89 -22.065 6.318 5.810 1.00 1.00 N ATOM 0 H HIS A 89 -19.960 2.374 6.666 1.00 1.00 H new ATOM 0 HA HIS A 89 -22.094 2.112 4.647 1.00 1.00 H new ATOM 0 HB2 HIS A 89 -19.367 3.457 4.581 1.00 1.00 H new ATOM 0 HB3 HIS A 89 -20.448 3.344 3.207 1.00 1.00 H new ATOM 0 HD2 HIS A 89 -21.161 4.648 6.909 1.00 1.00 H new ATOM 0 HE1 HIS A 89 -22.648 7.447 4.088 1.00 1.00 H new ATOM 0 HE2 HIS A 89 -22.416 6.907 6.565 1.00 1.00 H new ATOM 1431 N PRO A 90 -21.077 -0.225 4.215 1.00 1.00 N ATOM 1432 CA PRO A 90 -20.523 -1.450 3.630 1.00 1.00 C ATOM 1433 C PRO A 90 -20.135 -1.253 2.167 1.00 1.00 C ATOM 1434 O PRO A 90 -19.195 -1.874 1.674 1.00 1.00 O ATOM 1435 CB PRO A 90 -21.654 -2.472 3.773 1.00 1.00 C ATOM 1436 CG PRO A 90 -22.886 -1.666 4.007 1.00 1.00 C ATOM 1437 CD PRO A 90 -22.442 -0.421 4.717 1.00 1.00 C ATOM 0 HA PRO A 90 -19.605 -1.766 4.126 1.00 1.00 H new ATOM 0 HB2 PRO A 90 -21.748 -3.082 2.875 1.00 1.00 H new ATOM 0 HB3 PRO A 90 -21.466 -3.153 4.603 1.00 1.00 H new ATOM 0 HG2 PRO A 90 -23.377 -1.423 3.065 1.00 1.00 H new ATOM 0 HG3 PRO A 90 -23.606 -2.221 4.608 1.00 1.00 H new ATOM 0 HD2 PRO A 90 -23.084 0.428 4.483 1.00 1.00 H new ATOM 0 HD3 PRO A 90 -22.460 -0.545 5.800 1.00 1.00 H new ATOM 1445 N ASP A 91 -20.860 -0.388 1.475 1.00 1.00 N ATOM 1446 CA ASP A 91 -20.571 -0.116 0.062 1.00 1.00 C ATOM 1447 C ASP A 91 -19.198 0.534 -0.085 1.00 1.00 C ATOM 1448 O ASP A 91 -18.481 0.299 -1.062 1.00 1.00 O ATOM 1449 CB ASP A 91 -21.637 0.797 -0.553 1.00 1.00 C ATOM 1450 CG ASP A 91 -21.708 0.647 -2.065 1.00 1.00 C ATOM 1451 OD1 ASP A 91 -20.796 1.143 -2.759 1.00 1.00 O ATOM 1452 OD2 ASP A 91 -22.685 0.038 -2.551 1.00 1.00 O ATOM 0 H ASP A 91 -21.647 0.137 1.857 1.00 1.00 H new ATOM 0 HA ASP A 91 -20.579 -1.069 -0.468 1.00 1.00 H new ATOM 0 HB2 ASP A 91 -22.609 0.564 -0.119 1.00 1.00 H new ATOM 0 HB3 ASP A 91 -21.416 1.834 -0.301 1.00 1.00 H new ATOM 1457 N GLN A 92 -18.844 1.355 0.900 1.00 1.00 N ATOM 1458 CA GLN A 92 -17.564 2.062 0.892 1.00 1.00 C ATOM 1459 C GLN A 92 -16.422 1.141 1.310 1.00 1.00 C ATOM 1460 O GLN A 92 -16.552 0.365 2.268 1.00 1.00 O ATOM 1461 CB GLN A 92 -17.598 3.271 1.840 1.00 1.00 C ATOM 1462 CG GLN A 92 -18.122 4.554 1.201 1.00 1.00 C ATOM 1463 CD GLN A 92 -18.543 5.584 2.225 1.00 1.00 C ATOM 1464 OE1 GLN A 92 -18.545 5.318 3.426 1.00 1.00 O ATOM 1465 NE2 GLN A 92 -18.900 6.770 1.754 1.00 1.00 N ATOM 0 H GLN A 92 -19.426 1.548 1.715 1.00 1.00 H new ATOM 0 HA GLN A 92 -17.394 2.404 -0.129 1.00 1.00 H new ATOM 0 HB2 GLN A 92 -18.221 3.026 2.700 1.00 1.00 H new ATOM 0 HB3 GLN A 92 -16.591 3.451 2.217 1.00 1.00 H new ATOM 0 HG2 GLN A 92 -17.349 4.979 0.561 1.00 1.00 H new ATOM 0 HG3 GLN A 92 -18.971 4.316 0.560 1.00 1.00 H new ATOM 0 HE21 GLN A 92 -18.883 6.946 0.749 1.00 1.00 H new ATOM 0 HE22 GLN A 92 -19.192 7.507 2.396 1.00 1.00 H new ATOM 1474 N GLU A 93 -15.317 1.230 0.579 1.00 1.00 N ATOM 1475 CA GLU A 93 -14.136 0.419 0.856 1.00 1.00 C ATOM 1476 C GLU A 93 -13.005 1.299 1.341 1.00 1.00 C ATOM 1477 O GLU A 93 -12.668 2.304 0.716 1.00 1.00 O ATOM 1478 CB GLU A 93 -13.709 -0.332 -0.404 1.00 1.00 C ATOM 1479 CG GLU A 93 -13.977 -1.830 -0.340 1.00 1.00 C ATOM 1480 CD GLU A 93 -12.893 -2.569 0.415 1.00 1.00 C ATOM 1481 OE1 GLU A 93 -12.967 -2.615 1.661 1.00 1.00 O ATOM 1482 OE2 GLU A 93 -11.967 -3.097 -0.236 1.00 1.00 O ATOM 0 H GLU A 93 -15.214 1.861 -0.216 1.00 1.00 H new ATOM 0 HA GLU A 93 -14.380 -0.305 1.634 1.00 1.00 H new ATOM 0 HB2 GLU A 93 -14.235 0.087 -1.262 1.00 1.00 H new ATOM 0 HB3 GLU A 93 -12.644 -0.168 -0.571 1.00 1.00 H new ATOM 0 HG2 GLU A 93 -14.939 -2.006 0.142 1.00 1.00 H new ATOM 0 HG3 GLU A 93 -14.050 -2.229 -1.352 1.00 1.00 H new ATOM 1489 N LEU A 94 -12.425 0.929 2.491 1.00 1.00 N ATOM 1490 CA LEU A 94 -11.346 1.708 3.063 1.00 1.00 C ATOM 1491 C LEU A 94 -9.987 1.028 2.890 1.00 1.00 C ATOM 1492 O LEU A 94 -9.799 -0.128 3.289 1.00 1.00 O ATOM 1493 CB LEU A 94 -11.627 1.948 4.550 1.00 1.00 C ATOM 1494 CG LEU A 94 -10.796 3.058 5.208 1.00 1.00 C ATOM 1495 CD1 LEU A 94 -11.427 4.424 4.955 1.00 1.00 C ATOM 1496 CD2 LEU A 94 -10.665 2.796 6.698 1.00 1.00 C ATOM 0 H LEU A 94 -12.689 0.104 3.029 1.00 1.00 H new ATOM 0 HA LEU A 94 -11.300 2.658 2.531 1.00 1.00 H new ATOM 0 HB2 LEU A 94 -12.683 2.190 4.668 1.00 1.00 H new ATOM 0 HB3 LEU A 94 -11.451 1.018 5.090 1.00 1.00 H new ATOM 0 HG LEU A 94 -9.800 3.059 4.765 1.00 1.00 H new ATOM 0 HD11 LEU A 94 -10.823 5.197 5.430 1.00 1.00 H new ATOM 0 HD12 LEU A 94 -11.476 4.609 3.882 1.00 1.00 H new ATOM 0 HD13 LEU A 94 -12.434 4.443 5.373 1.00 1.00 H new ATOM 0 HD21 LEU A 94 -10.074 3.589 7.156 1.00 1.00 H new ATOM 0 HD22 LEU A 94 -11.656 2.774 7.152 1.00 1.00 H new ATOM 0 HD23 LEU A 94 -10.171 1.837 6.857 1.00 1.00 H new ATOM 1508 N VAL A 95 -9.050 1.775 2.312 1.00 1.00 N ATOM 1509 CA VAL A 95 -7.697 1.288 2.091 1.00 1.00 C ATOM 1510 C VAL A 95 -6.682 2.207 2.769 1.00 1.00 C ATOM 1511 O VAL A 95 -6.745 3.426 2.608 1.00 1.00 O ATOM 1512 CB VAL A 95 -7.370 1.197 0.592 1.00 1.00 C ATOM 1513 CG1 VAL A 95 -6.183 0.280 0.356 1.00 1.00 C ATOM 1514 CG2 VAL A 95 -8.576 0.716 -0.201 1.00 1.00 C ATOM 0 H VAL A 95 -9.208 2.729 1.986 1.00 1.00 H new ATOM 0 HA VAL A 95 -7.637 0.289 2.523 1.00 1.00 H new ATOM 0 HB VAL A 95 -7.110 2.197 0.245 1.00 1.00 H new ATOM 0 HG11 VAL A 95 -5.969 0.230 -0.712 1.00 1.00 H new ATOM 0 HG12 VAL A 95 -5.312 0.669 0.883 1.00 1.00 H new ATOM 0 HG13 VAL A 95 -6.415 -0.718 0.727 1.00 1.00 H new ATOM 0 HG21 VAL A 95 -8.318 0.661 -1.258 1.00 1.00 H new ATOM 0 HG22 VAL A 95 -8.873 -0.271 0.152 1.00 1.00 H new ATOM 0 HG23 VAL A 95 -9.402 1.414 -0.066 1.00 1.00 H new ATOM 1524 N ILE A 96 -5.754 1.631 3.535 1.00 1.00 N ATOM 1525 CA ILE A 96 -4.755 2.450 4.217 1.00 1.00 C ATOM 1526 C ILE A 96 -3.364 2.266 3.615 1.00 1.00 C ATOM 1527 O ILE A 96 -2.849 1.148 3.513 1.00 1.00 O ATOM 1528 CB ILE A 96 -4.729 2.131 5.727 1.00 1.00 C ATOM 1529 CG1 ILE A 96 -5.129 3.358 6.537 1.00 1.00 C ATOM 1530 CG2 ILE A 96 -3.364 1.634 6.175 1.00 1.00 C ATOM 1531 CD1 ILE A 96 -5.574 3.040 7.951 1.00 1.00 C ATOM 0 H ILE A 96 -5.674 0.627 3.696 1.00 1.00 H new ATOM 0 HA ILE A 96 -5.042 3.493 4.079 1.00 1.00 H new ATOM 0 HB ILE A 96 -5.450 1.333 5.904 1.00 1.00 H new ATOM 0 HG12 ILE A 96 -4.284 4.046 6.578 1.00 1.00 H new ATOM 0 HG13 ILE A 96 -5.937 3.876 6.020 1.00 1.00 H new ATOM 0 HG21 ILE A 96 -3.387 1.421 7.244 1.00 1.00 H new ATOM 0 HG22 ILE A 96 -3.110 0.725 5.629 1.00 1.00 H new ATOM 0 HG23 ILE A 96 -2.614 2.399 5.974 1.00 1.00 H new ATOM 0 HD11 ILE A 96 -5.842 3.963 8.464 1.00 1.00 H new ATOM 0 HD12 ILE A 96 -6.439 2.377 7.920 1.00 1.00 H new ATOM 0 HD13 ILE A 96 -4.761 2.550 8.487 1.00 1.00 H new ATOM 1543 N ALA A 97 -2.749 3.375 3.235 1.00 1.00 N ATOM 1544 CA ALA A 97 -1.412 3.343 2.644 1.00 1.00 C ATOM 1545 C ALA A 97 -0.359 3.801 3.640 1.00 1.00 C ATOM 1546 O ALA A 97 0.295 4.832 3.460 1.00 1.00 O ATOM 1547 CB ALA A 97 -1.358 4.208 1.388 1.00 1.00 C ATOM 0 H ALA A 97 -3.150 4.309 3.323 1.00 1.00 H new ATOM 0 HA ALA A 97 -1.196 2.310 2.370 1.00 1.00 H new ATOM 0 HB1 ALA A 97 -0.355 4.171 0.963 1.00 1.00 H new ATOM 0 HB2 ALA A 97 -2.075 3.834 0.657 1.00 1.00 H new ATOM 0 HB3 ALA A 97 -1.605 5.238 1.645 1.00 1.00 H new ATOM 1553 N GLY A 98 -0.205 3.021 4.700 1.00 1.00 N ATOM 1554 CA GLY A 98 0.775 3.354 5.721 1.00 1.00 C ATOM 1555 C GLY A 98 0.138 3.871 6.998 1.00 1.00 C ATOM 1556 O GLY A 98 -1.043 4.217 7.016 1.00 1.00 O ATOM 0 H GLY A 98 -0.736 2.168 4.874 1.00 1.00 H new ATOM 0 HA2 GLY A 98 1.371 2.470 5.949 1.00 1.00 H new ATOM 0 HA3 GLY A 98 1.459 4.107 5.330 1.00 1.00 H new ATOM 1560 N GLY A 99 0.924 3.899 8.083 1.00 1.00 N ATOM 1561 CA GLY A 99 2.328 3.488 8.032 1.00 1.00 C ATOM 1562 C GLY A 99 2.542 2.000 8.258 1.00 1.00 C ATOM 1563 O GLY A 99 1.586 1.240 8.452 1.00 1.00 O ATOM 0 H GLY A 99 0.609 4.202 9.005 1.00 1.00 H new ATOM 0 HA2 GLY A 99 2.742 3.761 7.061 1.00 1.00 H new ATOM 0 HA3 GLY A 99 2.887 4.044 8.785 1.00 1.00 H new ATOM 1567 N ALA A 100 3.803 1.593 8.215 1.00 1.00 N ATOM 1568 CA ALA A 100 4.170 0.195 8.406 1.00 1.00 C ATOM 1569 C ALA A 100 3.818 -0.295 9.806 1.00 1.00 C ATOM 1570 O ALA A 100 3.362 -1.431 9.986 1.00 1.00 O ATOM 1571 CB ALA A 100 5.660 0.020 8.141 1.00 1.00 C ATOM 0 H ALA A 100 4.594 2.215 8.048 1.00 1.00 H new ATOM 0 HA ALA A 100 3.599 -0.407 7.699 1.00 1.00 H new ATOM 0 HB1 ALA A 100 5.935 -1.025 8.284 1.00 1.00 H new ATOM 0 HB2 ALA A 100 5.885 0.318 7.117 1.00 1.00 H new ATOM 0 HB3 ALA A 100 6.228 0.642 8.833 1.00 1.00 H new ATOM 1577 N GLN A 101 3.990 0.565 10.800 1.00 1.00 N ATOM 1578 CA GLN A 101 3.663 0.206 12.180 1.00 1.00 C ATOM 1579 C GLN A 101 2.164 -0.071 12.271 1.00 1.00 C ATOM 1580 