USER MOD reduce.3.24.130724 H: found=0, std=0, add=1202, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1199 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 113 HIS : no HD1:sc= -0.279 X(o=2,f=2.2) USER MOD Set 1.2: A 116 HIS : no HE2:sc= 0.538 K(o=2,f=-4.7!) USER MOD Set 1.3: A 117 SER OG : rot 83:sc= 1.76 USER MOD Set 2.1: A 92 SER OG : rot 84:sc= 0.0841 USER MOD Set 2.2: A 93 HIS : no HE2:sc= 1.28 K(o=1.4,f=-4.8!) USER MOD Set 3.1: A 26 GLN : amide:sc= 2.48 K(o=3.5,f=-9.7!) USER MOD Set 3.2: A 62 LYS NZ :NH3+ 156:sc= 1 (180deg=-0.729) USER MOD Set 4.1: A 24 HIS : +bothHN:sc= -2.5! C(o=-4.4!,f=-18!) USER MOD Set 4.2: A 119 HIS : no HE2:sc= -1.9 K(o=-4.4,f=-16!) USER MOD Set 5.1: A 8 GLN : amide:sc= 0.562 K(o=2.4,f=-2.6) USER MOD Set 5.2: A 79 LYS NZ :NH3+ 150:sc= 1.8 (180deg=0.455) USER MOD Single : A 3 SER OG : rot 84:sc= 0.954 USER MOD Single : A 12 HIS : no HD1:sc= -0.36 X(o=-0.36,f=-0.015) USER MOD Single : A 16 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0597) USER MOD Single : A 34 LYS NZ :NH3+ 161:sc= 0.431 (180deg=-0.548) USER MOD Single : A 35 SER OG : rot 77:sc= 1.16 USER MOD Single : A 36 HIS : no HD1:sc= 0.0382 X(o=0.038,f=-0.28) USER MOD Single : A 39 THR OG1 : rot 60:sc= 0.554 USER MOD Single : A 42 LYS NZ :NH3+ -157:sc= 2.05 (180deg=0.894) USER MOD Single : A 47 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0114) USER MOD Single : A 48 HIS : no HE2:sc= 0.92 K(o=0.92,f=-2.9!) USER MOD Single : A 50 LYS NZ :NH3+ 164:sc= 0.577 (180deg=0.349) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0.572 USER MOD Single : A 55 MET CE :methyl -173:sc= -0.014 (180deg=-0.121) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 SER OG : rot 180:sc= 0.464 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 HIS : no HD1:sc= -0.467 X(o=-0.47,f=-0.63!) USER MOD Single : A 67 THR OG1 : rot 81:sc= 1.06 USER MOD Single : A 70 THR OG1 : rot 85:sc= 1.22 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 LYS NZ :NH3+ -172:sc= 0.57 (180deg=0.54) USER MOD Single : A 81 HIS : no HD1:sc=-0.00175 X(o=-0.0018,f=-0.00077) USER MOD Single : A 82 HIS : no HD1:sc= -0.7 K(o=-0.7,f=-3) USER MOD Single : A 87 LYS NZ :NH3+ -173:sc= -0.186 (180deg=-0.225) USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 THR OG1 : rot -63:sc= 1.01 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 HIS : no HD1:sc= -0.111 X(o=-0.11,f=-0.52) USER MOD Single : A 98 LYS NZ :NH3+ 140:sc= 0.0872 (180deg=-0.6) USER MOD Single : A 102 LYS NZ :NH3+ 172:sc= 0.309 (180deg=0.188) USER MOD Single : A 103 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 59:sc= 1.87 USER MOD Single : A 128 GLN : amide:sc= 0.0852 X(o=0.085,f=0) USER MOD Single : A 131 MET CE :methyl -174:sc= -0.689 (180deg=-0.719) USER MOD Single : A 132 ASN : amide:sc= 0.806 K(o=0.81,f=-4.2!) USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0561) USER MOD Single : A 145 LYS NZ :NH3+ 174:sc=-0.000291 (180deg=-0.0417) USER MOD Single : A 146 TYR OH : rot -171:sc= 1.23 USER MOD Single : A 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 19 N LEU A 2 19.372 -1.997 1.946 1.00 0.00 N ATOM 20 CA LEU A 2 18.770 -3.081 1.199 1.00 0.00 C ATOM 21 C LEU A 2 19.733 -3.563 0.127 1.00 0.00 C ATOM 22 O LEU A 2 19.682 -3.110 -1.015 1.00 0.00 O ATOM 23 CB LEU A 2 17.440 -2.666 0.558 1.00 0.00 C ATOM 24 CG LEU A 2 16.258 -2.649 1.530 1.00 0.00 C ATOM 25 CD1 LEU A 2 15.046 -2.058 0.809 1.00 0.00 C ATOM 26 CD2 LEU A 2 15.884 -4.065 1.984 1.00 0.00 C ATOM 0 HA LEU A 2 18.560 -3.890 1.899 1.00 0.00 H new ATOM 0 HB2 LEU A 2 17.553 -1.673 0.122 1.00 0.00 H new ATOM 0 HB3 LEU A 2 17.214 -3.350 -0.260 1.00 0.00 H new ATOM 0 HG LEU A 2 16.542 -2.060 2.402 1.00 0.00 H new ATOM 0 HD11 LEU A 2 14.193 -2.038 1.487 1.00 0.00 H new ATOM 0 HD12 LEU A 2 15.275 -1.043 0.484 1.00 0.00 H new ATOM 0 HD13 LEU A 2 14.805 -2.671 -0.059 1.00 0.00 H new ATOM 0 HD21 LEU A 2 15.041 -4.015 2.673 1.00 0.00 H new ATOM 0 HD22 LEU A 2 15.608 -4.664 1.116 1.00 0.00 H new ATOM 0 HD23 LEU A 2 16.736 -4.523 2.486 1.00 0.00 H new ATOM 38 N SER A 3 20.604 -4.496 0.497 1.00 0.00 N ATOM 39 CA SER A 3 21.523 -5.106 -0.450 1.00 0.00 C ATOM 40 C SER A 3 20.723 -6.049 -1.358 1.00 0.00 C ATOM 41 O SER A 3 19.565 -6.362 -1.068 1.00 0.00 O ATOM 42 CB SER A 3 22.652 -5.842 0.287 1.00 0.00 C ATOM 43 OG SER A 3 22.997 -5.180 1.489 1.00 0.00 O ATOM 0 H SER A 3 20.691 -4.846 1.451 1.00 0.00 H new ATOM 0 HA SER A 3 21.999 -4.340 -1.063 1.00 0.00 H new ATOM 0 HB2 SER A 3 22.340 -6.863 0.508 1.00 0.00 H new ATOM 0 HB3 SER A 3 23.528 -5.909 -0.358 1.00 0.00 H new ATOM 0 HG SER A 3 22.383 -5.455 2.202 1.00 0.00 H new ATOM 49 N GLU A 4 21.331 -6.493 -2.464 1.00 0.00 N ATOM 50 CA GLU A 4 20.672 -7.384 -3.410 1.00 0.00 C ATOM 51 C GLU A 4 20.008 -8.579 -2.724 1.00 0.00 C ATOM 52 O GLU A 4 18.880 -8.911 -3.062 1.00 0.00 O ATOM 53 CB GLU A 4 21.640 -7.822 -4.518 1.00 0.00 C ATOM 54 CG GLU A 4 22.026 -6.655 -5.442 1.00 0.00 C ATOM 55 CD GLU A 4 20.815 -6.050 -6.150 1.00 0.00 C ATOM 56 OE1 GLU A 4 20.065 -6.838 -6.767 1.00 0.00 O ATOM 57 OE2 GLU A 4 20.648 -4.817 -6.045 1.00 0.00 O ATOM 0 H GLU A 4 22.286 -6.244 -2.722 1.00 0.00 H new ATOM 0 HA GLU A 4 19.866 -6.818 -3.877 1.00 0.00 H new ATOM 0 HB2 GLU A 4 22.540 -8.241 -4.068 1.00 0.00 H new ATOM 0 HB3 GLU A 4 21.180 -8.615 -5.108 1.00 0.00 H new ATOM 0 HG2 GLU A 4 22.526 -5.882 -4.858 1.00 0.00 H new ATOM 0 HG3 GLU A 4 22.741 -7.005 -6.186 1.00 0.00 H new ATOM 64 N GLY A 5 20.673 -9.209 -1.751 1.00 0.00 N ATOM 65 CA GLY A 5 20.083 -10.324 -1.018 1.00 0.00 C ATOM 66 C GLY A 5 18.710 -9.935 -0.461 1.00 0.00 C ATOM 67 O GLY A 5 17.700 -10.572 -0.758 1.00 0.00 O ATOM 0 H GLY A 5 21.618 -8.964 -1.456 1.00 0.00 H new ATOM 0 HA2 GLY A 5 19.983 -11.187 -1.676 1.00 0.00 H new ATOM 0 HA3 GLY A 5 20.742 -10.620 -0.202 1.00 0.00 H new ATOM 71 N GLU A 6 18.674 -8.860 0.329 1.00 0.00 N ATOM 72 CA GLU A 6 17.455 -8.333 0.918 1.00 0.00 C ATOM 73 C GLU A 6 16.422 -8.038 -0.178 1.00 0.00 C ATOM 74 O GLU A 6 15.239 -8.341 -0.006 1.00 0.00 O ATOM 75 CB GLU A 6 17.755 -7.089 1.761 1.00 0.00 C ATOM 76 CG GLU A 6 18.723 -7.325 2.933 1.00 0.00 C ATOM 77 CD GLU A 6 20.185 -7.153 2.535 1.00 0.00 C ATOM 78 OE1 GLU A 6 20.733 -8.107 1.943 1.00 0.00 O ATOM 79 OE2 GLU A 6 20.727 -6.054 2.793 1.00 0.00 O ATOM 0 H GLU A 6 19.508 -8.327 0.578 1.00 0.00 H new ATOM 0 HA GLU A 6 17.031 -9.084 1.585 1.00 0.00 H new ATOM 0 HB2 GLU A 6 18.172 -6.319 1.112 1.00 0.00 H new ATOM 0 HB3 GLU A 6 16.817 -6.699 2.155 1.00 0.00 H new ATOM 0 HG2 GLU A 6 18.486 -6.631 3.739 1.00 0.00 H new ATOM 0 HG3 GLU A 6 18.574 -8.331 3.325 1.00 0.00 H new ATOM 86 N TRP A 7 16.852 -7.456 -1.304 1.00 0.00 N ATOM 87 CA TRP A 7 15.934 -7.252 -2.416 1.00 0.00 C ATOM 88 C TRP A 7 15.394 -8.585 -2.944 1.00 0.00 C ATOM 89 O TRP A 7 14.203 -8.691 -3.220 1.00 0.00 O ATOM 90 CB TRP A 7 16.529 -6.370 -3.522 1.00 0.00 C ATOM 91 CG TRP A 7 16.501 -4.893 -3.252 1.00 0.00 C ATOM 92 CD1 TRP A 7 17.571 -4.071 -3.226 1.00 0.00 C ATOM 93 CD2 TRP A 7 15.341 -4.037 -3.011 1.00 0.00 C ATOM 94 NE1 TRP A 7 17.163 -2.784 -2.958 1.00 0.00 N ATOM 95 CE2 TRP A 7 15.798 -2.704 -2.805 1.00 0.00 C ATOM 96 CE3 TRP A 7 13.947 -4.247 -2.958 1.00 0.00 C ATOM 97 CZ2 TRP A 7 14.922 -1.639 -2.539 1.00 0.00 C ATOM 98 CZ3 TRP A 7 13.061 -3.191 -2.684 1.00 0.00 C ATOM 99 CH2 TRP A 7 13.543 -1.889 -2.473 1.00 0.00 C ATOM 0 H TRP A 7 17.805 -7.128 -1.462 1.00 0.00 H new ATOM 0 HA TRP A 7 15.081 -6.694 -2.029 1.00 0.00 H new ATOM 0 HB2 TRP A 7 17.563 -6.672 -3.688 1.00 0.00 H new ATOM 0 HB3 TRP A 7 15.988 -6.563 -4.448 1.00 0.00 H new ATOM 0 HD1 TRP A 7 18.594 -4.377 -3.391 1.00 0.00 H new ATOM 0 HE1 TRP A 7 17.795 -1.987 -2.882 1.00 0.00 H new ATOM 0 HE3 TRP A 7 13.553 -5.238 -3.131 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 15.305 -0.641 -2.387 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 11.999 -3.383 -2.635 1.00 0.00 H new ATOM 0 HH2 TRP A 7 12.855 -1.084 -2.261 1.00 0.00 H new ATOM 110 N GLN A 8 16.220 -9.631 -3.036 1.00 0.00 N ATOM 111 CA GLN A 8 15.746 -10.932 -3.490 1.00 0.00 C ATOM 112 C GLN A 8 14.721 -11.468 -2.483 1.00 0.00 C ATOM 113 O GLN A 8 13.697 -12.005 -2.898 1.00 0.00 O ATOM 114 CB GLN A 8 16.898 -11.918 -3.732 1.00 0.00 C ATOM 115 CG GLN A 8 17.799 -11.513 -4.912 1.00 0.00 C ATOM 116 CD GLN A 8 17.039 -11.342 -6.225 1.00 0.00 C ATOM 117 OE1 GLN A 8 17.054 -10.274 -6.831 1.00 0.00 O ATOM 118 NE2 GLN A 8 16.357 -12.390 -6.678 1.00 0.00 N ATOM 0 H GLN A 8 17.212 -9.599 -2.803 1.00 0.00 H new ATOM 0 HA GLN A 8 15.260 -10.814 -4.458 1.00 0.00 H new ATOM 0 HB2 GLN A 8 17.503 -11.990 -2.828 1.00 0.00 H new ATOM 0 HB3 GLN A 8 16.487 -12.910 -3.920 1.00 0.00 H new ATOM 0 HG2 GLN A 8 18.305 -10.578 -4.669 1.00 0.00 H new ATOM 0 HG3 GLN A 8 18.573 -12.269 -5.045 1.00 0.00 H new ATOM 0 HE21 GLN A 8 16.361 -13.266 -6.155 1.00 0.00 H new ATOM 0 HE22 GLN A 8 15.830 -12.318 -7.548 1.00 0.00 H new ATOM 127 N LEU A 9 14.946 -11.304 -1.171 1.00 0.00 N ATOM 128 