O GLN A 101 1.722 -1.009 12.939 1.00 1.00 O ATOM 1581 CB GLN A 101 4.062 1.326 13.138 1.00 1.00 C ATOM 1582 CG GLN A 101 5.405 1.108 13.811 1.00 1.00 C ATOM 1583 CD GLN A 101 5.350 1.306 15.311 1.00 1.00 C ATOM 1584 OE1 GLN A 101 4.326 1.033 15.938 1.00 1.00 O ATOM 1585 NE2 GLN A 101 6.437 1.796 15.897 1.00 1.00 N ATOM 0 H GLN A 101 4.352 1.511 10.682 1.00 1.00 H new ATOM 0 HA GLN A 101 4.219 -0.687 12.467 1.00 1.00 H new ATOM 0 HB2 GLN A 101 4.090 2.268 12.590 1.00 1.00 H new ATOM 0 HB3 GLN A 101 3.294 1.426 13.905 1.00 1.00 H new ATOM 0 HG2 GLN A 101 5.754 0.098 13.595 1.00 1.00 H new ATOM 0 HG3 GLN A 101 6.135 1.796 13.385 1.00 1.00 H new ATOM 0 HE21 GLN A 101 7.265 2.009 15.340 1.00 1.00 H new ATOM 0 HE22 GLN A 101 6.444 1.960 16.904 1.00 1.00 H new ATOM 1594 N ILE A 102 1.406 0.741 11.559 1.00 1.00 N ATOM 1595 CA ILE A 102 -0.025 0.593 11.511 1.00 1.00 C ATOM 1596 C ILE A 102 -0.396 -0.731 10.837 1.00 1.00 C ATOM 1597 O ILE A 102 -1.312 -1.424 11.278 1.00 1.00 O ATOM 1598 CB ILE A 102 -0.700 1.757 10.748 1.00 1.00 C ATOM 1599 CG1 ILE A 102 -0.208 3.101 11.275 1.00 1.00 C ATOM 1600 CG2 ILE A 102 -2.213 1.660 10.868 1.00 1.00 C ATOM 1601 CD1 ILE A 102 -0.223 3.205 12.790 1.00 1.00 C ATOM 0 H ILE A 102 1.768 1.516 11.003 1.00 1.00 H new ATOM 0 HA ILE A 102 -0.386 0.604 12.540 1.00 1.00 H new ATOM 0 HB ILE A 102 -0.429 1.682 9.695 1.00 1.00 H new ATOM 0 HG12 ILE A 102 0.808 3.272 10.918 1.00 1.00 H new ATOM 0 HG13 ILE A 102 -0.829 3.894 10.859 1.00 1.00 H new ATOM 0 HG21 ILE A 102 -2.675 2.486 10.326 1.00 1.00 H new ATOM 0 HG22 ILE A 102 -2.552 0.714 10.445 1.00 1.00 H new ATOM 0 HG23 ILE A 102 -2.499 1.711 11.919 1.00 1.00 H new ATOM 0 HD11 ILE A 102 0.140 4.188 13.091 1.00 1.00 H new ATOM 0 HD12 ILE A 102 -1.241 3.067 13.154 1.00 1.00 H new ATOM 0 HD13 ILE A 102 0.421 2.435 13.214 1.00 1.00 H new ATOM 1613 N PHE A 103 0.300 -1.058 9.752 1.00 1.00 N ATOM 1614 CA PHE A 103 0.019 -2.276 8.994 1.00 1.00 C ATOM 1615 C PHE A 103 0.189 -3.532 9.829 1.00 1.00 C ATOM 1616 O PHE A 103 -0.666 -4.427 9.818 1.00 1.00 O ATOM 1617 CB PHE A 103 0.954 -2.391 7.787 1.00 1.00 C ATOM 1618 CG PHE A 103 0.537 -1.602 6.585 1.00 1.00 C ATOM 1619 CD1 PHE A 103 -0.794 -1.535 6.211 1.00 1.00 C ATOM 1620 CD2 PHE A 103 1.479 -0.923 5.830 1.00 1.00 C ATOM 1621 CE1 PHE A 103 -1.180 -0.805 5.105 1.00 1.00 C ATOM 1622 CE2 PHE A 103 1.099 -0.189 4.722 1.00 1.00 C ATOM 1623 CZ PHE A 103 -0.233 -0.131 4.359 1.00 1.00 C ATOM 0 H PHE A 103 1.064 -0.496 9.376 1.00 1.00 H new ATOM 0 HA PHE A 103 -1.020 -2.197 8.675 1.00 1.00 H new ATOM 0 HB2 PHE A 103 1.951 -2.068 8.087 1.00 1.00 H new ATOM 0 HB3 PHE A 103 1.031 -3.441 7.505 1.00 1.00 H new ATOM 0 HD1 PHE A 103 -1.539 -2.060 6.791 1.00 1.00 H new ATOM 0 HD2 PHE A 103 2.521 -0.967 6.110 1.00 1.00 H new ATOM 0 HE1 PHE A 103 -2.222 -0.761 4.823 1.00 1.00 H new ATOM 0 HE2 PHE A 103 1.842 0.338 4.141 1.00 1.00 H new ATOM 0 HZ PHE A 103 -0.533 0.441 3.493 1.00 1.00 H new ATOM 1633 N THR A 104 1.304 -3.615 10.547 1.00 1.00 N ATOM 1634 CA THR A 104 1.595 -4.787 11.375 1.00 1.00 C ATOM 1635 C THR A 104 0.571 -4.969 12.484 1.00 1.00 C ATOM 1636 O THR A 104 0.101 -6.080 12.739 1.00 1.00 O ATOM 1637 CB THR A 104 2.999 -4.685 11.983 1.00 1.00 C ATOM 1638 OG1 THR A 104 3.253 -5.770 12.852 1.00 1.00 O ATOM 1639 CG2 THR A 104 3.232 -3.412 12.760 1.00 1.00 C ATOM 0 H THR A 104 2.020 -2.889 10.575 1.00 1.00 H new ATOM 0 HA THR A 104 1.544 -5.658 10.722 1.00 1.00 H new ATOM 0 HB THR A 104 3.676 -4.695 11.129 1.00 1.00 H new ATOM 0 HG1 THR A 104 4.154 -5.685 13.227 1.00 1.00 H new ATOM 0 HG21 THR A 104 4.246 -3.410 13.160 1.00 1.00 H new ATOM 0 HG22 THR A 104 3.101 -2.554 12.101 1.00 1.00 H new ATOM 0 HG23 THR A 104 2.518 -3.351 13.581 1.00 1.00 H new ATOM 1647 N ALA A 105 0.236 -3.878 13.159 1.00 1.00 N ATOM 1648 CA ALA A 105 -0.729 -3.912 14.257 1.00 1.00 C ATOM 1649 C ALA A 105 -2.127 -4.311 13.792 1.00 1.00 C ATOM 1650 O ALA A 105 -2.848 -5.002 14.514 1.00 1.00 O ATOM 1651 CB ALA A 105 -0.769 -2.560 14.935 1.00 1.00 C ATOM 0 H ALA A 105 0.619 -2.952 12.966 1.00 1.00 H new ATOM 0 HA ALA A 105 -0.401 -4.674 14.964 1.00 1.00 H new ATOM 0 HB1 ALA A 105 -1.488 -2.585 15.754 1.00 1.00 H new ATOM 0 HB2 ALA A 105 0.219 -2.320 15.327 1.00 1.00 H new ATOM 0 HB3 ALA A 105 -1.067 -1.800 14.213 1.00 1.00 H new ATOM 1657 N PHE A 106 -2.514 -3.851 12.612 1.00 1.00 N ATOM 1658 CA PHE A 106 -3.836 -4.131 12.073 1.00 1.00 C ATOM 1659 C PHE A 106 -3.824 -5.243 11.017 1.00 1.00 C ATOM 1660 O PHE A 106 -4.847 -5.483 10.375 1.00 1.00 O ATOM 1661 CB PHE A 106 -4.418 -2.857 11.462 1.00 1.00 C ATOM 1662 CG PHE A 106 -4.849 -1.840 12.490 1.00 1.00 C ATOM 1663 CD1 PHE A 106 -5.744 -2.174 13.493 1.00 1.00 C ATOM 1664 CD2 PHE A 106 -4.353 -0.549 12.442 1.00 1.00 C ATOM 1665 CE1 PHE A 106 -6.135 -1.237 14.431 1.00 1.00 C ATOM 1666 CE2 PHE A 106 -4.741 0.393 13.376 1.00 1.00 C ATOM 1667 CZ PHE A 106 -5.633 0.048 14.372 1.00 1.00 C ATOM 0 H PHE A 106 -1.927 -3.278 12.006 1.00 1.00 H new ATOM 0 HA PHE A 106 -4.454 -4.478 12.901 1.00 1.00 H new ATOM 0 HB2 PHE A 106 -3.674 -2.406 10.805 1.00 1.00 H new ATOM 0 HB3 PHE A 106 -5.274 -3.120 10.841 1.00 1.00 H new ATOM 0 HD1 PHE A 106 -6.141 -3.177 13.543 1.00 1.00 H new ATOM 0 HD2 PHE A 106 -3.654 -0.274 11.666 1.00 1.00 H new ATOM 0 HE1 PHE A 106 -6.832 -1.510 15.209 1.00 1.00 H new ATOM 0 HE2 PHE A 106 -4.347 1.397 13.327 1.00 1.00 H new ATOM 0 HZ PHE A 106 -5.937 0.782 15.104 1.00 1.00 H new ATOM 1677 N LYS A 107 -2.695 -5.920 10.831 1.00 1.00 N ATOM 1678 CA LYS A 107 -2.621 -6.984 9.835 1.00 1.00 C ATOM 1679 C LYS A 107 -3.607 -8.093 10.155 1.00 1.00 C ATOM 1680 O LYS A 107 -4.347 -8.558 9.294 1.00 1.00 O ATOM 1681 CB LYS A 107 -1.201 -7.544 9.766 1.00 1.00 C ATOM 1682 CG LYS A 107 -0.848 -8.461 10.930 1.00 1.00 C ATOM 1683 CD LYS A 107 0.610 -8.892 10.878 1.00 1.00 C ATOM 1684 CE LYS A 107 0.929 -9.649 9.592 1.00 1.00 C ATOM 1685 NZ LYS A 107 2.062 -10.600 9.765 1.00 1.00 N ATOM 0 H LYS A 107 -1.831 -5.755 11.348 1.00 1.00 H new ATOM 0 HA LYS A 107 -2.883 -6.563 8.864 1.00 1.00 H new ATOM 0 HB2 LYS A 107 -1.082 -8.094 8.832 1.00 1.00 H new ATOM 0 HB3 LYS A 107 -0.494 -6.715 9.740 1.00 1.00 H new ATOM 0 HG2 LYS A 107 -1.043 -7.947 11.871 1.00 1.00 H new ATOM 0 HG3 LYS A 107 -1.490 -9.342 10.908 1.00 1.00 H new ATOM 0 HD2 LYS A 107 1.252 -8.014 10.952 1.00 1.00 H new ATOM 0 HD3 LYS A 107 0.834 -9.524 11.737 1.00 1.00 H new ATOM 0 HE2 LYS A 107 0.044 -10.196 9.266 1.00 1.00 H new ATOM 0 HE3 LYS A 107 1.172 -8.936 8.804 1.00 1.00 H new ATOM 0 HZ1 LYS A 107 2.243 -11.091 8.866 1.00 1.00 H new ATOM 0 HZ2 LYS A 107 2.914 -10.077 10.051 1.00 1.00 H new ATOM 0 HZ3 LYS A 107 1.821 -11.297 10.498 1.00 1.00 H new ATOM 1699 N ASP A 108 -3.638 -8.485 11.430 1.00 1.00 N ATOM 1700 CA ASP A 108 -4.558 -9.509 11.910 1.00 1.00 C ATOM 1701 C ASP A 108 -6.000 -9.022 11.796 1.00 1.00 C ATOM 1702 O ASP A 108 -6.927 -9.811 11.555 1.00 1.00 O ATOM 1703 CB ASP A 108 -4.227 -9.866 13.367 1.00 1.00 C ATOM 1704 CG ASP A 108 -2.981 -10.726 13.478 1.00 1.00 C ATOM 1705 OD1 ASP A 108 -3.059 -11.923 13.126 1.00 1.00 O ATOM 1706 OD2 ASP A 108 -1.934 -10.209 13.919 1.00 1.00 O ATOM 0 H ASP A 108 -3.028 -8.102 12.153 1.00 1.00 H new ATOM 0 HA ASP A 108 -4.447 -10.401 11.294 1.00 1.00 H new ATOM 0 HB2 ASP A 108 -4.086 -8.950 13.941 1.00 1.00 H new ATOM 0 HB3 ASP A 108 -5.071 -10.394 13.811 1.00 1.00 H new ATOM 1711 N ASP A 109 -6.184 -7.717 12.008 1.00 1.00 N ATOM 1712 CA ASP A 109 -7.500 -7.080 11.963 1.00 1.00 C ATOM 1713 C ASP A 109 -7.979 -6.807 10.530 1.00 1.00 C ATOM 1714 O ASP A 109 -9.106 -6.349 10.320 1.00 1.00 O ATOM 1715 CB ASP A 109 -7.480 -5.770 12.764 1.00 1.00 C ATOM 1716 CG ASP A 109 -7.621 -6.015 14.255 1.00 1.00 C ATOM 1717 OD1 ASP A 109 -7.048 -7.008 14.752 1.00 1.00 O ATOM 1718 OD2 ASP A 109 -8.323 -5.226 14.922 1.00 1.00 O ATOM 0 H ASP A 109 -5.422 -7.072 12.216 1.00 1.00 H new ATOM 0 HA ASP A 109 -8.206 -7.780 12.411 1.00 1.00 H new ATOM 0 HB2 ASP A 109 -6.547 -5.240 12.570 1.00 1.00 H new ATOM 0 HB3 ASP A 109 -8.290 -5.124 12.424 1.00 1.00 H new ATOM 1723 N VAL A 110 -7.133 -7.086 9.539 1.00 1.00 N ATOM 1724 CA VAL A 110 -7.511 -6.856 8.143 1.00 1.00 C ATOM 1725 C VAL A 110 -7.586 -8.170 7.372 1.00 1.00 C ATOM 1726 O VAL A 110 -6.641 -8.956 7.389 1.00 1.00 O ATOM 1727 CB VAL A 110 -6.506 -5.920 7.453 1.00 1.00 C ATOM 1728 CG1 VAL A 110 -6.376 -6.248 5.977 1.00 1.00 C ATOM 1729 CG2 VAL A 110 -6.914 -4.475 7.657 1.00 1.00 C ATOM 0 H VAL A 110 -6.196 -7.466 9.672 1.00 1.00 H new ATOM 0 HA VAL A 110 -8.496 -6.389 8.144 1.00 1.00 H new ATOM 0 HB VAL A 110 -5.527 -6.070 7.908 1.00 1.00 H new ATOM 0 HG11 VAL A 110 -5.658 -5.570 5.515 1.00 1.00 H new ATOM 0 HG12 VAL A 110 -6.030 -7.275 5.862 1.00 1.00 H new ATOM 0 HG13 VAL A 110 -7.346 -6.135 5.492 1.00 1.00 H new ATOM 0 HG21 VAL A 110 -6.195 -3.821 7.164 1.00 1.00 H new ATOM 0 HG22 VAL A 110 -7.904 -4.313 7.231 1.00 1.00 H new ATOM 0 HG23 VAL A 110 -6.937 -4.251 8.723 1.00 1.00 H new ATOM 1739 N ASP A 111 -8.715 -8.392 6.719 1.00 1.00 N ATOM 1740 CA ASP A 111 -8.947 -9.615 5.948 1.00 1.00 C ATOM 1741 C ASP A 111 -7.996 -9.737 4.753 1.00 1.00 C ATOM 1742 O ASP A 111 -7.569 -10.847 4.424 1.00 1.00 O ATOM 1743 CB ASP A 111 -10.399 -9.668 5.456 1.00 1.00 C ATOM 1744 CG ASP A 111 -11.151 -10.899 5.933 1.00 1.00 C ATOM 1745 OD1 ASP A 111 -10.893 -11.997 5.397 1.00 1.00 O ATOM 1746 OD2 ASP A 111 -12.012 -10.759 6.827 1.00 1.00 O ATOM 0 H ASP A 111 -9.497 -7.737 6.705 1.00 1.00 H new ATOM 0 HA ASP A 111 -8.752 -10.454 6.616 1.00 1.00 H new ATOM 0 HB2 ASP A 111 -10.924 -8.776 5.797 1.00 1.00 H new ATOM 0 HB3 ASP A 111 -10.407 -9.646 4.366 1.00 1.00 H new ATOM 1751 N THR A 112 -7.674 -8.617 4.092 1.00 1.00 N ATOM 1752 CA THR A 112 -6.786 -8.672 2.926 1.00 1.00 C ATOM 1753 C THR A 112 -5.523 -7.833 3.092 1.00 1.00 C ATOM 1754 O THR A 112 -5.584 -6.646 3.392 1.00 1.00 O ATOM 1755 CB THR A 112 -7.522 -8.209 1.675 1.00 1.00 C ATOM 1756 OG1 THR A 112 -8.664 -9.013 1.431 1.00 1.00 O ATOM 1757 CG2 THR A 112 -6.654 -8.240 0.437 1.00 1.00 C ATOM 0 H THR A 112 -8.006 -7.684 4.337 1.00 1.00 H new ATOM 0 HA THR A 112 -6.481 -9.714 2.829 1.00 1.00 H new ATOM 0 HB THR A 112 -7.813 -7.177 1.871 1.00 1.00 H new ATOM 0 HG1 THR A 112 -9.121 -8.696 0.624 1.00 1.00 H new ATOM 0 HG21 THR A 112 -7.233 -7.900 -0.422 1.00 1.00 H new ATOM 0 HG22 THR A 112 -5.795 -7.584 0.578 1.00 1.00 H new ATOM 0 HG23 THR A 112 -6.308 -9.258 0.261 1.00 1.00 H new ATOM 1765 N LEU A 113 -4.380 -8.476 2.858 1.00 1.00 N ATOM 1766 CA LEU A 113 -3.082 -7.819 2.941 1.00 1.00 C ATOM 1767 C LEU A 113 -2.393 -7.814 1.565 1.00 1.00 C ATOM 1768 O LEU A 113 -2.262 -8.861 0.930 1.00 1.00 O ATOM 1769 CB LEU A 113 -2.191 -8.529 3.960 1.00 1.00 C ATOM 1770 CG LEU A 113 -2.554 -8.283 5.426 1.00 1.00 C ATOM 1771 CD1 LEU A 113 -3.451 -9.382 5.945 1.00 1.00 C ATOM 1772 CD2 LEU A 113 -1.296 -8.180 6.273 1.00 1.00 C ATOM 0 H LEU A 113 -4.330 -9.463 2.607 1.00 1.00 H new ATOM 0 HA LEU A 113 -3.240 -6.789 3.262 1.00 1.00 H new ATOM 0 HB2 LEU A 113 -2.230 -9.601 3.768 1.00 1.00 H new ATOM 0 HB3 LEU A 113 -1.160 -8.213 3.800 1.00 1.00 H new ATOM 0 HG LEU A 113 -3.096 -7.339 5.492 1.00 1.00 H new ATOM 0 HD11 LEU A 113 -3.697 -9.188 6.989 1.00 1.00 H new ATOM 0 HD12 LEU A 113 -4.367 -9.413 5.356 1.00 1.00 H new ATOM 0 HD13 LEU A 113 -2.936 -10.340 5.866 1.00 1.00 H new ATOM 0 HD21 LEU A 113 -1.571 -8.005 7.313 1.00 1.00 H new ATOM 0 HD22 LEU A 113 -0.730 -9.109 6.199 1.00 1.00 H new ATOM 0 HD23 LEU A 113 -0.683 -7.352 5.915 1.00 1.00 H new ATOM 1784 N LEU A 114 -1.950 -6.638 1.105 1.00 1.00 N ATOM 1785 CA LEU A 114 -1.285 -6.546 -0.192 1.00 1.00 C ATOM 1786 C LEU A 114 0.220 -6.348 -0.025 1.00 1.00 C ATOM 1787 O LEU A 114 0.658 -5.426 0.669 1.00 1.00 O ATOM 1788 CB LEU A 114 -1.869 -5.410 -1.030 1.00 1.00 C ATOM 1789 CG LEU A 114 -2.970 -5.837 -1.988 1.00 1.00 C ATOM 1790 CD1 LEU A 114 -2.459 -6.852 -2.987 1.00 1.00 C ATOM 1791 CD2 LEU A 114 -4.145 -6.395 -1.200 1.00 1.00 C ATOM 0 H LEU A 114 -2.039 -5.753 1.604 1.00 1.00 H new ATOM 0 HA LEU A 114 -1.457 -7.488 -0.714 1.00 1.00 H new ATOM 0 HB2 LEU A 114 -2.264 -4.646 -0.360 1.00 1.00 H new ATOM 0 HB3 LEU A 114 -1.065 -4.947 -1.603 1.00 1.00 H new ATOM 0 HG LEU A 114 -3.303 -4.965 -2.550 1.00 1.00 H new ATOM 0 HD11 LEU A 114 -3.267 -7.140 -3.659 1.00 1.00 H new ATOM 0 HD12 LEU A 114 -1.644 -6.416 -3.565 1.00 1.00 H new ATOM 0 HD13 LEU A 114 -2.097 -7.733 -2.457 1.00 1.00 H new ATOM 0 HD21 LEU A 114 -4.933 -6.700 -1.889 1.00 1.00 H new ATOM 0 HD22 LEU A 114 -3.817 -7.257 -0.619 1.00 1.00 H new ATOM 0 HD23 LEU A 114 -4.529 -5.628 -0.527 1.00 1.00 H new ATOM 1803 N VAL A 115 0.989 -7.228 -0.666 1.00 1.00 N ATOM 1804 CA VAL A 115 2.447 -7.184 -0.588 1.00 1.00 C ATOM 1805 C VAL A 115 3.103 -7.047 -1.965 1.00 1.00 C ATOM 1806 O VAL A 115 2.791 -7.793 -2.897 1.00 1.00 O ATOM 1807 CB VAL A 115 3.005 -8.433 0.122 1.00 1.00 C ATOM 1808 CG1 VAL A 115 1.893 -9.416 0.440 1.00 1.00 C ATOM 1809 CG2 VAL A 115 4.091 -9.109 -0.708 1.00 1.00 C ATOM 0 H VAL A 115 0.624 -7.982 -1.247 1.00 1.00 H new ATOM 0 HA VAL A 115 2.693 -6.296 -0.006 1.00 1.00 H new ATOM 0 HB VAL A 115 3.455 -8.103 1.058 1.00 1.00 H new ATOM 0 HG11 VAL A 115 2.311 -10.289 0.941 1.00 1.00 H new ATOM 0 HG12 VAL A 115 1.162 -8.939 1.093 1.00 1.00 H new ATOM 0 HG13 VAL A 115 1.406 -9.726 -0.485 1.00 1.00 H new ATOM 0 HG21 VAL A 115 4.462 -9.986 -0.177 1.00 1.00 H new ATOM 0 HG22 VAL A 115 3.677 -9.415 -1.669 1.00 1.00 H new ATOM 0 HG23 VAL A 115 4.911 -8.410 -0.872 1.00 1.00 H new ATOM 1819 N THR A 116 4.022 -6.084 -2.064 1.00 1.00 N ATOM 1820 CA THR A 116 4.753 -5.836 -3.306 1.00 1.00 C ATOM 1821 C THR A 116 6.245 -6.077 -3.102 1.00 1.00 C ATOM 1822 O THR A 116 6.840 -5.589 -2.138 1.00 1.00 O ATOM 1823 CB THR A 116 4.535 -4.396 -3.785 1.00 1.00 C ATOM 1824 OG1 THR A 116 3.709 -4.366 -4.943 1.00 1.00 O ATOM 1825 CG2 THR A 116 5.832 -3.683 -4.123 1.00 1.00 C ATOM 0 H THR A 116 4.277 -5.463 -1.296 1.00 1.00 H new ATOM 0 HA THR A 116 4.374 -6.525 -4.061 1.00 1.00 H new ATOM 0 HB THR A 116 4.057 -3.880 -2.952 1.00 1.00 H new ATOM 0 HG1 THR A 116 2.977 -5.009 -4.839 1.00 1.00 H new ATOM 0 HG21 THR A 116 5.613 -2.668 -4.456 1.00 1.00 H new ATOM 0 HG22 THR A 116 6.468 -3.646 -3.238 1.00 1.00 H new ATOM 0 HG23 THR A 116 6.347 -4.222 -4.918 1.00 1.00 H new ATOM 1833 N ARG A 117 6.861 -6.848 -4.005 1.00 1.00 N ATOM 1834 CA ARG A 117 8.293 -7.160 -3.906 1.00 1.00 C ATOM 1835 C ARG A 117 9.027 -6.737 -5.172 1.00 1.00 C ATOM 1836 O ARG A 117 8.521 -6.920 -6.279 1.00 1.00 O ATOM 1837 CB ARG A 117 8.493 -8.656 -3.663 1.00 1.00 C ATOM 1838 CG ARG A 117 9.248 -8.977 -2.379 1.00 1.00 C ATOM 1839 CD ARG A 117 9.976 -10.316 -2.480 1.00 1.00 C ATOM 1840 NE ARG A 117 9.339 -11.326 -1.663 1.00 1.00 N ATOM 1841 CZ ARG A 117 9.560 -12.632 -1.792 1.00 1.00 C ATOM 1842 NH1 ARG A 117 10.397 -13.083 -2.718 1.00 1.00 N ATOM 1843 NH2 ARG A 117 8.942 -13.490 -0.992 1.00 1.00 N ATOM 0 H ARG A 117 6.394 -7.266 -4.809 1.00 1.00 H new ATOM 0 HA ARG A 117 8.705 -6.604 -3.064 1.00 1.00 H new ATOM 0 HB2 ARG A 117 7.518 -9.143 -3.631 1.00 1.00 H new ATOM 0 HB3 ARG A 117 9.034 -9.082 -4.508 1.00 1.00 H new ATOM 0 HG2 ARG A 117 9.967 -8.185 -2.170 1.00 1.00 H new ATOM 0 HG3 ARG A 117 8.550 -9.003 -1.542 1.00 1.00 H new ATOM 0 HD2 ARG A 117 9.994 -10.645 -3.519 1.00 1.00 H new ATOM 0 HD3 ARG A 117 11.013 -10.193 -2.167 1.00 1.00 H new ATOM 0 HE ARG A 117 8.682 -11.019 -0.946 1.00 1.00 H new ATOM 0 HH11 ARG A 117 10.875 -12.427 -3.336 1.00 1.00 H new ATOM 0 HH12 ARG A 117 10.562 -14.085 -2.812 1.00 1.00 H new ATOM 0 HH21 ARG A 117 8.298 -13.149 -0.278 1.00 1.00 H new ATOM 0 HH22 ARG A 117 9.111 -14.491 -1.090 1.00 1.00 H new ATOM 1857 N LEU A 118 10.215 -6.158 -4.990 1.00 1.00 N ATOM 1858 CA LEU A 118 11.029 -5.682 -6.107 1.00 1.00 C ATOM 1859 C LEU A 118 12.243 -6.574 -6.307 1.00 1.00 C ATOM 1860 O LEU A 118 12.978 -6.858 -5.362 1.00 1.00 O ATOM 1861 CB LEU A 118 11.481 -4.240 -5.852 1.00 1.00 C ATOM 1862 CG LEU A 118 10.460 -3.170 -6.229 1.00 1.00 C ATOM 1863 CD1 LEU A 118 10.649 -2.757 -7.677 1.00 1.00 C ATOM 1864 CD2 LEU A 118 9.049 -3.672 -6.006 1.00 1.00 C ATOM 0 H LEU A 118 10.636 -6.007 -4.073 1.00 1.00 H new ATOM 0 HA LEU A 118 10.421 -5.714 -7.011 1.00 1.00 H new ATOM 0 HB2 LEU A 118 11.725 -4.133 -4.795 1.00 1.00 H new ATOM 0 HB3 LEU A 118 12.399 -4.058 -6.411 1.00 1.00 H new ATOM 0 HG LEU A 118 10.618 -2.302 -5.590 1.00 1.00 H new ATOM 0 HD11 LEU A 118 9.916 -1.993 -7.936 1.00 1.00 H new ATOM 0 HD12 LEU A 118 11.654 -2.357 -7.813 1.00 1.00 H new ATOM 0 HD13 LEU A 118 10.514 -3.624 -8.323 1.00 1.00 H new ATOM 0 HD21 LEU A 118 8.338 -2.893 -6.281 1.00 1.00 H new ATOM 0 HD22 LEU A 118 8.876 -4.555 -6.621 1.00 1.00 H new ATOM 0 HD23 LEU A 118 8.916 -3.930 -4.955 1.00 1.00 H new ATOM 1876 N ALA A 119 12.449 -7.014 -7.542 1.00 1.00 N ATOM 1877 CA ALA A 119 13.580 -7.881 -7.862 1.00 1.00 C ATOM 1878 C ALA A 119 14.915 -7.180 -7.631 1.00 1.00 C ATOM 1879 O ALA A 119 15.880 -7.801 -7.194 1.00 1.00 O ATOM 1880 CB ALA A 119 13.494 -8.365 -9.303 1.00 1.00 C ATOM 0 H ALA A 119 11.851 -6.787 -8.337 1.00 1.00 H new ATOM 0 HA ALA A 119 13.528 -8.738 -7.191 1.00 1.00 H new ATOM 0 HB1 ALA A 119 14.345 -9.009 -9.522 1.00 1.00 H new ATOM 0 HB2 ALA A 119 12.569 -8.925 -9.444 1.00 