CA LEU A 9 13.950 -11.707 -0.177 1.00 0.00 C ATOM 129 C LEU A 9 12.641 -10.956 -0.459 1.00 0.00 C ATOM 130 O LEU A 9 11.604 -11.580 -0.673 1.00 0.00 O ATOM 131 CB LEU A 9 14.433 -11.454 1.262 1.00 0.00 C ATOM 132 CG LEU A 9 15.300 -12.556 1.896 1.00 0.00 C ATOM 133 CD1 LEU A 9 14.581 -13.907 1.990 1.00 0.00 C ATOM 134 CD2 LEU A 9 16.667 -12.721 1.229 1.00 0.00 C ATOM 0 H LEU A 9 15.798 -10.900 -0.781 1.00 0.00 H new ATOM 0 HA LEU A 9 13.786 -12.781 -0.261 1.00 0.00 H new ATOM 0 HB2 LEU A 9 15.001 -10.524 1.273 1.00 0.00 H new ATOM 0 HB3 LEU A 9 13.558 -11.301 1.894 1.00 0.00 H new ATOM 0 HG LEU A 9 15.479 -12.204 2.912 1.00 0.00 H new ATOM 0 HD11 LEU A 9 15.245 -14.642 2.446 1.00 0.00 H new ATOM 0 HD12 LEU A 9 13.684 -13.800 2.601 1.00 0.00 H new ATOM 0 HD13 LEU A 9 14.302 -14.241 0.991 1.00 0.00 H new ATOM 0 HD21 LEU A 9 17.222 -13.515 1.729 1.00 0.00 H new ATOM 0 HD22 LEU A 9 16.531 -12.979 0.179 1.00 0.00 H new ATOM 0 HD23 LEU A 9 17.223 -11.787 1.304 1.00 0.00 H new ATOM 146 N VAL A 10 12.710 -9.626 -0.586 1.00 0.00 N ATOM 147 CA VAL A 10 11.543 -8.789 -0.862 1.00 0.00 C ATOM 148 C VAL A 10 10.787 -9.300 -2.097 1.00 0.00 C ATOM 149 O VAL A 10 9.601 -9.624 -2.034 1.00 0.00 O ATOM 150 CB VAL A 10 12.001 -7.324 -1.011 1.00 0.00 C ATOM 151 CG1 VAL A 10 11.013 -6.424 -1.762 1.00 0.00 C ATOM 152 CG2 VAL A 10 12.285 -6.730 0.368 1.00 0.00 C ATOM 0 H VAL A 10 13.580 -9.101 -0.500 1.00 0.00 H new ATOM 0 HA VAL A 10 10.840 -8.841 -0.031 1.00 0.00 H new ATOM 0 HB VAL A 10 12.905 -7.355 -1.620 1.00 0.00 H new ATOM 0 HG11 VAL A 10 11.415 -5.412 -1.821 1.00 0.00 H new ATOM 0 HG12 VAL A 10 10.860 -6.812 -2.769 1.00 0.00 H new ATOM 0 HG13 VAL A 10 10.061 -6.406 -1.231 1.00 0.00 H new ATOM 0 HG21 VAL A 10 12.608 -5.695 0.259 1.00 0.00 H new ATOM 0 HG22 VAL A 10 11.379 -6.765 0.973 1.00 0.00 H new ATOM 0 HG23 VAL A 10 13.071 -7.306 0.857 1.00 0.00 H new ATOM 162 N LEU A 11 11.472 -9.394 -3.236 1.00 0.00 N ATOM 163 CA LEU A 11 10.854 -9.850 -4.472 1.00 0.00 C ATOM 164 C LEU A 11 10.351 -11.291 -4.351 1.00 0.00 C ATOM 165 O LEU A 11 9.327 -11.625 -4.943 1.00 0.00 O ATOM 166 CB LEU A 11 11.807 -9.638 -5.653 1.00 0.00 C ATOM 167 CG LEU A 11 12.192 -8.158 -5.846 1.00 0.00 C ATOM 168 CD1 LEU A 11 13.129 -8.042 -7.050 1.00 0.00 C ATOM 169 CD2 LEU A 11 10.977 -7.252 -6.077 1.00 0.00 C ATOM 0 H LEU A 11 12.460 -9.158 -3.324 1.00 0.00 H new ATOM 0 HA LEU A 11 9.968 -9.246 -4.667 1.00 0.00 H new ATOM 0 HB2 LEU A 11 12.711 -10.227 -5.496 1.00 0.00 H new ATOM 0 HB3 LEU A 11 11.338 -10.009 -6.564 1.00 0.00 H new ATOM 0 HG LEU A 11 12.678 -7.827 -4.928 1.00 0.00 H new ATOM 0 HD11 LEU A 11 13.407 -6.998 -7.195 1.00 0.00 H new ATOM 0 HD12 LEU A 11 14.026 -8.635 -6.872 1.00 0.00 H new ATOM 0 HD13 LEU A 11 12.622 -8.410 -7.942 1.00 0.00 H new ATOM 0 HD21 LEU A 11 11.310 -6.222 -6.206 1.00 0.00 H new ATOM 0 HD22 LEU A 11 10.446 -7.577 -6.972 1.00 0.00 H new ATOM 0 HD23 LEU A 11 10.310 -7.312 -5.217 1.00 0.00 H new ATOM 181 N HIS A 12 11.036 -12.146 -3.586 1.00 0.00 N ATOM 182 CA HIS A 12 10.562 -13.500 -3.342 1.00 0.00 C ATOM 183 C HIS A 12 9.201 -13.426 -2.656 1.00 0.00 C ATOM 184 O HIS A 12 8.234 -13.965 -3.186 1.00 0.00 O ATOM 185 CB HIS A 12 11.584 -14.317 -2.543 1.00 0.00 C ATOM 186 CG HIS A 12 11.062 -15.644 -2.051 1.00 0.00 C ATOM 187 ND1 HIS A 12 10.987 -16.040 -0.725 1.00 0.00 N ATOM 188 CD2 HIS A 12 10.626 -16.679 -2.832 1.00 0.00 C ATOM 189 CE1 HIS A 12 10.525 -17.306 -0.706 1.00 0.00 C ATOM 190 NE2 HIS A 12 10.285 -17.706 -1.971 1.00 0.00 N ATOM 0 H HIS A 12 11.919 -11.919 -3.128 1.00 0.00 H new ATOM 0 HA HIS A 12 10.444 -14.026 -4.289 1.00 0.00 H new ATOM 0 HB2 HIS A 12 12.461 -14.492 -3.167 1.00 0.00 H new ATOM 0 HB3 HIS A 12 11.914 -13.729 -1.687 1.00 0.00 H new ATOM 0 HD2 HIS A 12 10.561 -16.692 -3.910 1.00 0.00 H new ATOM 0 HE1 HIS A 12 10.372 -17.904 0.180 1.00 0.00 H new ATOM 0 HE2 HIS A 12 9.914 -18.615 -2.247 1.00 0.00 H new ATOM 199 N VAL A 13 9.103 -12.730 -1.516 1.00 0.00 N ATOM 200 CA VAL A 13 7.821 -12.534 -0.838 1.00 0.00 C ATOM 201 C VAL A 13 6.798 -11.992 -1.843 1.00 0.00 C ATOM 202 O VAL A 13 5.713 -12.546 -2.006 1.00 0.00 O ATOM 203 CB VAL A 13 7.962 -11.600 0.382 1.00 0.00 C ATOM 204 CG1 VAL A 13 6.603 -11.344 1.044 1.00 0.00 C ATOM 205 CG2 VAL A 13 8.896 -12.207 1.431 1.00 0.00 C ATOM 0 H VAL A 13 9.897 -12.295 -1.046 1.00 0.00 H new ATOM 0 HA VAL A 13 7.472 -13.493 -0.456 1.00 0.00 H new ATOM 0 HB VAL A 13 8.375 -10.661 0.015 1.00 0.00 H new ATOM 0 HG11 VAL A 13 6.734 -10.683 1.900 1.00 0.00 H new ATOM 0 HG12 VAL A 13 5.930 -10.877 0.325 1.00 0.00 H new ATOM 0 HG13 VAL A 13 6.177 -12.290 1.378 1.00 0.00 H new ATOM 0 HG21 VAL A 13 8.978 -11.529 2.281 1.00 0.00 H new ATOM 0 HG22 VAL A 13 8.494 -13.163 1.767 1.00 0.00 H new ATOM 0 HG23 VAL A 13 9.882 -12.362 0.994 1.00 0.00 H new ATOM 215 N TRP A 14 7.184 -11.001 -2.648 1.00 0.00 N ATOM 216 CA TRP A 14 6.222 -10.379 -3.543 1.00 0.00 C ATOM 217 C TRP A 14 5.751 -11.284 -4.669 1.00 0.00 C ATOM 218 O TRP A 14 4.602 -11.213 -5.102 1.00 0.00 O ATOM 219 CB TRP A 14 6.762 -9.071 -4.105 1.00 0.00 C ATOM 220 CG TRP A 14 5.641 -8.185 -4.501 1.00 0.00 C ATOM 221 CD1 TRP A 14 5.136 -8.024 -5.744 1.00 0.00 C ATOM 222 CD2 TRP A 14 4.738 -7.487 -3.601 1.00 0.00 C ATOM 223 NE1 TRP A 14 4.068 -7.151 -5.687 1.00 0.00 N ATOM 224 CE2 TRP A 14 3.783 -6.783 -4.386 1.00 0.00 C ATOM 225 CE3 TRP A 14 4.625 -7.393 -2.198 1.00 0.00 C ATOM 226 CZ2 TRP A 14 2.804 -5.974 -3.800 1.00 0.00 C ATOM 227 CZ3 TRP A 14 3.639 -6.582 -1.606 1.00 0.00 C ATOM 228 CH2 TRP A 14 2.760 -5.837 -2.408 1.00 0.00 C ATOM 0 H TRP A 14 8.130 -10.624 -2.696 1.00 0.00 H new ATOM 0 HA TRP A 14 5.345 -10.175 -2.929 1.00 0.00 H new ATOM 0 HB2 TRP A 14 7.382 -8.574 -3.359 1.00 0.00 H new ATOM 0 HB3 TRP A 14 7.399 -9.272 -4.967 1.00 0.00 H new ATOM 0 HD1 TRP A 14 5.508 -8.502 -6.638 1.00 0.00 H new ATOM 0 HE1 TRP A 14 3.554 -6.819 -6.503 1.00 0.00 H new ATOM 0 HE3 TRP A 14 5.304 -7.951 -1.570 1.00 0.00 H new ATOM 0 HZ2 TRP A 14 2.085 -5.457 -4.419 1.00 0.00 H new ATOM 0 HZ3 TRP A 14 3.558 -6.533 -0.530 1.00 0.00 H new ATOM 0 HH2 TRP A 14 2.052 -5.160 -1.952 1.00 0.00 H new ATOM 239 N ALA A 15 6.624 -12.162 -5.148 1.00 0.00 N ATOM 240 CA ALA A 15 6.185 -13.144 -6.112 1.00 0.00 C ATOM 241 C ALA A 15 5.250 -14.084 -5.353 1.00 0.00 C ATOM 242 O ALA A 15 4.162 -14.403 -5.827 1.00 0.00 O ATOM 243 CB ALA A 15 7.385 -13.902 -6.692 1.00 0.00 C ATOM 0 H ALA A 15 7.610 -12.210 -4.890 1.00 0.00 H new ATOM 0 HA ALA A 15 5.675 -12.682 -6.957 1.00 0.00 H new ATOM 0 HB1 ALA A 15 7.035 -14.638 -7.416 1.00 0.00 H new ATOM 0 HB2 ALA A 15 8.056 -13.198 -7.185 1.00 0.00 H new ATOM 0 HB3 ALA A 15 7.918 -14.410 -5.888 1.00 0.00 H new ATOM 249 N LYS A 16 5.682 -14.513 -4.162 1.00 0.00 N ATOM 250 CA LYS A 16 4.997 -15.498 -3.340 1.00 0.00 C ATOM 251 C LYS A 16 3.650 -15.065 -2.787 1.00 0.00 C ATOM 252 O LYS A 16 2.810 -15.928 -2.543 1.00 0.00 O ATOM 253 CB LYS A 16 5.944 -16.056 -2.272 1.00 0.00 C ATOM 254 CG LYS A 16 5.431 -17.334 -1.589 1.00 0.00 C ATOM 255 CD LYS A 16 5.036 -18.440 -2.581 1.00 0.00 C ATOM 256 CE LYS A 16 4.758 -19.766 -1.864 1.00 0.00 C ATOM 257 NZ LYS A 16 3.649 -19.644 -0.903 1.00 0.00 N ATOM 0 H LYS A 16 6.544 -14.170 -3.737 1.00 0.00 H new ATOM 0 HA LYS A 16 4.722 -16.310 -4.013 1.00 0.00 H new ATOM 0 HB2 LYS A 16 6.911 -16.264 -2.731 1.00 0.00 H new ATOM 0 HB3 LYS A 16 6.110 -15.292 -1.513 1.00 0.00 H new ATOM 0 HG2 LYS A 16 6.203 -17.715 -0.920 1.00 0.00 H new ATOM 0 HG3 LYS A 16 4.568 -17.086 -0.971 1.00 0.00 H new ATOM 0 HD2 LYS A 16 4.150 -18.133 -3.136 1.00 0.00 H new ATOM 0 HD3 LYS A 16 5.835 -18.580 -3.309 1.00 0.00 H new ATOM 0 HE2 LYS A 16 4.519 -20.534 -2.599 1.00 0.00 H new ATOM 0 HE3 LYS A 16 5.657 -20.093 -1.342 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 3.401 -20.586 -0.