1.00 H new ATOM 0 HB3 ALA A 119 13.505 -7.508 -9.976 1.00 1.00 H new ATOM 1886 N GLY A 120 14.968 -5.886 -7.952 1.00 1.00 N ATOM 1887 CA GLY A 120 16.205 -5.145 -7.786 1.00 1.00 C ATOM 1888 C GLY A 120 16.595 -4.934 -6.333 1.00 1.00 C ATOM 1889 O GLY A 120 15.732 -4.765 -5.468 1.00 1.00 O ATOM 0 H GLY A 120 14.185 -5.346 -8.320 1.00 1.00 H new ATOM 0 HA2 GLY A 120 17.009 -5.676 -8.296 1.00 1.00 H new ATOM 0 HA3 GLY A 120 16.106 -4.174 -8.272 1.00 1.00 H new ATOM 1893 N SER A 121 17.900 -4.933 -6.076 1.00 1.00 N ATOM 1894 CA SER A 121 18.404 -4.727 -4.722 1.00 1.00 C ATOM 1895 C SER A 121 18.252 -3.270 -4.311 1.00 1.00 C ATOM 1896 O SER A 121 18.306 -2.373 -5.159 1.00 1.00 O ATOM 1897 CB SER A 121 19.872 -5.141 -4.634 1.00 1.00 C ATOM 1898 OG SER A 121 20.023 -6.499 -5.038 1.00 1.00 O ATOM 0 H SER A 121 18.623 -5.071 -6.782 1.00 1.00 H new ATOM 0 HA SER A 121 17.819 -5.346 -4.041 1.00 1.00 H new ATOM 0 HB2 SER A 121 20.479 -4.495 -5.269 1.00 1.00 H new ATOM 0 HB3 SER A 121 20.233 -5.015 -3.613 1.00 1.00 H new ATOM 0 HG SER A 121 20.967 -6.755 -4.980 1.00 1.00 H new ATOM 1904 N PHE A 122 18.098 -3.036 -3.012 1.00 1.00 N ATOM 1905 CA PHE A 122 17.960 -1.680 -2.481 1.00 1.00 C ATOM 1906 C PHE A 122 18.530 -1.585 -1.066 1.00 1.00 C ATOM 1907 O PHE A 122 18.700 -2.597 -0.392 1.00 1.00 O ATOM 1908 CB PHE A 122 16.497 -1.236 -2.483 1.00 1.00 C ATOM 1909 CG PHE A 122 16.152 -0.322 -3.626 1.00 1.00 C ATOM 1910 CD1 PHE A 122 16.411 1.037 -3.549 1.00 1.00 C ATOM 1911 CD2 PHE A 122 15.567 -0.826 -4.777 1.00 1.00 C ATOM 1912 CE1 PHE A 122 16.093 1.877 -4.599 1.00 1.00 C ATOM 1913 CE2 PHE A 122 15.245 0.009 -5.830 1.00 1.00 C ATOM 1914 CZ PHE A 122 15.509 1.362 -5.741 1.00 1.00 C ATOM 0 H PHE A 122 18.065 -3.769 -2.303 1.00 1.00 H new ATOM 0 HA PHE A 122 18.527 -1.014 -3.132 1.00 1.00 H new ATOM 0 HB2 PHE A 122 15.858 -2.118 -2.527 1.00 1.00 H new ATOM 0 HB3 PHE A 122 16.277 -0.729 -1.543 1.00 1.00 H new ATOM 0 HD1 PHE A 122 16.866 1.444 -2.658 1.00 1.00 H new ATOM 0 HD2 PHE A 122 15.360 -1.883 -4.852 1.00 1.00 H new ATOM 0 HE1 PHE A 122 16.300 2.934 -4.527 1.00 1.00 H new ATOM 0 HE2 PHE A 122 14.788 -0.396 -6.721 1.00 1.00 H new ATOM 0 HZ PHE A 122 15.259 2.017 -6.563 1.00 1.00 H new ATOM 1924 N GLU A 123 18.844 -0.377 -0.627 1.00 1.00 N ATOM 1925 CA GLU A 123 19.406 -0.180 0.703 1.00 1.00 C ATOM 1926 C GLU A 123 18.688 0.959 1.435 1.00 1.00 C ATOM 1927 O GLU A 123 18.280 1.942 0.817 1.00 1.00 O ATOM 1928 CB GLU A 123 20.908 0.114 0.603 1.00 1.00 C ATOM 1929 CG GLU A 123 21.693 -0.958 -0.148 1.00 1.00 C ATOM 1930 CD GLU A 123 22.776 -1.576 0.712 1.00 1.00 C ATOM 1931 OE1 GLU A 123 22.430 -2.203 1.735 1.00 1.00 O ATOM 1932 OE2 GLU A 123 23.966 -1.434 0.365 1.00 1.00 O ATOM 0 H GLU A 123 18.721 0.479 -1.168 1.00 1.00 H new ATOM 0 HA GLU A 123 19.263 -1.096 1.276 1.00 1.00 H new ATOM 0 HB2 GLU A 123 21.049 1.072 0.104 1.00 1.00 H new ATOM 0 HB3 GLU A 123 21.317 0.215 1.608 1.00 1.00 H new ATOM 0 HG2 GLU A 123 21.010 -1.737 -0.486 1.00 1.00 H new ATOM 0 HG3 GLU A 123 22.143 -0.520 -1.039 1.00 1.00 H new ATOM 1939 N GLY A 124 18.546 0.824 2.750 1.00 1.00 N ATOM 1940 CA GLY A 124 17.896 1.844 3.545 1.00 1.00 C ATOM 1941 C GLY A 124 18.064 1.610 5.040 1.00 1.00 C ATOM 1942 O GLY A 124 18.553 0.555 5.453 1.00 1.00 O ATOM 0 H GLY A 124 18.874 0.017 3.281 1.00 1.00 H new ATOM 0 HA2 GLY A 124 18.306 2.820 3.285 1.00 1.00 H new ATOM 0 HA3 GLY A 124 16.834 1.869 3.301 1.00 1.00 H new ATOM 1946 N ASP A 125 17.673 2.589 5.847 1.00 1.00 N ATOM 1947 CA ASP A 125 17.779 2.484 7.303 1.00 1.00 C ATOM 1948 C ASP A 125 16.483 1.960 7.923 1.00 1.00 C ATOM 1949 O ASP A 125 16.393 1.811 9.151 1.00 1.00 O ATOM 1950 CB ASP A 125 18.124 3.850 7.907 1.00 1.00 C ATOM 1951 CG ASP A 125 19.060 3.756 9.097 1.00 1.00 C ATOM 1952 OD1 ASP A 125 20.076 3.035 9.015 1.00 1.00 O ATOM 1953 OD2 ASP A 125 18.767 4.412 10.119 1.00 1.00 O ATOM 0 H ASP A 125 17.277 3.470 5.519 1.00 1.00 H new ATOM 0 HA ASP A 125 18.575 1.774 7.527 1.00 1.00 H new ATOM 0 HB2 ASP A 125 18.583 4.474 7.140 1.00 1.00 H new ATOM 0 HB3 ASP A 125 17.204 4.347 8.214 1.00 1.00 H new ATOM 1958 N THR A 126 15.484 1.655 7.100 1.00 1.00 N ATOM 1959 CA THR A 126 14.208 1.143 7.608 1.00 1.00 C ATOM 1960 C THR A 126 13.931 -0.258 7.074 1.00 1.00 C ATOM 1961 O THR A 126 14.011 -0.517 5.874 1.00 1.00 O ATOM 1962 CB THR A 126 13.055 2.066 7.228 1.00 1.00 C ATOM 1963 OG1 THR A 126 11.811 1.484 7.592 1.00 1.00 O ATOM 1964 CG2 THR A 126 12.999 2.376 5.752 1.00 1.00 C ATOM 0 H THR A 126 15.529 1.751 6.086 1.00 1.00 H new ATOM 0 HA THR A 126 14.285 1.102 8.694 1.00 1.00 H new ATOM 0 HB THR A 126 13.235 2.994 7.770 1.00 1.00 H new ATOM 0 HG1 THR A 126 11.167 2.193 7.802 1.00 1.00 H new ATOM 0 HG21 THR A 126 12.156 3.037 5.551 1.00 1.00 H new ATOM 0 HG22 THR A 126 13.924 2.865 5.448 1.00 1.00 H new ATOM 0 HG23 THR A 126 12.876 1.450 5.190 1.00 1.00 H new ATOM 1972 N LYS A 127 13.608 -1.164 7.992 1.00 1.00 N ATOM 1973 CA LYS A 127 13.321 -2.553 7.626 1.00 1.00 C ATOM 1974 C LYS A 127 11.906 -2.939 8.039 1.00 1.00 C ATOM 1975 O LYS A 127 11.423 -2.557 9.104 1.00 1.00 O ATOM 1976 CB LYS A 127 14.328 -3.505 8.275 1.00 1.00 C ATOM 1977 CG LYS A 127 14.446 -3.335 9.780 1.00 1.00 C ATOM 1978 CD LYS A 127 15.091 -4.541 10.432 1.00 1.00 C ATOM 1979 CE LYS A 127 14.998 -4.486 11.947 1.00 1.00 C ATOM 1980 NZ LYS A 127 14.832 -5.837 12.541 1.00 1.00 N ATOM 0 H LYS A 127 13.538 -0.966 8.990 1.00 1.00 H new ATOM 0 HA LYS A 127 13.407 -2.636 6.543 1.00 1.00 H new ATOM 0 HB2 LYS A 127 14.037 -4.532 8.056 1.00 1.00 H new ATOM 0 HB3 LYS A 127 15.307 -3.348 7.823 1.00 1.00 H new ATOM 0 HG2 LYS A 127 15.034 -2.444 10.000 1.00 1.00 H new ATOM 0 HG3 LYS A 127 13.456 -3.177 10.207 1.00 1.00 H new ATOM 0 HD2 LYS A 127 14.608 -5.449 10.072 1.00 1.00 H new ATOM 0 HD3 LYS A 127 16.138 -4.597 10.135 1.00 1.00 H new ATOM 0 HE2 LYS A 127 15.898 -4.021 12.349 1.00 1.00 H new ATOM 0 HE3 LYS A 127 14.157 -3.856 12.236 1.00 1.00 H new ATOM 0 HZ1 LYS A 127 14.773 -5.756 13.576 1.00 1.00 H new ATOM 0 HZ2 LYS A 127 13.960 -6.272 12.177 1.00 1.00 H new ATOM 0 HZ3 LYS A 127 15.647 -6.431 12.286 1.00 1.00 H new ATOM 1994 N MET A 128 11.246 -3.718 7.188 1.00 1.00 N ATOM 1995 CA MET A 128 9.889 -4.170 7.461 1.00 1.00 C ATOM 1996 C MET A 128 9.896 -5.302 8.491 1.00 1.00 C ATOM 1997 O MET A 128 10.787 -6.148 8.489 1.00 1.00 O ATOM 1998 CB MET A 128 9.221 -4.659 6.166 1.00 1.00 C ATOM 1999 CG MET A 128 7.814 -4.127 5.985 1.00 1.00 C ATOM 2000 SD MET A 128 6.560 -5.126 6.825 1.00 1.00 S ATOM 2001 CE MET A 128 5.660 -3.854 7.718 1.00 1.00 C ATOM 0 H MET A 128 11.630 -4.049 6.303 1.00 1.00 H new ATOM 0 HA MET A 128 9.324 -3.329 7.863 1.00 1.00 H new ATOM 0 HB2 MET A 128 9.830 -4.357 5.314 1.00 1.00 H new ATOM 0 HB3 MET A 128 9.194 -5.749 6.168 1.00 1.00 H new ATOM 0 HG2 MET A 128 7.768 -3.105 6.362 1.00 1.00 H new ATOM 0 HG3 MET A 128 7.583 -4.085 4.921 1.00 1.00 H new ATOM 0 HE1 MET A 128 4.885 -4.317 8.329 1.00 1.00 H new ATOM 0 HE2 MET A 128 6.348 -3.304 8.360 1.00 1.00 H new ATOM 0 HE3 MET A 128 5.200 -3.167 7.008 1.00 1.00 H new ATOM 2011 N ILE A 129 8.902 -5.287 9.368 1.00 1.00 N ATOM 2012 CA ILE A 129 8.781 -6.293 10.426 1.00 1.00 C ATOM 2013 C ILE A 129 8.580 -7.689 9.849 1.00 1.00 C ATOM 2014 O ILE A 129 8.229 -7.840 8.680 1.00 1.00 O ATOM 2015 CB ILE A 129 7.611 -5.969 11.378 1.00 1.00 C ATOM 2016 CG1 ILE A 129 6.336 -5.638 10.619 1.00 1.00 C ATOM 2017 CG2 ILE A 129 7.984 -4.817 12.285 1.00 1.00 C ATOM 2018 CD1 ILE A 129 5.481 -6.844 10.315 1.00 1.00 C ATOM 0 H ILE A 129 8.161 -4.586 9.371 1.00 1.00 H new ATOM 0 HA ILE A 129 9.716 -6.271 10.986 1.00 1.00 H new ATOM 0 HB ILE A 129 7.419 -6.860 11.976 1.00 1.00 H new ATOM 0 HG12 ILE A 129 5.751 -4.926 11.202 1.00 1.00 H new ATOM 0 HG13 ILE A 129 6.598 -5.144 9.683 1.00 1.00 H new ATOM 0 HG21 ILE A 129 7.152 -4.596 12.953 1.00 1.00 H new ATOM 0 HG22 ILE A 129 8.861 -5.087 12.874 1.00 1.00 H new ATOM 0 HG23 ILE A 129 8.209 -3.937 11.682 1.00 1.00 H new ATOM 0 HD11 ILE A 129 4.589 -6.530 9.772 1.00 1.00 H new ATOM 0 HD12 ILE A 129 6.048 -7.548 9.705 1.00 1.00 H new ATOM 0 HD13 ILE A 129 5.187 -7.326 11.247 1.00 1.00 H new ATOM 2030 N PRO A 130 8.811 -8.738 10.666 1.00 1.00 N ATOM 2031 CA PRO A 130 8.659 -10.131 10.242 1.00 1.00 C ATOM 2032 C PRO A 130 7.234 -10.468 9.787 1.00 1.00 C ATOM 2033 O PRO A 130 6.265 -9.966 10.346 1.00 1.00 O ATOM 2034 CB PRO A 130 9.015 -10.929 11.495 1.00 1.00 C ATOM 2035 CG PRO A 130 9.808 -9.994 12.341 1.00 1.00 C ATOM 2036 CD PRO A 130 9.233 -8.637 12.068 1.00 1.00 C ATOM 0 HA PRO A 130 9.287 -10.353 9.380 1.00 1.00 H new ATOM 0 HB2 PRO A 130 8.118 -11.266 12.015 1.00 1.00 H new ATOM 0 HB3 PRO A 130 9.592 -11.819 11.244 1.00 1.00 H new ATOM 0 HG2 PRO A 130 9.726 -10.252 13.397 1.00 1.00 H new ATOM 0 HG3 PRO A 130 10.867 -10.032 12.085 1.00 1.00 H new ATOM 0 HD2 PRO A 130 8.395 -8.413 12.727 1.00 1.00 H new ATOM 0 HD3 PRO A 130 9.972 -7.848 12.212 1.00 1.00 H new ATOM 2044 N LEU A 131 7.129 -11.318 8.769 1.00 1.00 N ATOM 2045 CA LEU A 131 5.821 -11.713 8.243 1.00 1.00 C ATOM 2046 C LEU A 131 5.492 -13.144 8.663 1.00 1.00 C ATOM 2047 O LEU A 131 6.289 -14.061 8.459 1.00 1.00 O ATOM 2048 CB LEU A 131 5.792 -11.593 6.723 1.00 1.00 C ATOM 2049 CG LEU A 131 5.902 -10.170 6.171 1.00 1.00 C ATOM 2050 CD1 LEU A 131 6.067 -10.197 4.664 1.00 1.00 C ATOM 2051 CD2 LEU A 131 4.690 -9.345 6.562 1.00 1.00 C ATOM 0 H LEU A 131 7.925 -11.744 8.294 1.00 1.00 H new ATOM 0 HA LEU A 131 5.069 -11.041 8.657 1.00 1.00 H new ATOM 0 HB2 LEU A 131 6.609 -12.187 6.314 1.00 1.00 H new ATOM 0 HB3 LEU A 131 4.864 -12.034 6.359 1.00 1.00 H new ATOM 0 HG LEU A 131 6.785 -9.702 6.606 1.00 1.00 H new ATOM 0 HD11 LEU A 131 6.144 -9.177 4.288 1.00 1.00 H new ATOM 0 HD12 LEU A 131 6.972 -10.747 4.407 1.00 1.00 H new ATOM 0 HD13 LEU A 131 5.204 -10.686 4.212 1.00 1.00 H new ATOM 0 HD21 LEU A 131 4.790 -8.337 6.159 1.00 1.00 H new ATOM 0 HD22 LEU A 131 3.789 -9.809 6.160 1.00 1.00 H new ATOM 0 HD23 LEU A 131 4.619 -9.295 7.649 1.00 1.00 H new ATOM 2063 N ASN A 132 4.311 -13.332 9.238 1.00 1.00 N ATOM 2064 CA ASN A 132 3.905 -14.658 9.663 1.00 1.00 C ATOM 2065 C ASN A 132 3.195 -15.387 8.537 1.00 1.00 C ATOM 2066 O ASN A 132 2.050 -15.080 8.193 1.00 1.00 O ATOM 2067 CB ASN A 132 2.988 -14.567 10.883 1.00 1.00 C ATOM 2068 CG ASN A 132 3.743 -14.700 12.195 1.00 1.00 C ATOM 2069 OD1 ASN A 132 4.668 -15.504 12.321 1.00 1.00 O ATOM 2070 ND2 ASN A 132 3.354 -13.895 13.177 1.00 1.00 N ATOM 0 H ASN A 132 3.630 -12.594 9.417 1.00 1.00 H new ATOM 0 HA ASN A 132 4.800 -15.219 9.932 1.00 1.00 H new ATOM 0 HB2 ASN A 132 2.462 -13.613 10.866 1.00 1.00 H new ATOM 0 HB3 ASN A 132 2.231 -15.349 10.823 1.00 1.00 H new ATOM 0 HD21 ASN A 132 3.827 -13.927 14.080 1.00 1.00 H new ATOM 0 HD22 ASN A 132 2.583 -13.244 13.028 1.00 1.00 H new ATOM 2077 N TRP A 133 3.892 -16.360 7.963 1.00 1.00 N ATOM 2078 CA TRP A 133 3.350 -17.142 6.866 1.00 1.00 C ATOM 2079 C TRP A 133 2.070 -17.872 7.278 1.00 1.00 C ATOM 2080 O TRP A 133 1.127 -17.970 6.505 1.00 1.00 O ATOM 2081 CB TRP A 133 4.384 -18.153 6.359 1.00 1.00 C ATOM 2082 CG TRP A 133 5.218 -17.631 5.231 1.00 1.00 C ATOM 2083 CD1 TRP A 133 5.805 -16.402 5.158 1.00 1.00 C ATOM 2084 CD2 TRP A 133 5.556 -18.313 4.023 1.00 1.00 C ATOM 2085 NE1 TRP A 133 6.491 -16.279 3.974 1.00 1.00 N ATOM 2086 CE2 TRP A 133 6.352 -17.440 3.260 1.00 1.00 C ATOM 2087 CE3 TRP A 133 5.264 -19.579 3.512 1.00 1.00 C ATOM 2088 CZ2 TRP A 133 6.859 -17.792 2.015 1.00 1.00 C ATOM 2089 CZ3 TRP A 133 5.767 -19.929 2.274 1.00 1.00 C ATOM 2090 CH2 TRP A 133 6.558 -19.038 1.538 1.00 1.00 C ATOM 0 H TRP A 133 4.837 -16.625 8.242 1.00 1.00 H new ATOM 0 HA TRP A 133 3.105 -16.448 6.062 1.00 1.00 H new ATOM 0 HB2 TRP A 133 5.038 -18.438 7.183 1.00 1.00 H new ATOM 0 HB3 TRP A 133 3.869 -19.057 6.033 1.00 1.00 H new ATOM 0 HD1 TRP A 133 5.740 -15.638 5.919 1.00 1.00 H new ATOM 0 HE1 TRP A 133 7.017 -15.458 3.675 1.00 1.00 H new ATOM 0 HE3 TRP A 133 4.656 -20.272 4.074 1.00 1.00 H new ATOM 0 HZ2 TRP A 133 7.469 -17.107 1.445 1.00 1.00 H new ATOM 0 HZ3 TRP A 133 5.547 -20.905 1.867 1.00 1.00 H new ATOM 0 HH2 TRP A 133 6.938 -19.341 0.574 1.00 1.00 H new ATOM 2101 N ASP A 134 2.051 -18.395 8.487 1.00 1.00 N ATOM 2102 CA ASP A 134 0.876 -19.117 8.971 1.00 1.00 C ATOM 2103 C ASP A 134 -0.334 -18.192 9.112 1.00 1.00 C ATOM 2104 O ASP A 134 -1.472 -18.593 8.876 1.00 1.00 O ATOM 2105 CB ASP A 134 1.176 -19.780 10.322 1.00 1.00 C ATOM 2106 CG ASP A 134 1.967 -21.068 10.170 1.00 1.00 C ATOM 2107 OD1 ASP A 134 3.190 -20.995 9.923 1.00 1.00 O ATOM 2108 OD2 ASP A 134 1.356 -22.151 10.290 1.00 1.00 O ATOM 0 H ASP A 134 2.823 -18.339 9.151 1.00 1.00 H new ATOM 0 HA ASP A 134 0.637 -19.883 8.234 1.00 1.00 H new ATOM 0 HB2 ASP A 134 1.735 -19.085 10.949 1.00 1.00 H new ATOM 0 HB3 ASP A 134 0.239 -19.991 10.837 1.00 1.00 H new ATOM 2113 N ASP A 135 -0.086 -16.952 9.496 1.00 1.00 N ATOM 2114 CA ASP A 135 -1.147 -15.964 9.683 1.00 1.00 C ATOM 2115 C ASP A 135 -1.875 -15.628 8.384 1.00 1.00 C ATOM 2116 O ASP A 135 -3.084 -15.371 8.387 1.00 1.00 O ATOM 2117 CB ASP A 135 -0.572 -14.676 10.292 1.00 1.00 C ATOM 2118 CG ASP A 135 -0.920 -14.503 11.754 1.00 1.00 C ATOM 2119 OD1 ASP A 135 -2.053 -14.860 12.143 1.00 1.00 O ATOM 2120 OD2 ASP A 135 -0.056 -14.019 12.513 1.00 1.00 O ATOM 0 H ASP A 135 0.851 -16.597 9.688 1.00 1.00 H new ATOM 0 HA ASP A 135 -1.874 -16.410 10.362 1.00 1.00 H new ATOM 0 HB2 ASP A 135 0.512 -14.682 10.181 1.00 1.00 H new ATOM 0 HB3 ASP A 135 -0.945 -13.819 9.732 1.00 1.00 H new ATOM 2125 N PHE A 136 -1.155 -15.604 7.269 1.00 1.00 N ATOM 2126 CA PHE A 136 -1.760 -15.268 5.990 1.00 1.00 C ATOM 2127 C PHE A 136 -1.156 -16.068 4.842 1.00 1.00 C ATOM 2128 O PHE A 136 -0.012 -16.518 4.897 1.00 1.00 O ATOM 2129 CB PHE A 136 -1.589 -13.771 5.740 1.00 1.00 C ATOM 2130 CG PHE A 136 -2.442 -12.924 6.643 1.00 1.00 C ATOM 2131 CD1 PHE A 136 -3.815 -12.863 6.464 1.00 1.00 C ATOM 2132 CD2 PHE A 136 -1.871 -12.198 7.676 1.00 1.00 C ATOM 2133 CE1 PHE A 136 -4.602 -12.092 7.299 1.00 1.00 C ATOM 2134 CE2 PHE A 136 -2.653 -11.426 8.514 1.00 1.00 C ATOM 2135 CZ PHE A 136 -4.020 -11.374 8.326 1.00 1.00 C ATOM 0 H PHE A 136 -0.157 -15.812 7.226 1.00 1.00 H new ATOM 0 HA PHE A 136 -2.818 -15.525 6.033 1.00 1.00 H new ATOM 0 HB2 PHE A 136 -0.542 -13.502 5.881 1.00 1.00 H new ATOM 0 HB3 PHE A 136 -1.838 -13.551 4.702 1.00 1.00 H new ATOM 0 HD1 PHE A 136 -4.275 -13.424 5.664 1.00 1.00 H new ATOM 0 HD2 PHE A 136 -0.802 -12.236 7.828 1.00 1.00 H new ATOM 0 HE1 PHE A 136 -5.671 -12.051 7.149 1.00 1.00 H new ATOM 0 HE2 PHE A 136 -2.196 -10.864 9.315 1.00 1.00 H new ATOM 0 HZ PHE A 136 -4.633 -10.773 8.981 1.00 1.00 H new ATOM 2145 N THR A 137 -1.934 -16.228 3.783 1.00 1.00 N ATOM 2146 CA THR A 137 -1.476 -16.960 2.600 1.00 1.00 C ATOM 2147 C THR A 137 -1.727 -16.136 1.349 1.00 1.00 C ATOM 2148 O THR A 137 -2.605 -15.268 1.339 1.00 1.00 O ATOM 2149 CB THR A 137 -2.200 -18.303 2.483 1.00 1.00 C ATOM 2150 OG1 THR A 137 -1.959 -18.873 1.203 1.00 1.00 O ATOM 2151 CG2 THR A 137 -3.695 -18.219 2.678 1.00 1.00 C ATOM 0 H THR A 137 -2.884 -15.864 3.713 1.00 1.00 H new ATOM 0 HA THR A 137 -0.407 -17.145 2.704 1.00 1.00 H new ATOM 0 HB THR A 137 -1.798 -18.919 3.287 1.00 1.00 H new ATOM 0 HG1 THR A 137 -2.424 -19.733 1.135 1.00 1.00 H new ATOM 0 HG21 THR A 137 -4.131 -19.213 2.579 1.00 1.00 H new ATOM 0 HG22 THR A 137 -3.911 -17.825 3.671 1.00 1.00 H new ATOM 0 HG23 THR A 137 -4.124 -17.558 1.925 1.00 1.00 H new ATOM 2159 N LYS A 138 -0.954 -16.403 0.300 1.00 1.00 N ATOM 2160 CA LYS A 138 -1.091 -15.658 -0.952 1.00 1.00 C ATOM 2161 C LYS A 138 -2.219 -16.230 -1.810 1.00 1.00 C ATOM 2162 O LYS A 138 -2.146 -17.372 -2.283 1.00 1.00 O ATOM 2163 CB LYS A 138 0.231 -15.703 -1.723 1.00 1.00 C ATOM 2164 CG LYS A 138 0.704 -17.114 -2.087 1.00 1.00 C ATOM 2165 CD LYS A 138 2.211 -17.238 -2.013 1.00 1.00 C ATOM 2166 CE LYS A 138 2.661 -18.678 -2.190 1.00 1.00 C ATOM 2167 NZ LYS A 138 3.518 -19.141 -1.070 1.00 1.00 N ATOM 0 H LYS A 138 -0.232 -17.123 0.289 1.00 1.00 H new ATOM 0 HA LYS A 138 -1.339 -14.624 -0.715 1.00 1.00 H new ATOM 0 HB2 LYS A 138 0.123 -15.122 -2.639 1.00 1.00 H new ATOM 0 HB3 LYS A 138 1.003 -15.217 -1.126 1.00 1.00 H new ATOM 0 HG2 LYS A 138 0.246 -17.836 -1.411 1.00 1.00 H new ATOM 0 HG3 LYS A 138 0.368 -17.362 -3.094 1.00 1.00 H new ATOM 0 HD2 LYS A 138 2.666 -16.616 -2.784 1.00 1.00 H new ATOM 0 HD3 LYS A 138 2.561 -16.862 -1.052 1.00 1.00 H new ATOM 0 HE2 LYS A 138 1.786 -19.323 -2.266 1.00 1.00 H new ATOM 0 HE3 LYS A 138 3.209 -18.773 -3.127 1.00 1.00 H new ATOM 0 HZ1 LYS A 138 3.801 -20.128 -1.234 1.00 1.00 H new ATOM 0 HZ2 LYS A 138 4.367 -18.543 -1.012 1.00 1.00 H new ATOM 0 HZ3 LYS A 138 2.988 -19.077 -0.178 1.00 1.00 H new ATOM 2181 N VAL A 139 -3.247 -15.418 -2.028 1.00 1.00 N ATOM 2182 CA VAL A 139 -4.365 -15.826 -2.850 1.00 1.00 C ATOM 2183 C VAL A 139 -3.911 -16.055 -4.274 1.00 1.00 C ATOM 2184 O VAL A 139 -4.313 -17.013 -4.914 1.00 1.00 O ATOM 2185 CB VAL A 139 -5.514 -14.799 -2.826 1.00 1.00 C ATOM 2186 CG1 VAL A 139 -5.869 -14.417 -1.397 1.00 1.00 C ATOM 2187 CG2 VAL A 139 -5.144 -13.571 -3.635 1.00 1.00 C ATOM 0 H VAL A 139 -3.324 -14.476 -1.645 1.00 1.00 H new ATOM 0 HA VAL A 139 -4.748 -16.757 -2.432 1.00 1.00 H new ATOM 0 HB VAL