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 3.939 -19.032 -0.114 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 2.823 -19.228 -1.378 1.00 0.00 H new ATOM 271 N VAL A 17 3.396 -13.750 -2.719 1.00 0.00 N ATOM 272 CA VAL A 17 2.056 -13.184 -2.460 1.00 0.00 C ATOM 273 C VAL A 17 1.101 -13.909 -3.447 1.00 0.00 C ATOM 274 O VAL A 17 -0.101 -14.032 -3.217 1.00 0.00 O ATOM 275 CB VAL A 17 2.068 -11.644 -2.686 1.00 0.00 C ATOM 276 CG1 VAL A 17 0.893 -11.011 -3.441 1.00 0.00 C ATOM 277 CG2 VAL A 17 2.450 -10.853 -1.437 1.00 0.00 C ATOM 0 H VAL A 17 4.118 -13.040 -2.843 1.00 0.00 H new ATOM 0 HA VAL A 17 1.733 -13.334 -1.430 1.00 0.00 H new ATOM 0 HB VAL A 17 2.876 -11.554 -3.412 1.00 0.00 H new ATOM 0 HG11 VAL A 17 1.047 -9.935 -3.517 1.00 0.00 H new ATOM 0 HG12 VAL A 17 0.829 -11.440 -4.441 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -0.034 -11.208 -2.902 1.00 0.00 H new ATOM 0 HG21 VAL A 17 2.439 -9.787 -1.664 1.00 0.00 H new ATOM 0 HG22 VAL A 17 1.735 -11.062 -0.641 1.00 0.00 H new ATOM 0 HG23 VAL A 17 3.449 -11.145 -1.113 1.00 0.00 H new ATOM 287 N GLU A 18 1.685 -14.365 -4.570 1.00 0.00 N ATOM 288 CA GLU A 18 1.213 -15.250 -5.627 1.00 0.00 C ATOM 289 C GLU A 18 0.924 -14.438 -6.868 1.00 0.00 C ATOM 290 O GLU A 18 -0.061 -14.668 -7.565 1.00 0.00 O ATOM 291 CB GLU A 18 0.095 -16.151 -5.105 1.00 0.00 C ATOM 292 CG GLU A 18 0.018 -17.501 -5.830 1.00 0.00 C ATOM 293 CD GLU A 18 1.224 -18.387 -5.521 1.00 0.00 C ATOM 294 OE1 GLU A 18 1.273 -18.905 -4.384 1.00 0.00 O ATOM 295 OE2 GLU A 18 2.077 -18.527 -6.424 1.00 0.00 O ATOM 0 H GLU A 18 2.640 -14.071 -4.776 1.00 0.00 H new ATOM 0 HA GLU A 18 1.979 -15.959 -5.941 1.00 0.00 H new ATOM 0 HB2 GLU A 18 0.246 -16.326 -4.040 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -0.859 -15.634 -5.211 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -0.896 -18.018 -5.537 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -0.042 -17.332 -6.905 1.00 0.00 H new ATOM 302 N ALA A 19 1.793 -13.439 -7.073 1.00 0.00 N ATOM 303 CA ALA A 19 1.645 -12.410 -8.101 1.00 0.00 C ATOM 304 C ALA A 19 0.196 -11.878 -8.120 1.00 0.00 C ATOM 305 O ALA A 19 -0.333 -11.509 -9.169 1.00 0.00 O ATOM 306 CB ALA A 19 2.074 -12.969 -9.463 1.00 0.00 C ATOM 0 H ALA A 19 2.638 -13.325 -6.513 1.00 0.00 H new ATOM 0 HA ALA A 19 2.295 -11.566 -7.871 1.00 0.00 H new ATOM 0 HB1 ALA A 19 1.961 -12.198 -10.225 1.00 0.00 H new ATOM 0 HB2 ALA A 19 3.117 -13.283 -9.415 1.00 0.00 H new ATOM 0 HB3 ALA A 19 1.449 -13.825 -9.718 1.00 0.00 H new ATOM 312 N ASP A 20 -0.507 -11.992 -6.984 1.00 0.00 N ATOM 313 CA ASP A 20 -1.923 -11.709 -6.901 1.00 0.00 C ATOM 314 C ASP A 20 -2.172 -10.280 -6.460 1.00 0.00 C ATOM 315 O ASP A 20 -2.929 -10.025 -5.529 1.00 0.00 O ATOM 316 CB ASP A 20 -2.585 -12.752 -5.985 1.00 0.00 C ATOM 317 CG ASP A 20 -4.070 -12.489 -5.753 1.00 0.00 C ATOM 318 OD1 ASP A 20 -4.758 -12.145 -6.740 1.00 0.00 O ATOM 319 OD2 ASP A 20 -4.483 -12.588 -4.575 1.00 0.00 O ATOM 0 H ASP A 20 -0.094 -12.286 -6.099 1.00 0.00 H new ATOM 0 HA ASP A 20 -2.380 -11.791 -7.887 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -2.462 -13.742 -6.424 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -2.070 -12.762 -5.025 1.00 0.00 H new ATOM 324 N VAL A 21 -1.579 -9.326 -7.172 1.00 0.00 N ATOM 325 CA VAL A 21 -1.690 -7.933 -6.892 1.00 0.00 C ATOM 326 C VAL A 21 -3.164 -7.505 -6.817 1.00 0.00 C ATOM 327 O VAL A 21 -3.549 -6.719 -5.956 1.00 0.00 O ATOM 328 CB VAL A 21 -0.861 -7.246 -7.981 1.00 0.00 C ATOM 329 CG1 VAL A 21 0.632 -7.586 -7.864 1.00 0.00 C ATOM 330 CG2 VAL A 21 -1.350 -7.477 -9.419 1.00 0.00 C ATOM 0 H VAL A 21 -0.993 -9.528 -7.982 1.00 0.00 H new ATOM 0 HA VAL A 21 -1.303 -7.648 -5.914 1.00 0.00 H new ATOM 0 HB VAL A 21 -1.007 -6.183 -7.788 1.00 0.00 H new ATOM 0 HG11 VAL A 21 1.184 -7.078 -8.655 1.00 0.00 H new ATOM 0 HG12 VAL A 21 1.005 -7.258 -6.894 1.00 0.00 H new ATOM 0 HG13 VAL A 21 0.768 -8.663 -7.960 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -0.697 -6.950 -10.114 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -1.332 -8.544 -9.642 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -2.368 -7.102 -9.522 1.00 0.00 H new ATOM 340 N ALA A 22 -4.007 -8.043 -7.704 1.00 0.00 N ATOM 341 CA ALA A 22 -5.436 -7.763 -7.707 1.00 0.00 C ATOM 342 C ALA A 22 -6.104 -8.210 -6.404 1.00 0.00 C ATOM 343 O ALA A 22 -6.669 -7.400 -5.673 1.00 0.00 O ATOM 344 CB ALA A 22 -6.098 -8.470 -8.898 1.00 0.00 C ATOM 0 H ALA A 22 -3.712 -8.685 -8.439 1.00 0.00 H new ATOM 0 HA ALA A 22 -5.566 -6.684 -7.795 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -7.167 -8.259 -8.898 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -5.657 -8.108 -9.827 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -5.941 -9.545 -8.816 1.00 0.00 H new ATOM 350 N GLY A 23 -6.050 -9.515 -6.119 1.00 0.00 N ATOM 351 CA GLY A 23 -6.716 -10.099 -4.967 1.00 0.00 C ATOM 352 C GLY A 23 -6.149 -9.509 -3.688 1.00 0.00 C ATOM 353 O GLY A 23 -6.888 -8.942 -2.886 1.00 0.00 O ATOM 0 H GLY A 23 -5.540 -10.192 -6.687 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -7.788 -9.910 -5.021 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -6.583 -11.181 -4.969 1.00 0.00 H new ATOM 357 N HIS A 24 -4.816 -9.509 -3.566 1.00 0.00 N ATOM 358 CA HIS A 24 -4.157 -8.946 -2.401 1.00 0.00 C ATOM 359 C HIS A 24 -4.572 -7.489 -2.278 1.00 0.00 C ATOM 360 O HIS A 24 -4.987 -7.061 -1.211 1.00 0.00 O ATOM 361 CB HIS A 24 -2.629 -9.137 -2.452 1.00 0.00 C ATOM 362 CG HIS A 24 -2.255 -10.543 -2.070 1.00 0.00 C ATOM 363 ND1 HIS A 24 -2.996 -11.666 -2.367 1.00 0.00 N ATOM 364 CD2 HIS A 24 -1.284 -10.904 -1.172 1.00 0.00 C ATOM 365 CE1 HIS A 24 -2.512 -12.673 -1.629 1.00 0.00 C ATOM 366 NE2 HIS A 24 -1.491 -12.250 -0.870 1.00 0.00 N ATOM 0 H HIS A 24 -4.180 -9.895 -4.264 1.00 0.00 H new ATOM 0 HA HIS A 24 -4.472 -9.478 -1.503 1.00 0.00 H new ATOM 0 HB2 HIS A 24 -2.264 -8.918 -3.455 1.00 0.00 H new ATOM 0 HB3 HIS A 24 -2.147 -8.431 -1.776 1.00 0.00 H new ATOM 0 HD1 HIS A 24 -3.771 -11.720 -3.028 1.00 0.00 H new ATOM 0 HD2 HIS A 24 -0.507 -10.268 -0.774 1.00 0.00 H new ATOM 0 HE1 HIS A 24 -2.891 -13.684 -1.643 1.00 0.00 H new ATOM 0 HE2 HIS A 24 -0.964 -12.808 -0.198 1.00 0.00 H new ATOM 374 N GLY A 25 -4.557 -6.742 -3.381 1.00 0.00 N ATOM 375 CA GLY A 25 -4.946 -5.344 -3.369 1.00 0.00 C ATOM 376 C GLY A 25 -6.363 -5.159 -2.833 1.00 0.00 C ATOM 377 O GLY A 25 -6.579 -4.357 -1.927 1.00 0.00 O ATOM 0 H GLY A 25 -4.276 -7.091 -4.298 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -4.247 -4.777 -2.754 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -4.883 -4.940 -4.379 1.00 0.00 H new ATOM 381 N GLN A 26 -7.326 -5.935 -3.341 1.00 0.00 N ATOM 382 CA GLN A 26 -8.701 -5.815 -2.877 1.00 0.00 C ATOM 383 C GLN A 26 -8.702 -6.118 -1.375 1.00 0.00 C ATOM 384 O GLN A 26 -9.098 -5.273 -0.578 1.00 0.00 O ATOM 385 CB GLN A 26 -9.648 -6.730 -3.677 1.00 0.00 C ATOM 386 CG GLN A 26 -11.112 -6.282 -3.524 1.00 0.00 C ATOM 387 CD GLN A 26 -12.085 -7.113 -4.357 1.00 0.00 C ATOM 388 OE1 GLN A 26 -11.682 -8.037 -5.057 1.00 0.00 O ATOM 389 NE2 GLN A 26 -13.378 -6.804 -4.301 1.00 0.00 N ATOM 0 H GLN A 26 -7.177 -6.641 -4.062 1.00 0.00 H new ATOM 0 HA GLN A 26 -9.081 -4.807 -3.041 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -9.368 -6.716 -4.730 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -9.541 -7.759 -3.333 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -11.397 -6.345 -2.474 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -11.197 -5.235 -3.815 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -13.693 -6.032 -3.713 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -14.054 -7.339 -4.846 1.00 0.00 H new ATOM 398 N ASP A 27 -8.174 -7.289 -0.994 1.00 0.00 N ATOM 399 CA ASP A 27 -8.055 -7.743 0.387 1.00 0.00 C ATOM 400 C ASP A 27 -7.450 -6.677 1.307 1.00 0.00 C ATOM 401 O ASP A 27 -8.013 -6.391 2.359 1.00 0.00 O ATOM 402 CB ASP A 27 -7.284 -9.069 0.465 1.00 0.00 C ATOM 403 CG ASP A 27 -7.237 -9.621 1.888 1.00 0.00 C ATOM 404 OD1 ASP A 27 -8.256 -9.481 2.598 1.00 0.00 O ATOM 405 OD2 ASP A 27 -6.184 -10.200 2.233 1.00 0.00 O ATOM 0 H ASP A 27 -7.808 -7.964 -1.665 1.00 0.00 H new ATOM 0 HA ASP A 27 -9.066 -7.921 0.754 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -7.754 -9.801 -0.192 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -6.268 -8.919 0.101 1.00 0.00 H new ATOM 410 N ILE A 28 -6.367 -6.010 0.893 1.00 0.00 N ATOM 411 CA ILE A 28 -5.708 -4.996 1.710 1.00 0.00 C ATOM 412 C ILE A 28 -6.747 -3.943 2.088 1.00 0.00 C ATOM 413 O ILE A 28 -6.884 -3.581 3.253 1.00 0.00 O ATOM 414 CB ILE A 28 -4.512 -4.312 0.988 1.00 0.00 C ATOM 415 CG1 ILE A 28 -3.324 -5.218 0.584 1.00 0.00 C ATOM 416 CG2 ILE A 28 -3.913 -3.203 1.868 1.00 0.00 C ATOM 417 CD1 ILE A 28 -3.248 -6.563 1.307 1.00 0.00 C ATOM 0 H ILE A 28 -5.927 -6.160 -0.015 1.00 0.00 H new ATOM 0 HA ILE A 28 -5.296 -5.489 2.591 1.00 0.00 H new ATOM 0 HB ILE A 28 -4.973 -3.952 0.068 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -3.380 -5.404 -0.489 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -2.397 -4.675 0.765 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -3.078 -2.736 1.346 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -4.675 -2.453 2.077 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -3.561 -3.633 2.806 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -2.381 -7.119 0.951 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -3.155 -6.395 2.380 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -4.154 -7.136 1.106 1.00 0.00 H new ATOM 429 N LEU A 29 -7.458 -3.424 1.089 1.00 0.00 N ATOM 430 CA LEU A 29 -8.434 -2.397 1.228 1.00 0.00 C ATOM 431 C LEU A 29 -9.632 -2.913 2.025 1.00 0.00 C ATOM 432 O LEU A 29 -10.039 -2.272 2.985 1.00 0.00 O ATOM 433 CB LEU A 29 -8.770 -1.972 -0.196 1.00 0.00 C ATOM 434 CG LEU A 29 -7.636 -1.262 -0.966 1.00 0.00 C ATOM 435 CD1 LEU A 29 -8.147 -0.796 -2.333 1.00 0.00 C ATOM 436 CD2 LEU A 29 -7.080 -0.049 -0.212 1.00 0.00 C ATOM 0 H LEU A 29 -7.348 -3.737 0.124 1.00 0.00 H new ATOM 0 HA LEU A 29 -8.082 -1.534 1.793 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -9.069 -2.856 -0.759 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -9.634 -1.308 -0.164 1.00 0.00 H new ATOM 0 HG LEU A 29 -6.831 -1.988 -1.078 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -7.342 -0.296 -2.871 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -8.487 -1.658 -2.907 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -8.976 -0.102 -2.194 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -6.286 0.412 -0.799 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -7.878 0.676 -0.050 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -6.680 -0.370 0.750 1.00 0.00 H new ATOM 448 N ILE A 30 -10.136 -4.115 1.723 1.00 0.00 N ATOM 449 CA ILE A 30 -11.237 -4.736 2.419 1.00 0.00 C ATOM 450 C ILE A 30 -10.922 -4.777 3.916 1.00 0.00 C ATOM 451 O ILE A 30 -11.744 -4.414 4.761 1.00 0.00 O ATOM 452 CB ILE A 30 -11.466 -6.122 1.760 1.00 0.00 C ATOM 453 CG1 ILE A 30 -12.821 -6.113 1.059 1.00 0.00 C ATOM 454 CG2 ILE A 30 -11.263 -7.323 2.674 1.00 0.00 C ATOM 455 CD1 ILE A 30 -13.103 -7.389 0.256 1.00 0.00 C ATOM 0 H ILE A 30 -9.769 -4.688 0.963 1.00 0.00 H new ATOM 0 HA ILE A 30 -12.171 -4.179 2.338 1.00 0.00 H new ATOM 0 HB ILE A 30 -10.675 -6.266 1.024 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -13.606 -5.981 1.804 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -12.869 -5.254 0.390 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -11.448 -8.241 2.115 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -10.239 -7.326 3.049 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -11.956 -7.263 3.513 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -14.083 -7.313 -0.215 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -12.339 -7.512 -0.512 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -13.087 -8.250 0.924 1.00 0.00 H new ATOM 467 N ARG A 31 -9.698 -5.201 4.229 1.00 0.00 N ATOM 468 CA ARG A 31 -9.229 -5.307 5.602 1.00 0.00 C ATOM 469 C ARG A 31 -9.184 -3.917 6.220 1.00 0.00 C ATOM 470 O ARG A 31 -9.798 -3.673 7.260 1.00 0.00 O ATOM 471 CB ARG A 31 -7.864 -6.007 5.662 1.00 0.00 C ATOM 472 CG ARG A 31 -7.347 -6.031 7.106 1.00 0.00 C ATOM 473 CD ARG A 31 -6.037 -6.811 7.241 1.00 0.00 C ATOM 474 NE ARG A 31 -5.452 -6.585 8.570 1.00 0.00 N ATOM 475 CZ ARG A 31 -5.862 -7.157 9.711 1.00 0.00 C ATOM 476 NH1 ARG A 31 -6.797 -8.113 9.700 1.00 0.00 N ATOM 477 NH2 ARG A 31 -5.334 -6.750 10.869 1.00 0.00 N ATOM 0 H ARG A 31 -9.006 -5.480 3.534 1.00 0.00 H new ATOM 0 HA ARG A 31 -9.920 -5.921 6.180 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -7.952 -7.025 5.282 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -7.152 -5.488 5.021 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -7.196 -5.009 7.453 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -8.102 -6.478 7.753 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -6.221 -7.875 7.092 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -5.336 -6.497 6.468 1.00 0.00 H new ATOM 0 HE ARG A 31 -4.666 -5.937 8.629 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -7.207 -8.415 8.816 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -7.100 -8.540 10.575 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -4.629 -6.013 10.877 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -5.636 -7.176 11.745 1.00 0.00 H new ATOM 491 N LEU A 32 -8.460 -3.002 5.570 1.00 0.00 N ATOM 492 CA LEU A 32 -8.272 -1.653 6.026 1.00 0.00 C ATOM 493 C LEU A 32 -9.610 -1.009 6.368 1.00 0.00 C ATOM 494 O LEU A 32 -9.815 -0.586 7.497 1.00 0.00 O ATOM 495 CB LEU A 32 -7.561 -0.930 4.887 1.00 0.00 C ATOM 496 CG LEU A 32 -6.853 0.353 5.257 1.00 0.00 C ATOM 497 CD1 LEU A 32 -7.743 1.419 5.876 1.00 0.00 C ATOM 498 CD2 LEU A 32 -5.645 0.108 6.155 1.00 0.00 C ATOM 0 H LEU A 32 -7.983 -3.200 4.691 1.00 0.00 H new ATOM 0 HA LEU A 32 -7.681 -1.607 6.941 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -6.831 -1.611 4.450 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -8.293 -0.707 4.111 1.00 0.00 H new ATOM 0 HG LEU A 32 -6.519 0.747 4.297 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -7.147 2.301 6.107 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -8.531 1.688 5.173 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -8.190 1.033 6.792 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -5.170 1.060 6.393 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -5.969 -0.377 7.076 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -4.932 -0.534 5.638 1.00 0.00 H new ATOM 510 N PHE A 33 -10.509 -0.935 5.390 1.00 0.00 N ATOM 511 CA PHE A 33 -11.822 -0.332 5.517 1.00 0.00 C ATOM 512 C PHE A 33 -12.610 -0.906 6.691 1.00 0.00 C ATOM 513 O PHE A 33 -13.153 -0.144 7.487 1.00 0.00 O ATOM 514 CB PHE A 33 -12.565 -0.483 4.182 1.00 0.00 C ATOM 515 CG PHE A 33 -11.902 0.155 2.968 1.00 0.00 C ATOM 516 CD1 PHE A 33 -10.837 1.074 3.093 1.00 0.00 C ATOM 517 CD2 PHE A 33 -12.400 -0.142 1.686 1.00 0.00 C ATOM 518 CE1 PHE A 33 -10.292 1.691 1.958 1.00 0.00 C ATOM 519 CE2 PHE A 33 -11.835 0.463 0.549 1.00 0.00 C ATOM 520 CZ PHE A 33 -10.788 1.389 0.683 1.00 0.00 C ATOM 0 H PHE A 33 -10.332 -1.308 4.457 1.00 0.00 H new ATOM 0 HA PHE A 33 -11.709 0.729 5.741 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -12.697 -1.546 3.981 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -13.561 -0.054 4.294 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -10.439 1.303 4.071 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -13.219 -0.837 1.575 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -9.486 2.402 2.067 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -12.209 0.214 -0.433 1.00 0.00 H new ATOM 0 HZ PHE A 33 -10.368 1.865 -0.191 1.00 0.00 H new ATOM 530 N LYS A 34 -12.676 -2.236 6.828 1.00 0.00 N ATOM 531 CA LYS A 34 -13.397 -2.810 7.958 1.00 0.00 C ATOM 532 C LYS A 34 -12.715 -2.459 9.285 1.00 0.00 C ATOM 533 O LYS A 34 -13.394 -2.256 10.289 1.00 0.00 O ATOM 534 CB LYS A 34 -13.570 -4.327 7.801 1.00 0.00 C ATOM 535 CG LYS A 34 -14.529 -4.630 6.638 1.00 0.00 C ATOM 536 CD LYS A 34 -14.920 -6.112 6.539 1.00 0.00 C ATOM 537 CE LYS A 34 -13.973 -6.938 5.659 1.00 0.00 C ATOM 538 NZ LYS A 34 -12.580 -6.883 6.128 1.00 0.00 N ATOM 0 H LYS A 34 -12.253 -2.911 6.191 1.00 0.00 H new ATOM 0 HA LYS A 34 -14.394 -2.369 7.972 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -12.603 -4.794 7.617 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -13.959 -4.754 8.725 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -15.432 -4.031 6.756 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -14.062 -4.322 5.702 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -14.940 -6.542 7.540 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -15.932 -6.187 6.140 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -14.308 -7.975 5.644 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -14.023 -6.572 4.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -12.046 -7.680 5.725 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -12.147 -5.988 5.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -12.561 -6.943 7.166 1.00 0.00 H new ATOM 552 N SER A 35 -11.381 -2.424 9.307 1.00 0.00 N ATOM 553 CA SER A 35 -10.624 -2.128 10.519 1.00 0.00 C ATOM 554 C SER A 35 -10.701 -0.645 10.908 1.00 0.00 C ATOM 555 O SER A 35 -10.730 -0.315 12.092 1.00 0.00 O ATOM 556 CB SER A 35 -9.165 -2.555 10.325 1.00 0.00 C ATOM 557 OG SER A 35 -9.096 -3.911 9.923 1.00 0.00 O ATOM 0 H SER A 35 -10.800 -2.600 8.487 1.00 0.00 H new ATOM 0 HA SER A 35 -11.070 -2.692 11.338 1.00 0.00 H new ATOM 0 HB2 SER A 35 -8.691 -1.922 9.575 1.00 0.00 H new ATOM 0 HB3 SER A 35 -8.612 -2.416 11.254 1.00 0.00 H new ATOM 0 HG SER A 35 -9.328 -3.983 8.974 1.00 0.00 H new ATOM 563 N HIS A 36 -10.697 0.250 9.916 1.00 0.00 N ATOM 564 CA HIS A 36 -10.661 1.691 10.091 1.00 0.00 C ATOM 565 C HIS A 36 -11.656 2.343 9.110 1.00 0.00 C ATOM 566 O HIS A 36 -11.410 2.343 7.902 1.00 0.00 O ATOM 567 CB HIS A 36 -9.225 2.187 9.831 1.00 0.00 C ATOM 568 CG HIS A 36 -8.132 1.503 10.621 1.00 0.00 C ATOM 569 ND1 HIS A 36 -7.706 1.832 11.894 1.00 0.00 N ATOM 570 CD2 HIS A 36 -7.324 0.502 10.157 1.00 0.00 C ATOM 571 CE1 HIS A 36 -6.671 1.027 12.201 1.00 0.00 C ATOM 572 NE2 HIS A 36 -6.430 0.201 11.165 1.00 0.00 N ATOM 0 H HIS A 36 -10.720 -0.028 8.935 1.00 0.00 H new ATOM 0 HA HIS A 36 -10.948 1.963 11.107 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -9.008 2.067 8.770 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -9.187 3.255 10.046 1.00 0.00 H new ATOM 0 HD2 HIS A 36 -7.376 0.035 9.185 1.00 0.00 H new ATOM 0 HE1 HIS A 36 -6.121 1.042 13.131 1.00 0.00 H new ATOM 0 HE2 HIS A 36 -5.711 -0.522 11.131 1.00 0.00 H new ATOM 581 N PRO A 37 -12.780 2.907 9.583 1.00 0.00 N ATOM 582 CA PRO A 37 -13.797 3.495 8.718 1.00 0.00 C ATOM 583 C PRO A 37 -13.443 4.893 8.180 1.00 0.00 C ATOM 584 O PRO A 37 -13.982 5.312 7.154 1.00 0.00 O ATOM 585 CB PRO A 37 -15.056 3.542 9.586 1.00 0.00 C ATOM 586 CG PRO