A 139 -6.393 -15.258 -3.280 1.00 1.00 H new ATOM 0 HG11 VAL A 139 -6.682 -13.691 -1.406 1.00 1.00 H new ATOM 0 HG12 VAL A 139 -6.182 -15.306 -0.850 1.00 1.00 H new ATOM 0 HG13 VAL A 139 -4.997 -13.979 -0.910 1.00 1.00 H new ATOM 0 HG21 VAL A 139 -5.966 -12.856 -3.608 1.00 1.00 H new ATOM 0 HG22 VAL A 139 -4.250 -13.112 -3.212 1.00 1.00 H new ATOM 0 HG23 VAL A 139 -4.949 -13.861 -4.668 1.00 1.00 H new ATOM 2197 N SER A 140 -3.068 -15.145 -4.767 1.00 1.00 N ATOM 2198 CA SER A 140 -2.562 -15.227 -6.127 1.00 1.00 C ATOM 2199 C SER A 140 -1.256 -14.471 -6.286 1.00 1.00 C ATOM 2200 O SER A 140 -0.883 -13.657 -5.441 1.00 1.00 O ATOM 2201 CB SER A 140 -3.591 -14.683 -7.113 1.00 1.00 C ATOM 2202 OG SER A 140 -3.996 -15.680 -8.031 1.00 1.00 O ATOM 0 H SER A 140 -2.724 -14.343 -4.238 1.00 1.00 H new ATOM 0 HA SER A 140 -2.375 -16.279 -6.340 1.00 1.00 H new ATOM 0 HB2 SER A 140 -4.459 -14.312 -6.569 1.00 1.00 H new ATOM 0 HB3 SER A 140 -3.168 -13.837 -7.654 1.00 1.00 H new ATOM 0 HG SER A 140 -4.657 -15.305 -8.650 1.00 1.00 H new ATOM 2208 N SER A 141 -0.552 -14.743 -7.384 1.00 1.00 N ATOM 2209 CA SER A 141 0.716 -14.082 -7.660 1.00 1.00 C ATOM 2210 C SER A 141 0.795 -13.629 -9.119 1.00 1.00 C ATOM 2211 O SER A 141 0.184 -14.228 -10.003 1.00 1.00 O ATOM 2212 CB SER A 141 1.875 -15.026 -7.343 1.00 1.00 C ATOM 2213 OG SER A 141 1.401 -16.274 -6.875 1.00 1.00 O ATOM 0 H SER A 141 -0.840 -15.416 -8.094 1.00 1.00 H new ATOM 0 HA SER A 141 0.785 -13.198 -7.026 1.00 1.00 H new ATOM 0 HB2 SER A 141 2.481 -15.175 -8.236 1.00 1.00 H new ATOM 0 HB3 SER A 141 2.521 -14.574 -6.591 1.00 1.00 H new ATOM 0 HG SER A 141 2.161 -16.861 -6.681 1.00 1.00 H new ATOM 2219 N ARG A 142 1.551 -12.572 -9.359 1.00 1.00 N ATOM 2220 CA ARG A 142 1.725 -12.025 -10.696 1.00 1.00 C ATOM 2221 C ARG A 142 3.199 -11.791 -10.984 1.00 1.00 C ATOM 2222 O ARG A 142 3.967 -11.453 -10.079 1.00 1.00 O ATOM 2223 CB ARG A 142 0.957 -10.705 -10.852 1.00 1.00 C ATOM 2224 CG ARG A 142 0.606 -10.385 -12.289 1.00 1.00 C ATOM 2225 CD ARG A 142 -0.225 -11.480 -12.927 1.00 1.00 C ATOM 2226 NE ARG A 142 -1.017 -10.977 -14.043 1.00 1.00 N ATOM 2227 CZ ARG A 142 -2.080 -11.605 -14.541 1.00 1.00 C ATOM 2228 NH1 ARG A 142 -2.507 -12.740 -14.001 1.00 1.00 N ATOM 2229 NH2 ARG A 142 -2.725 -11.091 -15.579 1.00 1.00 N ATOM 0 H ARG A 142 2.062 -12.068 -8.634 1.00 1.00 H new ATOM 0 HA ARG A 142 1.328 -12.749 -11.408 1.00 1.00 H new ATOM 0 HB2 ARG A 142 0.041 -10.754 -10.263 1.00 1.00 H new ATOM 0 HB3 ARG A 142 1.557 -9.893 -10.442 1.00 1.00 H new ATOM 0 HG2 ARG A 142 0.057 -9.444 -12.327 1.00 1.00 H new ATOM 0 HG3 ARG A 142 1.522 -10.243 -12.863 1.00 1.00 H new ATOM 0 HD2 ARG A 142 0.431 -12.277 -13.277 1.00 1.00 H new ATOM 0 HD3 ARG A 142 -0.887 -11.917 -12.179 1.00 1.00 H new ATOM 0 HE ARG A 142 -0.740 -10.092 -14.467 1.00 1.00 H new ATOM 0 HH11 ARG A 142 -2.020 -13.138 -13.198 1.00 1.00 H new ATOM 0 HH12 ARG A 142 -3.322 -13.214 -14.389 1.00 1.00 H new ATOM 0 HH21 ARG A 142 -2.407 -10.216 -15.995 1.00 1.00 H new ATOM 0 HH22 ARG A 142 -3.540 -11.571 -15.962 1.00 1.00 H new ATOM 2243 N THR A 143 3.603 -11.987 -12.234 1.00 1.00 N ATOM 2244 CA THR A 143 4.998 -11.808 -12.615 1.00 1.00 C ATOM 2245 C THR A 143 5.164 -10.679 -13.644 1.00 1.00 C ATOM 2246 O THR A 143 4.466 -10.628 -14.664 1.00 1.00 O ATOM 2247 CB THR A 143 5.579 -13.103 -13.162 1.00 1.00 C ATOM 2248 OG1 THR A 143 5.137 -14.206 -12.399 1.00 1.00 O ATOM 2249 CG2 THR A 143 7.098 -13.127 -13.179 1.00 1.00 C ATOM 0 H THR A 143 2.987 -12.268 -12.997 1.00 1.00 H new ATOM 0 HA THR A 143 5.546 -11.527 -11.715 1.00 1.00 H new ATOM 0 HB THR A 143 5.226 -13.166 -14.191 1.00 1.00 H new ATOM 0 HG1 THR A 143 5.518 -15.031 -12.765 1.00 1.00 H new ATOM 0 HG21 THR A 143 7.442 -14.080 -13.581 1.00 1.00 H new ATOM 0 HG22 THR A 143 7.468 -12.314 -13.804 1.00 1.00 H new ATOM 0 HG23 THR A 143 7.475 -13.004 -12.164 1.00 1.00 H new ATOM 2257 N VAL A 144 6.097 -9.778 -13.367 1.00 1.00 N ATOM 2258 CA VAL A 144 6.362 -8.643 -14.246 1.00 1.00 C ATOM 2259 C VAL A 144 7.786 -8.728 -14.795 1.00 1.00 C ATOM 2260 O VAL A 144 8.740 -8.921 -14.027 1.00 1.00 O ATOM 2261 CB VAL A 144 6.180 -7.299 -13.506 1.00 1.00 C ATOM 2262 CG1 VAL A 144 6.377 -6.126 -14.462 1.00 1.00 C ATOM 2263 CG2 VAL A 144 4.805 -7.240 -12.839 1.00 1.00 C ATOM 0 H VAL A 144 6.687 -9.810 -12.536 1.00 1.00 H new ATOM 0 HA VAL A 144 5.644 -8.685 -15.065 1.00 1.00 H new ATOM 0 HB VAL A 144 6.939 -7.226 -12.727 1.00 1.00 H new ATOM 0 HG11 VAL A 144 6.244 -5.189 -13.921 1.00 1.00 H new ATOM 0 HG12 VAL A 144 7.382 -6.164 -14.882 1.00 1.00 H new ATOM 0 HG13 VAL A 144 5.645 -6.186 -15.268 1.00 1.00 H new ATOM 0 HG21 VAL A 144 4.692 -6.287 -12.322 1.00 1.00 H new ATOM 0 HG22 VAL A 144 4.028 -7.335 -13.598 1.00 1.00 H new ATOM 0 HG23 VAL A 144 4.713 -8.055 -12.121 1.00 1.00 H new ATOM 2273 N GLU A 145 7.907 -8.614 -16.118 1.00 1.00 N ATOM 2274 CA GLU A 145 9.207 -8.705 -16.780 1.00 1.00 C ATOM 2275 C GLU A 145 9.556 -7.411 -17.505 1.00 1.00 C ATOM 2276 O GLU A 145 8.678 -6.748 -18.063 1.00 1.00 O ATOM 2277 CB GLU A 145 9.207 -9.880 -17.771 1.00 1.00 C ATOM 2278 CG GLU A 145 7.813 -10.347 -18.176 1.00 1.00 C ATOM 2279 CD GLU A 145 7.064 -9.331 -19.016 1.00 1.00 C ATOM 2280 OE1 GLU A 145 7.699 -8.696 -19.884 1.00 1.00 O ATOM 2281 OE2 GLU A 145 5.841 -9.175 -18.813 1.00 1.00 O ATOM 0 H GLU A 145 7.122 -8.459 -16.750 1.00 1.00 H new ATOM 0 HA GLU A 145 9.964 -8.874 -16.014 1.00 1.00 H new ATOM 0 HB2 GLU A 145 9.756 -9.587 -18.666 1.00 1.00 H new ATOM 0 HB3 GLU A 145 9.745 -10.717 -17.327 1.00 1.00 H new ATOM 0 HG2 GLU A 145 7.897 -11.279 -18.734 1.00 1.00 H new ATOM 0 HG3 GLU A 145 7.234 -10.564 -17.278 1.00 1.00 H new ATOM 2288 N ASP A 146 10.836 -7.065 -17.478 1.00 1.00 N ATOM 2289 CA ASP A 146 11.331 -5.850 -18.118 1.00 1.00 C ATOM 2290 C ASP A 146 12.792 -6.022 -18.529 1.00 1.00 C ATOM 2291 O ASP A 146 13.427 -7.022 -18.182 1.00 1.00 O ATOM 2292 CB ASP A 146 11.197 -4.660 -17.158 1.00 1.00 C ATOM 2293 CG ASP A 146 10.345 -3.548 -17.744 1.00 1.00 C ATOM 2294 OD1 ASP A 146 9.159 -3.806 -18.039 1.00 1.00 O ATOM 2295 OD2 ASP A 146 10.868 -2.430 -17.927 1.00 1.00 O ATOM 0 H ASP A 146 11.559 -7.615 -17.014 1.00 1.00 H new ATOM 0 HA ASP A 146 10.736 -5.659 -19.011 1.00 1.00 H new ATOM 0 HB2 ASP A 146 10.756 -4.999 -16.221 1.00 1.00 H new ATOM 0 HB3 ASP A 146 12.188 -4.271 -16.922 1.00 1.00 H new ATOM 2300 N THR A 147 13.306 -5.067 -19.277 1.00 1.00 N ATOM 2301 CA THR A 147 14.676 -5.122 -19.767 1.00 1.00 C ATOM 2302 C THR A 147 15.673 -5.113 -18.609 1.00 1.00 C ATOM 2303 O THR A 147 16.621 -5.904 -18.579 1.00 1.00 O ATOM 2304 CB THR A 147 14.956 -3.949 -20.706 1.00 1.00 C ATOM 2305 OG1 THR A 147 16.258 -4.051 -21.268 1.00 1.00 O ATOM 2306 CG2 THR A 147 14.848 -2.601 -20.041 1.00 1.00 C ATOM 0 H THR A 147 12.792 -4.234 -19.563 1.00 1.00 H new ATOM 0 HA THR A 147 14.797 -6.054 -20.319 1.00 1.00 H new ATOM 0 HB THR A 147 14.186 -4.013 -21.475 1.00 1.00 H new ATOM 0 HG1 THR A 147 16.416 -3.292 -21.867 1.00 1.00 H new ATOM 0 HG21 THR A 147 15.060 -1.818 -20.769 1.00 1.00 H new ATOM 0 HG22 THR A 147 13.840 -2.469 -19.649 1.00 1.00 H new ATOM 0 HG23 THR A 147 15.566 -2.540 -19.223 1.00 1.00 H new ATOM 2314 N ASN A 148 15.460 -4.218 -17.646 1.00 1.00 N ATOM 2315 CA ASN A 148 16.345 -4.115 -16.491 1.00 1.00 C ATOM 2316 C ASN A 148 15.890 -5.067 -15.385 1.00 1.00 C ATOM 2317 O ASN A 148 14.701 -5.097 -15.040 1.00 1.00 O ATOM 2318 CB ASN A 148 16.390 -2.679 -15.974 1.00 1.00 C ATOM 2319 CG ASN A 148 17.737 -2.315 -15.370 1.00 1.00 C ATOM 2320 OD1 ASN A 148 18.193 -2.949 -14.417 1.00 1.00 O ATOM 2321 ND2 ASN A 148 18.380 -1.293 -15.923 1.00 1.00 N ATOM 0 H ASN A 148 14.684 -3.556 -17.644 1.00 1.00 H new ATOM 0 HA ASN A 148 17.350 -4.399 -16.802 1.00 1.00 H new ATOM 0 HB2 ASN A 148 16.167 -1.995 -16.793 1.00 1.00 H new ATOM 0 HB3 ASN A 148 15.611 -2.543 -15.224 1.00 1.00 H new ATOM 0 HD21 ASN A 148 19.289 -1.005 -15.560 1.00 1.00 H new ATOM 0 HD22 ASN A 148 17.965 -0.796 -16.711 1.00 1.00 H new ATOM 2328 N PRO A 149 16.812 -5.871 -14.814 1.00 1.00 N ATOM 2329 CA PRO A 149 16.455 -6.811 -13.742 1.00 1.00 C ATOM 2330 C PRO A 149 15.802 -6.123 -12.554 1.00 1.00 C ATOM 2331 O PRO A 149 14.872 -6.657 -11.949 1.00 1.00 O ATOM 2332 CB PRO A 149 17.801 -7.408 -13.330 1.00 1.00 C ATOM 2333 CG PRO A 149 18.680 -7.229 -14.523 1.00 1.00 C ATOM 2334 CD PRO A 149 18.243 -5.931 -15.162 1.00 1.00 C ATOM 0 HA PRO A 149 15.726 -7.548 -14.080 1.00 1.00 H new ATOM 0 HB2 PRO A 149 18.210 -6.898 -12.458 1.00 1.00 H new ATOM 0 HB3 PRO A 149 17.702 -8.461 -13.066 1.00 1.00 H new ATOM 0 HG2 PRO A 149 19.730 -7.189 -14.233 1.00 1.00 H new ATOM 0 HG3 PRO A 149 18.573 -8.063 -15.217 1.00 1.00 H new ATOM 0 HD2 PRO A 149 18.793 -5.078 -14.765 1.00 1.00 H new ATOM 0 HD3 PRO A 149 18.399 -5.937 -16.241 1.00 1.00 H new ATOM 2342 N ALA A 150 16.281 -4.923 -12.234 1.00 1.00 N ATOM 2343 CA ALA A 150 15.727 -4.154 -11.123 1.00 1.00 C ATOM 2344 C ALA A 150 14.281 -3.790 -11.405 1.00 1.00 C ATOM 2345 O ALA A 150 13.433 -3.790 -10.503 1.00 1.00 O ATOM 2346 CB ALA A 150 16.562 -2.899 -10.879 1.00 1.00 C ATOM 0 H ALA A 150 17.048 -4.464 -12.726 1.00 1.00 H new ATOM 0 HA ALA A 150 15.758 -4.767 -10.222 1.00 1.00 H new ATOM 0 HB1 ALA A 150 16.138 -2.335 -10.048 1.00 1.00 H new ATOM 0 HB2 ALA A 150 17.586 -3.184 -10.638 1.00 1.00 H new ATOM 0 HB3 ALA A 150 16.559 -2.280 -11.776 1.00 1.00 H new ATOM 2352 N LEU A 151 14.001 -3.483 -12.658 1.00 1.00 N ATOM 2353 CA LEU A 151 12.653 -3.108 -13.085 1.00 1.00 C ATOM 2354 C LEU A 151 11.674 -4.269 -12.904 1.00 1.00 C ATOM 2355 O LEU A 151 10.519 -4.055 -12.522 1.00 1.00 O ATOM 2356 CB LEU A 151 12.669 -2.649 -14.542 1.00 1.00 C ATOM 2357 CG LEU A 151 13.257 -1.259 -14.770 1.00 1.00 C ATOM 2358 CD1 LEU A 151 13.262 -0.900 -16.245 1.00 1.00 C ATOM 2359 CD2 LEU A 151 12.486 -0.223 -13.958 1.00 1.00 C ATOM 0 H LEU A 151 14.692 -3.484 -13.409 1.00 1.00 H new ATOM 0 HA LEU A 151 12.316 -2.283 -12.458 1.00 1.00 H new ATOM 0 HB2 LEU A 151 13.239 -3.370 -15.129 1.00 1.00 H new ATOM 0 HB3 LEU A 151 11.648 -2.663 -14.924 1.00 1.00 H new ATOM 0 HG LEU A 151 14.293 -1.265 -14.431 1.00 1.00 H new ATOM 0 HD11 LEU A 151 13.686 0.095 -16.376 1.00 1.00 H new ATOM 0 HD12 LEU A 151 13.862 -1.625 -16.794 1.00 1.00 H new ATOM 0 HD13 LEU A 151 12.241 -0.912 -16.626 1.00 1.00 H new ATOM 0 HD21 LEU A 151 12.914 0.765 -14.128 1.00 1.00 H new ATOM 0 HD22 LEU A 151 11.441 -0.224 -14.266 1.00 1.00 H new ATOM 0 HD23 LEU A 151 12.552 -0.469 -12.898 1.00 1.00 H new ATOM 2371 N THR A 152 12.141 -5.490 -13.184 1.00 1.00 N ATOM 2372 CA THR A 152 11.297 -6.666 -13.049 1.00 1.00 C ATOM 2373 C THR A 152 10.919 -6.887 -11.585 1.00 1.00 C ATOM 2374 O THR A 152 11.758 -6.780 -10.697 1.00 1.00 O ATOM 2375 CB THR A 152 12.027 -7.898 -13.590 1.00 1.00 C ATOM 2376 OG1 THR A 152 11.745 -8.071 -14.965 1.00 1.00 O ATOM 2377 CG2 THR A 152 11.646 -9.166 -12.867 1.00 1.00 C ATOM 0 H THR A 152 13.091 -5.682 -13.502 1.00 1.00 H new ATOM 0 HA THR A 152 10.385 -6.508 -13.625 1.00 1.00 H new ATOM 0 HB THR A 152 13.090 -7.717 -13.430 1.00 1.00 H new ATOM 0 HG1 THR A 152 12.219 -8.861 -15.299 1.00 1.00 H new ATOM 0 HG21 THR A 152 12.194 -10.006 -13.293 1.00 1.00 H new ATOM 0 HG22 THR A 152 11.893 -9.070 -11.810 1.00 1.00 H new ATOM 0 HG23 THR A 152 10.575 -9.339 -12.975 1.00 1.00 H new ATOM 2385 N HIS A 153 9.641 -7.179 -11.343 1.00 1.00 N ATOM 2386 CA HIS A 153 9.157 -7.394 -9.977 1.00 1.00 C ATOM 2387 C HIS A 153 7.995 -8.377 -9.958 1.00 1.00 C ATOM 2388 O HIS A 153 7.375 -8.635 -10.988 1.00 1.00 O ATOM 2389 CB HIS A 153 8.732 -6.058 -9.346 1.00 1.00 C ATOM 2390 CG HIS A 153 7.937 -5.180 -10.269 1.00 1.00 C ATOM 2391 ND1 HIS A 153 8.159 -3.920 -10.713 1.00 1.00 N flip ATOM 2392 CD2 HIS A 153 6.762 -5.592 -10.860 1.00 1.00 C flip ATOM 2393 CE1 HIS A 153 7.124 -3.599 -11.555 1.00 1.00 C flip ATOM 2394 NE2 HIS A 153 6.295 -4.624 -11.628 1.00 1.00 N flip ATOM 0 H HIS A 153 8.928 -7.272 -12.066 1.00 1.00 H new ATOM 0 HA HIS A 153 9.972 -7.819 -9.392 1.00 1.00 H new ATOM 0 HB2 HIS A 153 8.141 -6.260 -8.453 1.00 1.00 H new ATOM 0 HB3 HIS A 153 9.623 -5.519 -9.024 1.00 1.00 H new ATOM 0 HD1 HIS A 153 8.948 -3.322 -10.468 1.00 1.00 H new ATOM 0 HD2 HIS A 153 6.296 -6.556 -10.717 1.00 1.00 H new ATOM 0 HE1 HIS A 153 7.007 -2.659 -12.074 1.00 1.00 H new ATOM 2403 N THR A 154 7.699 -8.908 -8.783 1.00 1.00 N ATOM 2404 CA THR A 154 6.600 -9.849 -8.634 1.00 1.00 C ATOM 2405 C THR A 154 5.550 -9.313 -7.662 1.00 1.00 C ATOM 2406 O THR A 154 5.879 -8.902 -6.548 1.00 1.00 O ATOM 2407 CB THR A 154 7.122 -11.202 -8.146 1.00 1.00 C ATOM 2408 OG1 THR A 154 8.508 -11.147 -7.894 1.00 1.00 O ATOM 2409 CG2 THR A 154 6.894 -12.328 -9.138 1.00 1.00 C ATOM 0 H THR A 154 8.203 -8.704 -7.920 1.00 1.00 H new ATOM 0 HA THR A 154 6.131 -9.979 -9.610 1.00 1.00 H new ATOM 0 HB THR A 154 6.558 -11.410 -7.236 1.00 1.00 H new ATOM 0 HG1 THR A 154 8.819 -12.022 -7.582 1.00 1.00 H new ATOM 0 HG21 THR A 154 7.288 -13.258 -8.729 1.00 1.00 H new ATOM 0 HG22 THR A 154 5.826 -12.437 -9.325 1.00 1.00 H new ATOM 0 HG23 THR A 154 7.405 -12.098 -10.073 1.00 1.00 H new ATOM 2417 N TYR A 155 4.293 -9.310 -8.094 1.00 1.00 N ATOM 2418 CA TYR A 155 3.195 -8.812 -7.262 1.00 1.00 C ATOM 2419 C TYR A 155 2.359 -9.961 -6.728 1.00 1.00 C ATOM 2420 O TYR A 155 1.938 -10.844 -7.482 1.00 1.00 O ATOM 2421 CB TYR A 155 2.318 -7.850 -8.062 1.00 1.00 C ATOM 2422 CG TYR A 155 1.500 -6.919 -7.190 1.00 1.00 C ATOM 2423 CD1 TYR A 155 0.262 -7.317 -6.702 1.00 1.00 C ATOM 2424 CD2 TYR A 155 1.964 -5.654 -6.852 1.00 1.00 C ATOM 2425 CE1 TYR A 155 -0.492 -6.480 -5.901 1.00 1.00 C ATOM 2426 CE2 TYR A 155 1.217 -4.811 -6.051 1.00 1.00 C ATOM 2427 CZ TYR A 155 -0.011 -5.228 -5.579 1.00 1.00 C ATOM 2428 OH TYR A 155 -0.754 -4.392 -4.771 1.00 1.00 O ATOM 0 H TYR A 155 4.006 -9.646 -9.014 1.00 1.00 H new ATOM 0 HA TYR A 155 3.625 -8.277 -6.415 1.00 1.00 H new ATOM 0 HB2 TYR A 155 2.950 -7.256 -8.722 1.00 1.00 H new ATOM 0 HB3 TYR A 155 1.645 -8.426 -8.698 1.00 1.00 H new ATOM 0 HD1 TYR A 155 -0.118 -8.297 -6.952 1.00 1.00 H new ATOM 0 HD2 TYR A 155 2.924 -5.324 -7.221 1.00 1.00 H new ATOM 0 HE1 TYR A 155 -1.453 -6.805 -5.529 1.00 1.00 H new ATOM 0 HE2 TYR A 155 1.592 -3.831 -5.796 1.00 1.00 H new ATOM 0 HH TYR A 155 -0.272 -3.549 -4.641 1.00 1.00 H new ATOM 2438 N GLU A 156 2.110 -9.960 -5.428 1.00 1.00 N ATOM 2439 CA GLU A 156 1.322 -11.013 -4.804 1.00 1.00 C ATOM 2440 C GLU A 156 0.308 -10.440 -3.824 1.00 1.00 C ATOM 2441 O GLU A 156 0.551 -9.424 -3.171 1.00 1.00 O ATOM 2442 CB GLU A 156 2.223 -12.021 -4.092 1.00 1.00 C ATOM 2443 CG GLU A 156 3.561 -12.260 -4.784 1.00 1.00 C ATOM 2444 CD GLU A 156 4.472 -13.186 -3.994 1.00 1.00 C ATOM 2445 OE1 GLU A 156 4.414 -13.157 -2.747 1.00 1.00 O ATOM 2446 OE2 GLU A 156 5.244 -13.936 -4.627 1.00 1.00 O ATOM 0 H GLU A 156 2.442 -9.242 -4.784 1.00 1.00 H new ATOM 0 HA GLU A 156 0.780 -11.526 -5.598 1.00 1.00 H new ATOM 0 HB2 GLU A 156 2.409 -11.672 -3.076 1.00 1.00 H new ATOM 0 HB3 GLU A 156 1.694 -12.970 -4.010 1.00 1.00 H new ATOM 0 HG2 GLU A 156 3.384 -12.687 -5.771 1.00 1.00 H new ATOM 0 HG3 GLU A 156 4.063 -11.304 -4.935 1.00 1.00 H new ATOM 2453 N VAL A 157 -0.833 -11.108 -3.715 1.00 1.00 N ATOM 2454 CA VAL A 157 -1.878 -10.682 -2.810 1.00 1.00 C ATOM 2455 C VAL A 157 -2.131 -11.749 -1.762 1.00 1.00 C ATOM 2456 O VAL A 157 -2.358 -12.914 -2.094 1.00 1.00 O ATOM 2457 CB VAL A 157 -3.193 -10.398 -3.552 1.00 1.00 C ATOM 2458 CG1 VAL A 157 -3.368 -11.341 -4.732 1.00 1.00 C ATOM 2459 CG2 VAL A 157 -4.368 -10.492 -2.602 1.00 1.00 C ATOM 0 H VAL A 157 -1.053 -11.950 -4.247 1.00 1.00 H new ATOM 0 HA VAL A 157 -1.538 -9.761 -2.337 1.00 1.00 H new ATOM 0 HB VAL A 157 -3.152 -9.382 -3.944 1.00 1.00 H new ATOM 0 HG11 VAL A 157 -4.307 -11.118 -5.240 1.00 1.00 H new ATOM 0 HG12 VAL A 157 -2.539 -11.211 -5.428 1.00 1.00 H new ATOM 0 HG13 VAL A 157 -3.384 -12.371 -4.375 1.00 1.00 H new ATOM 0 HG21 VAL A 157 -5.291 -10.288 -3.144 1.00 1.00 H new ATOM 0 HG22 VAL A 157 -4.412 -11.494 -2.175 1.00 1.00 H new ATOM 0 HG23 VAL A 157 -4.248 -9.762 -1.802 1.00 1.00 H new ATOM 2469 N TRP A 158 -2.096 -11.349 -0.497 1.00 1.00 N ATOM 2470 CA TRP A 158 -2.310 -12.271 0.607 1.00 1.00 C ATOM 2471 C TRP A 158 -3.610 -11.996 1.334 1.00 1.00 C ATOM 2472 O TRP A 158 -3.979 -10.845 1.553 1.00 1.00 O ATOM 2473 CB TRP A 158 -1.148 -12.205 1.602 1.00 1.00 C ATOM 2474 CG TRP A 158 0.166 -12.651 1.026 1.00 1.00 C ATOM 2475 CD1 TRP A 158 0.750 -12.215 -0.128 1.00 1.00 C ATOM 2476 CD2 TRP A 158 1.055 -13.628 1.582 1.00 1.00 C ATOM 2477 NE1 TRP A 158 1.947 -12.862 -0.325 1.00 1.00 N ATOM 2478 CE2 TRP A 158 2.157 -13.734 0.711 1.00 1.00 C ATOM 2479 CE3 TRP A 158 1.027 -14.422 2.732 1.00 1.00 C ATOM 2480 CZ2 TRP A 158 3.218 -14.602 0.955 1.00 1.00 C ATOM 2481 CZ3 TRP A 158 2.081 -15.284 2.972 1.00 1.00 C ATOM 2482 CH2 TRP A 158 3.163 -15.367 2.087 1.00 1.00 C ATOM 0 H TRP A 158 -1.920 -10.386 -0.211 1.00 1.00 H new ATOM 0 HA TRP A 158 -2.366 -13.270 0.176 1.00 1.00 H new ATOM 0 HB2 TRP A 158 -1.048 -11.181 1.963 1.00 1.00 H new ATOM 0 HB3 TRP A 158 -1.385 -12.826 2.466 1.00 1.00 H new ATOM 0 HD1 TRP A 158 0.333 -11.470 -0.790 1.00 1.00 H new ATOM 0 HE1 TRP A 158 2.577 -12.717 -1.114 1.00 1.00 H new ATOM 0 HE3 TRP A 158 0.197 -14.363 3.421 