A 37 -14.505 3.746 10.997 1.00 0.00 C ATOM 587 CD PRO A 37 -13.203 2.943 10.975 1.00 0.00 C ATOM 0 HA PRO A 37 -13.913 2.897 7.814 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -15.717 4.357 9.291 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -15.632 2.620 9.509 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -14.326 4.799 11.213 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -15.194 3.378 11.757 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -12.444 3.412 11.602 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -13.359 1.936 11.362 1.00 0.00 H new ATOM 595 N GLU A 38 -12.623 5.671 8.894 1.00 0.00 N ATOM 596 CA GLU A 38 -12.264 7.012 8.445 1.00 0.00 C ATOM 597 C GLU A 38 -11.473 6.950 7.141 1.00 0.00 C ATOM 598 O GLU A 38 -11.704 7.719 6.207 1.00 0.00 O ATOM 599 CB GLU A 38 -11.508 7.793 9.530 1.00 0.00 C ATOM 600 CG GLU A 38 -12.203 7.795 10.903 1.00 0.00 C ATOM 601 CD GLU A 38 -11.874 6.590 11.784 1.00 0.00 C ATOM 602 OE1 GLU A 38 -11.242 5.641 11.267 1.00 0.00 O ATOM 603 OE2 GLU A 38 -12.280 6.632 12.965 1.00 0.00 O ATOM 0 H GLU A 38 -12.200 5.394 9.780 1.00 0.00 H new ATOM 0 HA GLU A 38 -13.188 7.557 8.252 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -10.511 7.367 9.640 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -11.380 8.823 9.198 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -11.925 8.705 11.435 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -13.282 7.833 10.750 1.00 0.00 H new ATOM 610 N THR A 39 -10.557 5.993 7.068 1.00 0.00 N ATOM 611 CA THR A 39 -9.777 5.723 5.884 1.00 0.00 C ATOM 612 C THR A 39 -10.694 5.386 4.708 1.00 0.00 C ATOM 613 O THR A 39 -10.389 5.772 3.584 1.00 0.00 O ATOM 614 CB THR A 39 -8.828 4.563 6.199 1.00 0.00 C ATOM 615 OG1 THR A 39 -9.344 3.804 7.273 1.00 0.00 O ATOM 616 CG2 THR A 39 -7.479 5.063 6.705 1.00 0.00 C ATOM 0 H THR A 39 -10.337 5.375 7.849 1.00 0.00 H new ATOM 0 HA THR A 39 -9.199 6.602 5.599 1.00 0.00 H new ATOM 0 HB THR A 39 -8.724 3.992 5.276 1.00 0.00 H new ATOM 0 HG1 THR A 39 -10.222 3.445 7.028 1.00 0.00 H new ATOM 0 HG21 THR A 39 -6.832 4.212 6.918 1.00 0.00 H new ATOM 0 HG22 THR A 39 -7.015 5.690 5.944 1.00 0.00 H new ATOM 0 HG23 THR A 39 -7.625 5.645 7.615 1.00 0.00 H new ATOM 624 N LEU A 40 -11.783 4.641 4.939 1.00 0.00 N ATOM 625 CA LEU A 40 -12.723 4.313 3.875 1.00 0.00 C ATOM 626 C LEU A 40 -13.487 5.558 3.467 1.00 0.00 C ATOM 627 O LEU A 40 -13.556 5.856 2.276 1.00 0.00 O ATOM 628 CB LEU A 40 -13.634 3.142 4.284 1.00 0.00 C ATOM 629 CG LEU A 40 -14.803 2.758 3.351 1.00 0.00 C ATOM 630 CD1 LEU A 40 -16.068 3.598 3.570 1.00 0.00 C ATOM 631 CD2 LEU A 40 -14.434 2.735 1.866 1.00 0.00 C ATOM 0 H LEU A 40 -12.029 4.258 5.852 1.00 0.00 H new ATOM 0 HA LEU A 40 -12.178 3.968 2.996 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -13.005 2.260 4.408 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -14.054 3.374 5.263 1.00 0.00 H new ATOM 0 HG LEU A 40 -15.031 1.733 3.644 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -16.846 3.271 2.880 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -16.416 3.471 4.595 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -15.842 4.649 3.391 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -15.309 2.457 1.278 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -14.091 3.724 1.561 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -13.639 2.008 1.700 1.00 0.00 H new ATOM 643 N GLU A 41 -14.046 6.283 4.443 1.00 0.00 N ATOM 644 CA GLU A 41 -14.772 7.523 4.185 1.00 0.00 C ATOM 645 C GLU A 41 -13.967 8.413 3.229 1.00 0.00 C ATOM 646 O GLU A 41 -14.526 9.022 2.321 1.00 0.00 O ATOM 647 CB GLU A 41 -15.071 8.229 5.516 1.00 0.00 C ATOM 648 CG GLU A 41 -16.002 9.434 5.332 1.00 0.00 C ATOM 649 CD GLU A 41 -16.301 10.108 6.668 1.00 0.00 C ATOM 650 OE1 GLU A 41 -15.344 10.664 7.248 1.00 0.00 O ATOM 651 OE2 GLU A 41 -17.477 10.049 7.087 1.00 0.00 O ATOM 0 H GLU A 41 -14.006 6.024 5.429 1.00 0.00 H new ATOM 0 HA GLU A 41 -15.724 7.304 3.702 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -15.528 7.521 6.207 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -14.136 8.559 5.969 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -15.542 10.153 4.654 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -16.934 9.110 4.868 1.00 0.00 H new ATOM 658 N LYS A 42 -12.641 8.420 3.395 1.00 0.00 N ATOM 659 CA LYS A 42 -11.746 9.229 2.588 1.00 0.00 C ATOM 660 C LYS A 42 -11.791 8.931 1.074 1.00 0.00 C ATOM 661 O LYS A 42 -11.485 9.813 0.272 1.00 0.00 O ATOM 662 CB LYS A 42 -10.321 9.100 3.151 1.00 0.00 C ATOM 663 CG LYS A 42 -9.409 10.237 2.677 1.00 0.00 C ATOM 664 CD LYS A 42 -9.848 11.653 3.122 1.00 0.00 C ATOM 665 CE LYS A 42 -10.723 12.477 2.155 1.00 0.00 C ATOM 666 NZ LYS A 42 -10.304 12.341 0.749 1.00 0.00 N ATOM 0 H LYS A 42 -12.163 7.858 4.100 1.00 0.00 H new ATOM 0 HA LYS A 42 -12.093 10.260 2.660 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -10.361 9.098 4.240 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -9.896 8.144 2.846 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -8.400 10.052 3.047 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -9.359 10.213 1.588 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -10.391 11.554 4.062 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -8.948 12.231 3.333 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -11.761 12.160 2.252 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -10.682 13.528 2.441 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -10.633 13.166 0.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -9.267 12.285 0.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -10.717 11.476 0.346 1.00 0.00 H new ATOM 680 N PHE A 43 -12.161 7.716 0.659 1.00 0.00 N ATOM 681 CA PHE A 43 -12.198 7.351 -0.755 1.00 0.00 C ATOM 682 C PHE A 43 -13.434 7.913 -1.441 1.00 0.00 C ATOM 683 O PHE A 43 -14.536 7.431 -1.194 1.00 0.00 O ATOM 684 CB PHE A 43 -12.171 5.828 -0.930 1.00 0.00 C ATOM 685 CG PHE A 43 -10.817 5.179 -0.756 1.00 0.00 C ATOM 686 CD1 PHE A 43 -10.301 5.005 0.534 1.00 0.00 C ATOM 687 CD2 PHE A 43 -10.007 4.892 -1.873 1.00 0.00 C ATOM 688 CE1 PHE A 43 -8.970 4.595 0.712 1.00 0.00 C ATOM 689 CE2 PHE A 43 -8.699 4.412 -1.690 1.00 0.00 C ATOM 690 CZ PHE A 43 -8.187 4.231 -0.395 1.00 0.00 C ATOM 0 H PHE A 43 -12.441 6.965 1.290 1.00 0.00 H new ATOM 0 HA PHE A 43 -11.311 7.782 -1.219 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -12.862 5.385 -0.213 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -12.545 5.587 -1.925 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -10.928 5.187 1.394 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -10.392 5.041 -2.871 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -8.547 4.559 1.705 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -8.085 4.181 -2.548 1.00 0.00 H new ATOM 0 HZ PHE A 43 -7.200 3.816 -0.252 1.00 0.00 H new ATOM 700 N ASP A 44 -13.261 8.807 -2.418 1.00 0.00 N ATOM 701 CA ASP A 44 -14.391 9.385 -3.135 1.00 0.00 C ATOM 702 C ASP A 44 -15.226 8.281 -3.789 1.00 0.00 C ATOM 703 O ASP A 44 -16.454 8.314 -3.743 1.00 0.00 O ATOM 704 CB ASP A 44 -13.896 10.359 -4.212 1.00 0.00 C ATOM 705 CG ASP A 44 -15.067 10.980 -4.966 1.00 0.00 C ATOM 706 OD1 ASP A 44 -15.696 11.891 -4.386 1.00 0.00 O ATOM 707 OD2 ASP A 44 -15.314 10.534 -6.107 1.00 0.00 O ATOM 0 H ASP A 44 -12.349 9.143 -2.727 1.00 0.00 H new ATOM 0 HA ASP A 44 -15.011 9.926 -2.420 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -13.298 11.145 -3.750 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -13.246 9.834 -4.912 1.00 0.00 H new ATOM 712 N ARG A 45 -14.560 7.297 -4.403 1.00 0.00 N ATOM 713 CA ARG A 45 -15.252 6.216 -5.087 1.00 0.00 C ATOM 714 C ARG A 45 -15.782 5.169 -4.100 1.00 0.00 C ATOM 715 O ARG A 45 -16.846 4.583 -4.327 1.00 0.00 O ATOM 716 CB ARG A 45 -14.319 5.532 -6.087 1.00 0.00 C ATOM 717 CG ARG A 45 -13.616 6.447 -7.096 1.00 0.00 C ATOM 718 CD ARG A 45 -12.838 5.540 -8.059 1.00 0.00 C ATOM 719 NE ARG A 45 -11.852 6.285 -8.848 1.00 0.00 N ATOM 720 CZ ARG A 45 -10.946 5.706 -9.651 1.00 0.00 C ATOM 721 NH1 ARG A 45 -10.968 4.382 -9.859 1.00 0.00 N ATOM 722 NH2 ARG A 45 -10.018 6.465 -10.243 1.00 0.00 N ATOM 0 H ARG A 45 -13.543 7.233 -4.436 1.00 0.00 H new ATOM 0 HA ARG A 45 -16.098 6.658 -5.613 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -13.556 4.990 -5.528 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -14.895 4.791 -6.641 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -14.342 7.052 -7.638 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -12.943 7.137 -6.587 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -12.331 4.760 -7.491 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -13.537 5.042 -8.731 1.00 0.00 H new ATOM 0 HE ARG A 45 -11.855 7.303 -8.783 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -11.677 3.806 -9.405 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -10.275 3.950 -10.471 