1.00 1.00 H new ATOM 0 HZ2 TRP A 158 4.054 -14.669 0.275 1.00 1.00 H new ATOM 0 HZ3 TRP A 158 2.070 -15.904 3.857 1.00 1.00 H new ATOM 0 HH2 TRP A 158 3.971 -16.050 2.303 1.00 1.00 H new ATOM 2493 N GLN A 159 -4.285 -13.071 1.737 1.00 1.00 N ATOM 2494 CA GLN A 159 -5.538 -12.976 2.476 1.00 1.00 C ATOM 2495 C GLN A 159 -5.588 -14.043 3.554 1.00 1.00 C ATOM 2496 O GLN A 159 -4.935 -15.072 3.458 1.00 1.00 O ATOM 2497 CB GLN A 159 -6.724 -13.127 1.527 1.00 1.00 C ATOM 2498 CG GLN A 159 -6.864 -11.960 0.555 1.00 1.00 C ATOM 2499 CD GLN A 159 -8.296 -11.685 0.167 1.00 1.00 C ATOM 2500 OE1 GLN A 159 -9.221 -12.050 0.891 1.00 1.00 O ATOM 2501 NE2 GLN A 159 -8.490 -11.007 -0.958 1.00 1.00 N ATOM 0 H GLN A 159 -3.979 -14.028 1.560 1.00 1.00 H new ATOM 0 HA GLN A 159 -5.594 -11.996 2.949 1.00 1.00 H new ATOM 0 HB2 GLN A 159 -6.614 -14.052 0.961 1.00 1.00 H new ATOM 0 HB3 GLN A 159 -7.640 -13.218 2.111 1.00 1.00 H new ATOM 0 HG2 GLN A 159 -6.437 -11.065 1.007 1.00 1.00 H new ATOM 0 HG3 GLN A 159 -6.284 -12.171 -0.343 1.00 1.00 H new ATOM 0 HE21 GLN A 159 -7.692 -10.725 -1.527 1.00 1.00 H new ATOM 0 HE22 GLN A 159 -9.437 -10.768 -1.253 1.00 1.00 H new ATOM 2510 N LYS A 160 -6.380 -13.796 4.589 1.00 1.00 N ATOM 2511 CA LYS A 160 -6.510 -14.750 5.689 1.00 1.00 C ATOM 2512 C LYS A 160 -7.179 -16.036 5.210 1.00 1.00 C ATOM 2513 O LYS A 160 -8.169 -15.987 4.487 1.00 1.00 O ATOM 2514 CB LYS A 160 -7.325 -14.136 6.824 1.00 1.00 C ATOM 2515 CG LYS A 160 -6.689 -14.345 8.188 1.00 1.00 C ATOM 2516 CD LYS A 160 -7.426 -15.405 8.989 1.00 1.00 C ATOM 2517 CE LYS A 160 -6.466 -16.289 9.772 1.00 1.00 C ATOM 2518 NZ LYS A 160 -6.027 -15.649 11.043 1.00 1.00 N ATOM 0 H LYS A 160 -6.940 -12.950 4.693 1.00 1.00 H new ATOM 0 HA LYS A 160 -5.511 -14.990 6.054 1.00 1.00 H new ATOM 0 HB2 LYS A 160 -7.443 -13.068 6.643 1.00 1.00 H new ATOM 0 HB3 LYS A 160 -8.324 -14.571 6.824 1.00 1.00 H new ATOM 0 HG2 LYS A 160 -5.647 -14.640 8.064 1.00 1.00 H new ATOM 0 HG3 LYS A 160 -6.690 -13.405 8.739 1.00 1.00 H new ATOM 0 HD2 LYS A 160 -8.120 -14.923 9.677 1.00 1.00 H new ATOM 0 HD3 LYS A 160 -8.021 -16.022 8.315 1.00 1.00 H new ATOM 0 HE2 LYS A 160 -6.949 -17.241 9.994 1.00 1.00 H new ATOM 0 HE3 LYS A 160 -5.593 -16.510 9.157 1.00 1.00 H new ATOM 0 HZ1 LYS A 160 -5.375 -16.285 11.545 1.00 1.00 H new ATOM 0 HZ2 LYS A 160 -5.543 -14.753 10.831 1.00 1.00 H new ATOM 0 HZ3 LYS A 160 -6.856 -15.462 11.642 1.00 1.00 H new ATOM 2532 N LYS A 161 -6.646 -17.181 5.621 1.00 1.00 N ATOM 2533 CA LYS A 161 -7.220 -18.459 5.216 1.00 1.00 C ATOM 2534 C LYS A 161 -8.592 -18.639 5.862 1.00 1.00 C ATOM 2535 O LYS A 161 -8.776 -18.380 7.053 1.00 1.00 O ATOM 2536 CB LYS A 161 -6.292 -19.606 5.599 1.00 1.00 C ATOM 2537 CG LYS A 161 -5.912 -19.605 7.071 1.00 1.00 C ATOM 2538 CD LYS A 161 -5.833 -21.021 7.622 1.00 1.00 C ATOM 2539 CE LYS A 161 -5.202 -21.046 9.003 1.00 1.00 C ATOM 2540 NZ LYS A 161 -5.672 -22.215 9.802 1.00 1.00 N ATOM 0 H LYS A 161 -5.828 -17.251 6.226 1.00 1.00 H new ATOM 0 HA LYS A 161 -7.338 -18.466 4.132 1.00 1.00 H new ATOM 0 HB2 LYS A 161 -6.776 -20.552 5.356 1.00 1.00 H new ATOM 0 HB3 LYS A 161 -5.385 -19.548 4.997 1.00 1.00 H new ATOM 0 HG2 LYS A 161 -4.951 -19.108 7.200 1.00 1.00 H new ATOM 0 HG3 LYS A 161 -6.646 -19.032 7.638 1.00 1.00 H new ATOM 0 HD2 LYS A 161 -6.834 -21.450 7.670 1.00 1.00 H new ATOM 0 HD3 LYS A 161 -5.251 -21.645 6.943 1.00 1.00 H new ATOM 0 HE2 LYS A 161 -4.117 -21.083 8.907 1.00 1.00 H new ATOM 0 HE3 LYS A 161 -5.444 -20.123 9.531 1.00 1.00 H new ATOM 0 HZ1 LYS A 161 -5.220 -22.199 10.739 1.00 1.00 H new ATOM 0 HZ2 LYS A 161 -6.705 -22.166 9.915 1.00 1.00 H new ATOM 0 HZ3 LYS A 161 -5.419 -23.096 9.310 1.00 1.00 H new ATOM 2554 N ALA A 162 -9.561 -19.077 5.071 1.00 1.00 N ATOM 2555 CA ALA A 162 -10.918 -19.291 5.563 1.00 1.00 C ATOM 2556 C ALA A 162 -11.490 -18.024 6.188 1.00 1.00 C ATOM 2557 O ALA A 162 -12.008 -18.102 7.322 1.00 1.00 O ATOM 2558 CB ALA A 162 -10.936 -20.424 6.567 1.00 1.00 C ATOM 2559 OXT ALA A 162 -11.417 -16.960 5.532 1.00 1.00 O ATOM 0 H ALA A 162 -9.434 -19.292 4.082 1.00 1.00 H new ATOM 0 HA ALA A 162 -11.545 -19.556 4.712 1.00 1.00 H new ATOM 0 HB1 ALA A 162 -11.954 -20.575 6.927 1.00 1.00 H new ATOM 0 HB2 ALA A 162 -10.581 -21.338 6.091 1.00 1.00 H new ATOM 0 HB3 ALA A 162 -10.287 -20.176 7.407 1.00 1.00 H new TER 2565 ALA A 162 HETATM 2566 PA NDP A 170 3.920 5.493 11.440 1.00 1.00 P HETATM 2567 O1A NDP A 170 4.311 5.667 12.852 1.00 1.00 O HETATM 2568 O2A NDP A 170 3.303 4.207 11.055 1.00 1.00 O HETATM 2569 O5B NDP A 170 3.070 6.726 10.909 1.00 1.00 O HETATM 2570 C5B NDP A 170 1.677 6.873 11.267 1.00 1.00 C HETATM 2571 C4B NDP A 170 1.380 8.307 11.646 1.00 1.00 C HETATM 2572 O4B NDP A 170 -0.064 8.512 11.657 1.00 1.00 O HETATM 2573 C3B NDP A 170 1.883 8.737 13.022 1.00 1.00 C HETATM 2574 O3B NDP A 170 3.143 9.399 12.910 1.00 1.00 O HETATM 2575 C2B NDP A 170 0.809 9.712 13.487 1.00 1.00 C HETATM 2576 O2B NDP A 170 0.992 11.024 12.997 1.00 1.00 O HETATM 2577 C1B NDP A 170 -0.445 9.080 12.894 1.00 1.00 C HETATM 2578 N9A NDP A 170 -1.005 8.018 13.727 1.00 1.00 N HETATM 2579 C8A NDP A 170 -0.508 6.753 13.938 1.00 1.00 C HETATM 2580 N7A NDP A 170 -1.239 6.025 14.748 1.00 1.00 N HETATM 2581 C5A NDP A 170 -2.289 6.858 15.088 1.00 1.00 C HETATM 2582 C6A NDP A 170 -3.409 6.671 15.908 1.00 1.00 C HETATM 2583 N6A NDP A 170 -3.667 5.536 16.567 1.00 1.00 N HETATM 2584 N1A NDP A 170 -4.270 7.702 16.035 1.00 1.00 N HETATM 2585 C2A NDP A 170 -4.014 8.839 15.379 1.00 1.00 C HETATM 2586 N3A NDP A 170 -2.997 9.133 14.576 1.00 1.00 N HETATM 2587 C4A NDP A 170 -2.161 8.088 14.470 1.00 1.00 C HETATM 2588 O3 NDP A 170 5.257 5.725 10.512 1.00 1.00 O HETATM 2589 PN NDP A 170 6.870 5.424 10.696 1.00 1.00 P HETATM 2590 O1N NDP A 170 7.433 6.436 11.612 1.00 1.00 O HETATM 2591 O2N NDP A 170 7.033 4.006 11.065 1.00 1.00 O HETATM 2592 O5D NDP A 170 7.312 5.688 9.193 1.00 1.00 O HETATM 2593 C5D NDP A 170 6.393 5.489 8.094 1.00 1.00 C HETATM 2594 C4D NDP A 170 7.136 5.531 6.779 1.00 1.00 C HETATM 2595 O4D NDP A 170 7.548 4.185 6.423 1.00 1.00 O HETATM 2596 C3D NDP A 170 6.349 6.065 5.594 1.00 1.00 C HETATM 2597 O3D NDP A 170 6.581 7.468 5.437 1.00 1.00 O HETATM 2598 C2D NDP A 170 6.933 5.297 4.415 1.00 1.00 C HETATM 2599 O2D NDP A 170 8.080 5.915 3.824 1.00 1.00 O HETATM 2600 C1D NDP A 170 7.294 3.959 5.049 1.00 1.00 C HETATM 2601 N1N NDP A 170 6.251 2.940 4.930 1.00 1.00 N HETATM 2602 C2N NDP A 170 6.355 1.653 4.665 1.00 1.00 C HETATM 2603 C3N NDP A 170 5.396 0.797 4.578 1.00 1.00 C HETATM 2604 C7N NDP A 170 5.926 -0.502 4.276 1.00 1.00 C HETATM 2605 O7N NDP A 170 6.000 -1.090 5.439 1.00 1.00 O HETATM 2606 N7N NDP A 170 6.273 -1.058 3.097 1.00 1.00 N HETATM 2607 C4N NDP A 170 3.995 1.291 4.807 1.00 1.00 C HETATM 2608 C5N NDP A 170 3.809 2.679 5.100 1.00 1.00 C HETATM 2609 C6N NDP A 170 4.864 3.566 5.186 1.00 1.00 C HETATM 2610 P2B NDP A 170 1.491 12.381 13.834 1.00 1.00 P HETATM 2611 O1X NDP A 170 3.039 12.257 13.513 1.00 1.00 O HETATM 2612 O2X NDP A 170 0.874 13.480 12.967 1.00 1.00 O HETATM 2613 O3X NDP A 170 1.231 11.937 15.273 1.00 1.00 O HETATM 0 HO3N NDP A 170 6.469 7.917 6.301 1.00 1.00 H new HETATM 0 HO3A NDP A 170 3.009 10.368 12.962 1.00 1.00 H new HETATM 0 HO2N NDP A 170 8.399 5.366 3.077 1.00 1.00 H new HETATM 0 H72N NDP A 170 6.639 -2.010 3.070 1.00 1.00 H new HETATM 0 H71N NDP A 170 6.169 -0.527 2.232 1.00 1.00 H new HETATM 0 H62A NDP A 170 -4.501 5.463 17.149 1.00 1.00 H new HETATM 0 H61A NDP A 170 -3.030 4.744 16.487 1.00 1.00 H new HETATM 0 H52N NDP A 170 5.886 4.530 8.203 1.00 1.00 H new HETATM 0 H52A NDP A 170 1.046 6.573 10.430 1.00 1.00 H new HETATM 0 H51N NDP A 170 5.623 6.260 8.110 1.00 1.00 H new HETATM 0 H51A NDP A 170 1.437 6.212 12.100 1.00 1.00 H new HETATM 0 H42N NDP A 170 3.409 1.057 3.918 1.00 1.00 H new HETATM 0 H41N NDP A 170 3.569 0.717 5.630 1.00 1.00 H new HETATM 0 H8A NDP A 170 0.409 6.389 13.475 1.00 1.00 H new HETATM 0 H6N NDP A 170 4.728 4.623 5.416 1.00 1.00 H new HETATM 0 H5N NDP A 170 2.797 3.050 5.261 1.00 1.00 H new HETATM 0 H4D NDP A 170 7.963 6.219 6.955 1.00 1.00 H new HETATM 0 H4B NDP A 170 1.906 8.903 10.900 1.00 1.00 H new HETATM 0 H3D NDP A 170 5.272 5.938 5.699 1.00 1.00 H new HETATM 0 H3B NDP A 170 2.037 7.903 13.706 1.00 1.00 H new HETATM 0 H2N NDP A 170 7.363 1.271 4.502 1.00 1.00 H new HETATM 0 H2D NDP A 170 6.231 5.235 3.583 1.00 1.00 H new HETATM 0 H2B NDP A 170 0.797 9.843 14.569 1.00 1.00 H new HETATM 0 H2A NDP A 170 -4.742 9.637 15.523 1.00 1.00 H new HETATM 0 H1D NDP A 170 8.163 3.574 4.515 1.00 1.00 H new HETATM 0 H1B NDP A 170 -1.210 9.851 12.803 1.00 1.00 H new