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -10.004 7.472 -10.082 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -9.324 6.037 -10.856 1.00 0.00 H new ATOM 736 N PHE A 46 -15.011 4.842 -3.052 1.00 0.00 N ATOM 737 CA PHE A 46 -15.411 3.801 -2.118 1.00 0.00 C ATOM 738 C PHE A 46 -16.284 4.237 -0.952 1.00 0.00 C ATOM 739 O PHE A 46 -16.821 3.367 -0.277 1.00 0.00 O ATOM 740 CB PHE A 46 -14.247 2.892 -1.688 1.00 0.00 C ATOM 741 CG PHE A 46 -13.532 2.215 -2.838 1.00 0.00 C ATOM 742 CD1 PHE A 46 -14.271 1.624 -3.878 1.00 0.00 C ATOM 743 CD2 PHE A 46 -12.143 2.371 -2.973 1.00 0.00 C ATOM 744 CE1 PHE A 46 -13.654 1.365 -5.108 1.00 0.00 C ATOM 745 CE2 PHE A 46 -11.516 2.074 -4.194 1.00 0.00 C ATOM 746 CZ PHE A 46 -12.287 1.627 -5.278 1.00 0.00 C ATOM 0 H PHE A 46 -14.117 5.284 -2.839 1.00 0.00 H new ATOM 0 HA PHE A 46 -16.088 3.192 -2.717 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -13.526 3.485 -1.125 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -14.628 2.127 -1.011 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -15.310 1.371 -3.729 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -11.556 2.720 -2.136 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -14.232 0.963 -5.927 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -10.447 2.189 -4.298 1.00 0.00 H new ATOM 0 HZ PHE A 46 -11.827 1.485 -6.245 1.00 0.00 H new ATOM 756 N LYS A 47 -16.457 5.534 -0.703 1.00 0.00 N ATOM 757 CA LYS A 47 -17.319 6.031 0.365 1.00 0.00 C ATOM 758 C LYS A 47 -18.703 5.352 0.357 1.00 0.00 C ATOM 759 O LYS A 47 -19.335 5.228 1.402 1.00 0.00 O ATOM 760 CB LYS A 47 -17.428 7.556 0.220 1.00 0.00 C ATOM 761 CG LYS A 47 -18.283 8.220 1.307 1.00 0.00 C ATOM 762 CD LYS A 47 -18.048 9.740 1.348 1.00 0.00 C ATOM 763 CE LYS A 47 -18.261 10.436 -0.004 1.00 0.00 C ATOM 764 NZ LYS A 47 -19.607 10.186 -0.546 1.00 0.00 N ATOM 0 H LYS A 47 -16.001 6.272 -1.239 1.00 0.00 H new ATOM 0 HA LYS A 47 -16.879 5.784 1.331 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -16.427 7.987 0.244 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -17.852 7.790 -0.757 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -19.337 8.017 1.119 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -18.043 7.786 2.278 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -18.720 10.182 2.084 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -17.031 9.932 1.689 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -18.111 11.509 0.113 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -17.513 10.085 -0.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -19.733 10.728 -1.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -19.718 9.171 -0.746 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -20.322 10.482 0.149 1.00 0.00 H new ATOM 778 N HIS A 48 -19.182 4.914 -0.817 1.00 0.00 N ATOM 779 CA HIS A 48 -20.487 4.273 -0.963 1.00 0.00 C ATOM 780 C HIS A 48 -20.508 2.783 -0.585 1.00 0.00 C ATOM 781 O HIS A 48 -21.585 2.184 -0.568 1.00 0.00 O ATOM 782 CB HIS A 48 -21.041 4.505 -2.377 1.00 0.00 C ATOM 783 CG HIS A 48 -20.588 3.523 -3.434 1.00 0.00 C ATOM 784 ND1 HIS A 48 -19.336 3.442 -4.017 1.00 0.00 N ATOM 785 CD2 HIS A 48 -21.406 2.635 -4.074 1.00 0.00 C ATOM 786 CE1 HIS A 48 -19.404 2.531 -5.004 1.00 0.00 C ATOM 787 NE2 HIS A 48 -20.650 2.028 -5.055 1.00 0.00 N ATOM 0 H HIS A 48 -18.668 4.998 -1.694 1.00 0.00 H new ATOM 0 HA HIS A 48 -21.143 4.753 -0.237 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -22.130 4.480 -2.328 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -20.759 5.508 -2.696 1.00 0.00 H new ATOM 0 HD1 HIS A 48 -18.510 3.977 -3.747 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -22.446 2.445 -3.854 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -18.588 2.248 -5.652 1.00 0.00 H new ATOM 796 N LEU A 49 -19.353 2.158 -0.326 1.00 0.00 N ATOM 797 CA LEU A 49 -19.311 0.764 0.102 1.00 0.00 C ATOM 798 C LEU A 49 -19.769 0.707 1.559 1.00 0.00 C ATOM 799 O LEU A 49 -19.117 1.259 2.440 1.00 0.00 O ATOM 800 CB LEU A 49 -17.917 0.134 -0.070 1.00 0.00 C ATOM 801 CG LEU A 49 -17.628 -0.403 -1.485 1.00 0.00 C ATOM 802 CD1 LEU A 49 -18.038 0.559 -2.602 1.00 0.00 C ATOM 803 CD2 LEU A 49 -16.133 -0.693 -1.629 1.00 0.00 C ATOM 0 H LEU A 49 -18.437 2.600 -0.407 1.00 0.00 H new ATOM 0 HA LEU A 49 -19.977 0.177 -0.530 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -17.162 0.878 0.183 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -17.811 -0.683 0.644 1.00 0.00 H new ATOM 0 HG LEU A 49 -18.227 -1.307 -1.593 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -17.805 0.114 -3.569 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -19.109 0.753 -2.541 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -17.493 1.497 -2.493 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -15.931 -1.073 -2.631 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -15.567 0.225 -1.468 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -15.834 -1.438 -0.891 1.00 0.00 H new ATOM 815 N LYS A 50 -20.906 0.053 1.791 1.00 0.00 N ATOM 816 CA LYS A 50 -21.558 -0.043 3.084 1.00 0.00 C ATOM 817 C LYS A 50 -20.949 -1.152 3.942 1.00 0.00 C ATOM 818 O LYS A 50 -20.662 -0.932 5.116 1.00 0.00 O ATOM 819 CB LYS A 50 -23.058 -0.272 2.851 1.00 0.00 C ATOM 820 CG LYS A 50 -23.676 0.859 2.010 1.00 0.00 C ATOM 821 CD LYS A 50 -24.972 0.406 1.326 1.00 0.00 C ATOM 822 CE LYS A 50 -25.400 1.397 0.235 1.00 0.00 C ATOM 823 NZ LYS A 50 -24.445 1.432 -0.894 1.00 0.00 N ATOM 0 H LYS A 50 -21.411 -0.440 1.055 1.00 0.00 H new ATOM 0 HA LYS A 50 -21.409 0.885 3.637 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -23.208 -1.226 2.346 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -23.571 -0.336 3.811 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -23.881 1.718 2.648 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -22.960 1.186 1.256 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -24.829 -0.582 0.888 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -25.765 0.314 2.068 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -26.388 1.123 -0.135 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -25.487 2.394 0.666 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -24.892 1.892 -1.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -23.598 1.967 -0.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -24.173 0.461 -1.149 1.00 0.00 H new ATOM 837 N THR A 51 -20.747 -2.344 3.372 1.00 0.00 N ATOM 838 CA THR A 51 -20.215 -3.477 4.116 1.00 0.00 C ATOM 839 C THR A 51 -19.662 -4.546 3.163 1.00 0.00 C ATOM 840 O THR A 51 -19.325 -4.269 2.007 1.00 0.00 O ATOM 841 CB THR A 51 -21.291 -3.998 5.102 1.00 0.00 C ATOM 842 OG1 THR A 51 -20.772 -5.013 5.942 1.00 0.00 O ATOM 843 CG2 THR A 51 -22.547 -4.518 4.391 1.00 0.00 C ATOM 0 H THR A 51 -20.947 -2.544 2.392 1.00 0.00 H new ATOM 0 HA THR A 51 -19.362 -3.167 4.720 1.00 0.00 H new ATOM 0 HB THR A 51 -21.580 -3.139 5.707 1.00 0.00 H new ATOM 0 HG1 THR A 51 -21.473 -5.321 6.554 1.00 0.00 H new ATOM 0 HG21 THR A 51 -23.265 -4.870 5.132 1.00 0.00 H new ATOM 0 HG22 THR A 51 -22.993 -3.714 3.806 1.00 0.00 H new ATOM 0 HG23 THR A 51 -22.276 -5.341 3.729 1.00 0.00 H new ATOM 851 N GLU A 52 -19.518 -5.770 3.674 1.00 0.00 N ATOM 852 CA GLU A 52 -19.010 -6.909 2.933 1.00 0.00 C ATOM 853 C GLU A 52 -19.993 -7.282 1.815 1.00 0.00 C ATOM 854 O GLU A 52 -21.123 -6.801 1.771 1.00 0.00 O ATOM 855 CB GLU A 52 -18.728 -8.061 3.916 1.00 0.00 C ATOM 856 CG GLU A 52 -17.972 -9.255 3.310 1.00 0.00 C ATOM 857 CD GLU A 52 -16.699 -8.828 2.583 1.00 0.00 C ATOM 858 OE1 GLU A 52 -15.653 -8.728 3.260 1.00 0.00 O ATOM 859 OE2 GLU A 52 -16.814 -8.579 1.362 1.00 0.00 O ATOM 0 H GLU A 52 -19.760 -5.995 4.639 1.00 0.00 H new ATOM 0 HA GLU A 52 -18.067 -6.669 2.442 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -18.151 -7.671 4.755 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -19.676 -8.416 4.319 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -17.716 -9.960 4.101 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -18.626 -9.781 2.614 1.00 0.00 H new ATOM 866 N ALA A 53 -19.524 -8.064 0.842 1.00 0.00 N ATOM 867 CA ALA A 53 -20.218 -8.532 -0.347 1.00 0.00 C ATOM 868 C ALA A 53 -20.196 -7.434 -1.402 1.00 0.00 C ATOM 869 O ALA A 53 -19.818 -7.667 -2.546 1.00 0.00 O ATOM 870 CB ALA A 53 -21.618 -9.055 -0.007 1.00 0.00 C ATOM 0 H ALA A 53 -18.566 -8.413 0.873 1.00 0.00 H new ATOM 0 HA ALA A 53 -19.701 -9.392 -0.772 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -22.110 -9.397 -0.918 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -21.536 -9.885 0.695 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -22.206 -8.255 0.444 1.00 0.00 H new ATOM 876 N GLU A 54 -20.499 -6.210 -0.971 1.00 0.00 N ATOM 877 CA GLU A 54 -20.435 -5.025 -1.812 1.00 0.00 C ATOM 878 C GLU A 54 -18.946 -4.815 -2.080 1.00 0.00 C ATOM 879 O GLU A 54 -18.499 -4.843 -3.222 1.00 0.00 O ATOM 880 CB GLU A 54 -21.119 -3.834 -1.118 1.00 0.00 C ATOM 881 CG GLU A 54 -21.329 -2.664 -2.091 1.00 0.00 C ATOM 882 CD GLU A 54 -22.158 -1.538 -1.477 1.00 0.00 C ATOM 883 OE1 GLU A 54 -22.114 -1.405 -0.235 1.00 0.00 O ATOM 884 OE2 GLU A 54 -22.824 -0.828 -2.261 1.00 0.00 O ATOM 0 H GLU A 54 -20.799 -6.016 -0.016 1.00 0.00 H new ATOM 0 HA GLU A 54 -20.972 -5.132 -2.755 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -22.081 -4.150 -0.713 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -20.511 -3.504 -0.275 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -20.359 -2.272 -2.398 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -21.825 -3.028 -2.991 1.00 0.00 H new ATOM 891 N MET A 55 -18.163 -4.767 -0.995 1.00 0.00 N ATOM 892 CA MET A 55 -16.713 -4.654 -1.063 1.00 0.00 C ATOM 893 C MET A 55 -16.146 -5.721 -2.020 1.00 0.00 C ATOM 894 O MET A 55 -15.507 -5.402 -3.023 1.00 0.00 O ATOM 895 CB MET A 55 -16.138 -4.773 0.361 1.00 0.00 C ATOM 896 CG MET A 55 -15.630 -3.421 0.875 1.00 0.00 C ATOM 897 SD MET A 55 -14.947 -3.366 2.553 1.00 0.00 S ATOM 898 CE MET A 55 -16.439 -3.643 3.526 1.00 0.00 C ATOM 0 H MET A 55 -18.526 -4.806 -0.043 1.00 0.00 H new ATOM 0 HA MET A 55 -16.421 -3.684 -1.464 1.00 0.00 H new ATOM 0 HB2 MET A 55 -16.906 -5.154 1.034 1.00 0.00 H new ATOM 0 HB3 MET A 55 -15.322 -5.496 0.366 1.00 0.00 H new ATOM 0 HG2 MET A 55 -14.862 -3.067 0.188 1.00 0.00 H new ATOM 0 HG3 MET A 55 -16.455 -2.710 0.824 1.00 0.00 H new ATOM 0 HE1 MET A 55 -16.212 -3.515 4.584 1.00 0.00 H new ATOM 0 HE2 MET A 55 -17.205 -2.926 3.230 1.00 0.00 H new ATOM 0 HE3 MET A 55 -16.803 -4.656 3.353 1.00 0.00 H new ATOM 908 N LYS A 56 -16.534 -6.986 -1.813 1.00 0.00 N ATOM 909 CA LYS A 56 -16.061 -8.093 -2.638 1.00 0.00 C ATOM 910 C LYS A 56 -16.442 -7.916 -4.115 1.00 0.00 C ATOM 911 O LYS A 56 -15.644 -8.215 -5.004 1.00 0.00 O ATOM 912 CB LYS A 56 -16.602 -9.417 -2.082 1.00 0.00 C ATOM 913 CG LYS A 56 -15.947 -10.631 -2.756 1.00 0.00 C ATOM 914 CD LYS A 56 -16.342 -11.959 -2.095 1.00 0.00 C ATOM 915 CE LYS A 56 -17.840 -12.261 -2.231 1.00 0.00 C ATOM 916 NZ LYS A 56 -18.161 -13.604 -1.715 1.00 0.00 N ATOM 0 H LYS A 56 -17.179 -7.264 -1.074 1.00 0.00 H new ATOM 0 HA LYS A 56 -14.972 -8.106 -2.598 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -16.425 -9.459 -1.007 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -17.681 -9.459 -2.229 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -16.231 -10.655 -3.808 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -14.863 -10.520 -2.721 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -15.769 -12.770 -2.545 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -16.075 -11.929 -1.039 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -18.416 -11.512 -1.687 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -18.134 -12.191 -3.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -19.180 -13.782 -1.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -17.628 -14.318 -2.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -17.901 -13.661 -0.710 1.00 0.00 H new ATOM 930 N ALA A 57 -17.673 -7.473 -4.384 1.00 0.00 N ATOM 931 CA ALA A 57 -18.160 -7.283 -5.742 1.00 0.00 C ATOM 932 C ALA A 57 -17.690 -5.967 -6.368 1.00 0.00 C ATOM 933 O ALA A 57 -17.992 -5.716 -7.535 1.00 0.00 O ATOM 934 CB ALA A 57 -19.690 -7.376 -5.750 1.00 0.00 C ATOM 0 H ALA A 57 -18.355 -7.238 -3.663 1.00 0.00 H new ATOM 0 HA ALA A 57 -17.737 -8.076 -6.358 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -20.058 -7.234 -6.766 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -19.997 -8.357 -5.387 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -20.105 -6.603 -5.103 1.00 0.00 H new ATOM 940 N SER A 58 -17.003 -5.095 -5.623 1.00 0.00 N ATOM 941 CA SER A 58 -16.545 -3.841 -6.193 1.00 0.00 C ATOM 942 C SER A 58 -15.382 -4.087 -7.158 1.00 0.00 C ATOM 943 O SER A 58 -14.219 -4.178 -6.771 1.00 0.00 O ATOM 944 CB SER A 58 -16.233 -2.812 -5.102 1.00 0.00 C ATOM 945 OG SER A 58 -15.772 -1.612 -5.703 1.00 0.00 O ATOM 0 H SER A 58 -16.759 -5.237 -4.643 1.00 0.00 H new ATOM 0 HA SER A 58 -17.350 -3.403 -6.783 1.00 0.00 H new ATOM 0 HB2 SER A 58 -17.125 -2.614 -4.507 1.00 0.00 H new ATOM 0 HB3 SER A 58 -15.477 -3.205 -4.422 1.00 0.00 H new ATOM 0 HG SER A 58 -15.573 -0.952 -5.006 1.00 0.00 H new ATOM 951 N GLU A 59 -15.708 -4.192 -8.446 1.00 0.00 N ATOM 952 CA GLU A 59 -14.725 -4.348 -9.503 1.00 0.00 C ATOM 953 C GLU A 59 -13.778 -3.147 -9.496 1.00 0.00 C ATOM 954 O GLU A 59 -12.580 -3.293 -9.712 1.00 0.00 O ATOM 955 CB GLU A 59 -15.434 -4.521 -10.849 1.00 0.00 C ATOM 956 CG GLU A 59 -16.284 -5.798 -10.884 1.00 0.00 C ATOM 957 CD GLU A 59 -16.964 -5.961 -12.240 1.00 0.00 C ATOM 958 OE1 GLU A 59 -18.073 -5.407 -12.388 1.00 0.00 O ATOM 959 OE2 GLU A 59 -16.350 -6.622 -13.107 1.00 0.00 O ATOM 0 H GLU A 59 -16.671 -4.170 -8.782 1.00 0.00 H new ATOM 0 HA GLU A 59 -14.127 -5.243 -9.335 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -16.069 -3.656 -11.039 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -14.694 -4.555 -11.648 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -15.655 -6.665 -10.682 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -17.037 -5.760 -10.097 1.00 0.00 H new ATOM 966 N ASP A 60 -14.308 -1.965 -9.173 1.00 0.00 N ATOM 967 CA ASP A 60 -13.509 -0.758 -9.045 1.00 0.00 C ATOM 968 C ASP A 60 -12.551 -0.926 -7.862 1.00 0.00 C ATOM 969 O ASP A 60 -11.382 -0.568 -7.969 1.00 0.00 O ATOM 970 CB ASP A 60 -14.421 0.468 -8.921 1.00 0.00 C ATOM 971 CG ASP A 60 -13.647 1.774 -8.747 1.00 0.00 C ATOM 972 OD1 ASP A 60 -12.625 1.957 -9.445 1.00 0.00 O ATOM 973 OD2 ASP A 60 -14.113 2.589 -7.924 1.00 0.00 O ATOM 0 H ASP A 60 -15.302 -1.824 -8.994 1.00 0.00 H new ATOM 0 HA ASP A 60 -12.904 -0.594 -9.937 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -15.047 0.539 -9.810 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -15.089 0.332 -8.071 1.00 0.00 H new ATOM 978 N LEU A 61 -13.011 -1.507 -6.744 1.00 0.00 N ATOM 979 CA LEU A 61 -12.115 -1.785 -5.619 1.00 0.00 C ATOM 980 C LEU A 61 -11.023 -2.743 -6.080 1.00 0.00 C ATOM 981 O LEU A 61 -9.844 -2.449 -5.916 1.00 0.00 O ATOM 982 CB LEU A 61 -12.878 -2.316 -4.402 1.00 0.00 C ATOM 983 CG LEU A 61 -12.015 -2.524 -3.153 1.00 0.00 C ATOM 984 CD1 LEU A 61 -11.618 -1.176 -2.564 1.00 0.00 C ATOM 985 CD2 LEU A 61 -12.814 -3.309 -2.107 1.00 0.00 C ATOM 0 H LEU A 61 -13.981 -1.788 -6.598 1.00 0.00 H new ATOM 0 HA LEU A 61 -11.649 -0.855 -5.293 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -13.682 -1.621 -4.161 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -13.346 -3.264 -4.667 1.00 0.00 H new ATOM 0 HG LEU A 61 -11.118 -3.077 -3.430 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -11.005 -1.333 -1.677 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -11.050 -0.610 -3.302 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -12.515 -0.620 -2.291 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -12.201 -3.458 -1.218 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -13.711 -2.751 -1.840 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -13.098 -4.278 -2.518 1.00 0.00 H new ATOM 997 N LYS A 62 -11.389 -3.808 -6.802 1.00 0.00 N ATOM 998 CA LYS A 62 -10.398 -4.769 -7.278 1.00 0.00 C ATOM 999 C LYS A 62 -9.362 -4.059 -8.167 1.00 0.00 C ATOM 1000 O LYS A 62 -8.152 -4.189 -7.972 1.00 0.00 O ATOM 1001 CB LYS A 62 -11.093 -5.947 -7.984 1.00 0.00 C ATOM 1002 CG LYS A 62 -10.125 -7.113 -8.236 1.00 0.00 C ATOM 1003 CD LYS A 62 -10.741 -8.210 -9.123 1.00 0.00 C ATOM 1004 CE LYS A 62 -11.518 -9.291 -8.355 1.00 0.00 C ATOM 1005 NZ LYS A 62 -12.669 -8.758 -7.607 1.00 0.00 N ATOM 0 H LYS A 62 -12.351 -4.021 -7.065 1.00 0.00 H new ATOM 0 HA LYS A 62 -9.854 -5.191 -6.433 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -11.929 -6.293 -7.376 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -11.508 -5.608 -8.933 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -9.220 -6.733 -8.710 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -9.828 -7.547 -7.281 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -11.411 -7.742 -9.844 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -9.944 -8.689 -9.692 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -11.869 -10.046 -9.059 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -10.842 -9.791 -7.661 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -13.366 -9.515 -7.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -12.347 -8.396 -6.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -13.108 -7.986 -8.149 1.00 0.00 H new ATOM 1019 N LYS A 63 -9.845 -3.259 -9.123 1.00 0.00 N ATOM 1020 CA LYS A 63 -9.015 -2.462 -10.014 1.00 0.00 C ATOM 1021 C LYS A 63 -8.130 -1.518 -9.196 1.00 0.00 C ATOM 1022 O LYS A 63 -6.991 -1.228 -9.584 1.00 0.00 O ATOM 1023 CB LYS A 63 -9.920 -1.685 -10.983 1.00 0.00 C ATOM 1024 CG LYS A 63 -9.115 -0.961 -12.074 1.00 0.00 C ATOM 1025 CD LYS A 63 -10.009 -0.122 -12.999 1.00 0.00 C ATOM 1026 CE LYS A 63 -10.658 1.059 -12.264 1.00 0.00 C ATOM 1027 NZ LYS A 63 -11.322 1.985 -13.198 1.00 0.00 N ATOM 0 H LYS A 63 -10.844 -3.150 -9.298 1.00 0.00 H new ATOM 0 HA LYS A 63 -8.360 -3.110 -10.596 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -10.625 -2.373 -11.450 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -10.508 -0.957 -10.424 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -8.373 -0.315 -11.606 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -8.570 -1.695 -12.667 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -9.415 0.253 -13.833 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -10.788 -0.756 -13.422 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -11.386 0.684 -11.545 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -9.898 1.597 -11.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -11.748 2.769 -12.665 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -10.623 2.362 -13.869 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -12.064 1.478 -13.721 1.00 0.00 H new ATOM 1041 N HIS A 64 -8.662 -0.954 -8.106 1.00 0.00 N ATOM 1042 CA HIS A 64 -7.827 -0.127 -7.272 1.00 0.00 C ATOM 1043 C HIS A 64 -6.731 -0.965 -6.668 1.00 0.00 C ATOM 1044 O HIS A 64 -5.580 -0.571 -6.735 1.00 0.00 O ATOM 1045 CB HIS A 64 -8.557 0.606 -6.145 1.00 0.00 C ATOM 1046 CG HIS A 64 -7.983 1.978 -5.959 1.00 0.00 C ATOM 1047 ND1 HIS A 64 -7.534 2.791 -6.972 1.00 0.00 N ATOM 1048 CD2 HIS A 64 -7.731 2.608 -4.771 1.00 0.00 C ATOM 1049 CE1 HIS A 64 -6.993 3.875 -6.409 1.00 0.00 C ATOM 1050 NE2 HIS A 64 -7.113 3.825 -5.072 1.00 0.00 N ATOM 0 H HIS A 64 -9.630 -1.057 -7.801 1.00 0.00 H new ATOM 0 HA HIS A 64 -7.437 0.645 -7.935 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -9.620 0.677 -6.377 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -8.471 0.040 -5.218 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -7.966 2.235 -3.785 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -6.524 4.681 -6.954 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -6.812 4.537 -4.406 1.00 0.00 H new ATOM 1058 N GLY A 65 -7.080 -2.123 -6.117 1.00 0.00 N ATOM 1059 CA GLY A 65 -6.128 -3.039 -5.530 1.00 0.00 C ATOM 1060 C GLY A 65 -4.975 -3.277 -6.510 1.00 0.00 C ATOM 1061 O GLY A 65 -3.810 -3.184 -6.128 1.00 0.00 O ATOM 0 H GLY A 65 -8.045 -2.449 -6.069 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -5.745 -2.632 -4.594 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -6.616 -3.984 -5.291 1.00 0.00 H new ATOM 1065 N VAL A 66 -5.304 -3.488 -7.790 1.00 0.00 N ATOM 1066 CA VAL A 66 -4.321 -3.664 -8.855 1.00 0.00 C ATOM 1067 C VAL A 66 -3.472 -2.396 -8.942 1.00 0.00 C ATOM 1068 O VAL A 66 -2.260 -2.463 -8.790 1.00 0.00 O ATOM 1069 CB VAL A 66 -4.986 -3.964 -10.216 1.00 0.00 C ATOM 1070 CG1 VAL A 66 -3.950 -4.021 -11.349 1.00 0.00 C ATOM 1071 CG2 VAL A 66 -5.713 -5.307 -10.200 1.00 0.00 C ATOM 0 H VAL A 66 -6.270 -3.541 -8.114 1.00 0.00 H new ATOM 0 HA VAL A 66 -3.696 -4.525 -8.617 1.00 0.00 H new ATOM 0 HB VAL A 66 -5.693 -3.152 -10.389 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -4.453 -4.234 -12.292 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -3.436 -3.062 -11.421 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -3.224 -4.807 -11.139 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -6.169 -5.485 -11.174 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -5.002 -6.103 -9.981 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -6.488 -5.292 -9.434 1.00 0.00 H new ATOM 1081 N THR A 67 -4.105 -1.238 -9.142 1.00 0.00 N ATOM 1082 CA THR A 67 -3.435 0.057 -9.247 1.00 0.00 C ATOM 1083 C THR A 67 -2.427 0.257 -8.102 1.00 0.00 C ATOM 1084 O THR A 67 -1.259 0.586 -8.309 1.00 0.00 O ATOM 1085 CB THR A 67 -4.526 1.148 -9.272 1.00 0.00 C ATOM 1086 OG1 THR A 67 -5.408 0.931 -10.357 1.00 0.00 O ATOM 1087 CG2 THR A 67 -4.017 2.589 -9.351 1.00 0.00 C ATOM 0 H THR A 67 -5.119 -1.175 -9.237 1.00 0.00 H new ATOM 0 HA THR A 67 -2.850 0.113 -10.165 1.00 0.00 H new ATOM 0 HB THR A 67 -5.026 1.050 -8.308 1.00 0.00 H new ATOM 0 HG1 THR A 67 -6.061 0.241 -10.115 1.00 0.00 H new ATOM 0 HG21 THR A 67 -4.865 3.274 -9.363 1.00 0.00 H new ATOM 0 HG22 THR A 67 -3.391 2.802 -8.485 1.00 0.00 H new ATOM 0 HG23 THR A 67 -3.433 2.719 -10.262 1.00 0.00 H new ATOM 1095 N VAL A 68 -2.907 0.024 -6.887 1.00 0.00 N ATOM 1096 CA VAL A 68 -2.222 0.220 -5.622 1.00 0.00 C ATOM 1097 C VAL A 68 -1.057 -0.763 -5.468 1.00 0.00 C ATOM 1098 O VAL A 68 0.095 -0.346 -5.340 1.00 0.00 O ATOM 1099 CB VAL A 68 -3.333 0.186 -4.550 1.00 0.00 C ATOM 1100 CG1 VAL A 68 -2.965 -0.044 -3.091 1.00 0.00 C ATOM 1101 CG2 VAL A 68 -4.069 1.529 -4.584 1.00 0.00 C ATOM 0 H VAL A 68 -3.853 -0.332 -6.754 1.00 0.00 H new ATOM 0 HA VAL A 68 -1.706 1.176 -5.530 1.00 0.00 H new ATOM 0 HB VAL A 68 -3.902 -0.699 -4.836 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -3.869 -0.037 -2.482 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -2.467 -1.008 -2.989 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -2.295 0.748 -2.756 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -4.860 1.529 -3.834 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -3.366 2.334 -4.371 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -4.505 1.680 -5.571 1.00 0.00 H new ATOM 1111 N LEU A 69 -1.314 -2.070 -5.525 1.00 0.00 N ATOM 1112 CA LEU A 69 -0.247 -3.056 -5.400 1.00 0.00 C ATOM 1113 C LEU A 69 0.721 -3.015 -6.575 1.00 0.00 C ATOM 1114 O LEU A 69 1.903 -3.268 -6.380 1.00 0.00 O ATOM 1115 CB LEU A 69 -0.798 -4.463 -5.151 1.00 0.00 C ATOM 1116 CG LEU A 69 -1.530 -4.582 -3.804 1.00 0.00 C ATOM 1117 CD1 LEU A 69 -1.481 -6.034 -3.321 1.00 0.00 C ATOM 1118 CD2 LEU A 69 -0.985 -3.722 -2.655 1.00 0.00 C ATOM 0 H LEU A 69 -2.245 -2.466 -5.656 1.00 0.00 H new ATOM 0 HA LEU A 69 0.332 -2.782 -4.518 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -1.482 -4.729 -5.957 1.00 0.00 H new ATOM 0 HB3 LEU A 69 0.022 -5.181 -5.179 1.00 0.00 H new ATOM 0 HG LEU A 69 -2.535 -4.220 -4.023 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -2.000 -6.118 -2.366 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -1.965 -6.678 -4.055 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -0.443 -6.342 -3.198 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -1.582 -3.892 -1.759 1.00 0.00 H new ATOM 0 HD22 LEU A 69 0.052 -3.994 -2.457 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -1.037 -2.669 -2.932 1.00 0.00 H new ATOM 1130 N THR A 70 0.271 -2.674 -7.782 1.00 0.00 N ATOM 1131 CA THR A 70 1.171 -2.547 -8.924 1.00 0.00 C ATOM 1132 C THR A 70 2.073 -1.333 -8.690 1.00 0.00 C ATOM 1133 O THR A 70 3.252 -1.359 -9.038 1.00 0.00 O ATOM 1134 CB THR A 70 0.390 -2.446 -10.242 1.00 0.00 C ATOM 1135 OG1 THR A 70 -0.423 -3.592 -10.372 1.00 0.00 O ATOM 1136 CG2 THR A 70 1.320 -2.413 -11.457 1.00 0.00 C ATOM 0 H THR A 70 -0.708 -2.482 -7.992 1.00 0.00 H new ATOM 0 HA THR A 70 1.791 -3.439 -9.013 1.00 0.00 H new ATOM 0 HB THR A 70 -0.191 -1.524 -10.212 1.00 0.00 H new ATOM 0 HG1 THR A 70 -1.267 -3.451 -9.894 1.00 0.00 H new ATOM 0 HG21 THR A 70 0.726 -2.341 -12.368 1.00 0.00 H new ATOM 0 HG22 THR A 70 1.981 -1.549 -11.386 1.00 0.00 H new ATOM 0 HG23 THR A 70 1.916 -3.325 -11.484 1.00 0.00 H new ATOM 1144 N ALA A 71 1.530 -0.250 -8.119 1.00 0.00 N ATOM 1145 CA ALA A 71 2.345 0.902 -7.800 1.00 0.00 C ATOM 1146 C ALA A 71 3.386 0.538 -6.746 1.00 0.00 C ATOM 1147 O ALA A 71 4.581 0.669 -7.008 1.00 0.00 O ATOM 1148 CB ALA A 71 1.478 2.094 -7.388 1.00 0.00 C ATOM 0 H ALA A 71 0.544 -0.159 -7.876 1.00 0.00 H new ATOM 0 HA ALA A 71 2.886 1.212 -8.694 1.00 0.00 H new ATOM 0 HB1 ALA A 71 2.117 2.945 -7.154 1.00 0.00 H new ATOM 0 HB2 ALA A 71 0.808 2.357 -8.207 1.00 0.00 H new ATOM 0 HB3 ALA A 71 0.890 1.830 -6.509 1.00 0.00 H new ATOM 1154 N LEU A 72 2.953 0.116 -5.553 1.00 0.00 N ATOM 1155 CA LEU A 72 3.888 -0.287 -4.507 1.00 0.00 C ATOM 1156 C LEU A 72 4.881 -1.325 -5.061 1.00 0.00 C ATOM 1157 O LEU A 72 6.095 -1.219 -4.899 1.00 0.00 O ATOM 1158 CB LEU A 72 3.116 -0.819 -3.288 1.00 0.00 C ATOM 1159 CG LEU A 72 4.020 -1.177 -2.095 1.00 0.00 C ATOM 1160 CD1 LEU A 72 4.738 0.051 -1.525 1.00 0.00 C ATOM 1161 CD2 LEU A 72 3.177 -1.834 -0.997 1.00 0.00 C ATOM 0 H LEU A 72 1.969 0.046 -5.293 1.00 0.00 H new ATOM 0 HA LEU A 72 4.466 0.577 -4.178 1.00 0.00 H new ATOM 0 HB2 LEU A 72 2.391 -0.069 -2.972 1.00 0.00 H new ATOM 0 HB3 LEU A 72 2.551 -1.703 -3.584 1.00 0.00 H new ATOM 0 HG LEU A 72 4.784 -1.868 -2.453 1.00 0.00 H new ATOM 0 HD11 LEU A 72 5.364 -0.251 -0.685 1.00 0.00 H new ATOM 0 HD12 LEU A 72 5.361 0.500 -2.299 1.00 0.00 H new ATOM 0 HD13 LEU A 72 4.001 0.778 -1.185 1.00 0.00 H new ATOM 0 HD21 LEU A 72 3.816 -2.088 -0.151 1.00 0.00 H new ATOM 0 HD22 LEU A 72 2.401 -1.142 -0.671 1.00 0.00 H new ATOM 0 HD23 LEU A 72 2.714 -2.740 -1.387 1.00 0.00 H new ATOM 1173 N GLY A 73 4.358 -2.313 -5.783 1.00 0.00 N ATOM 1174 CA GLY A 73 5.120 -3.371 -6.426 1.00 0.00 C ATOM 1175 C GLY A 73 6.190 -2.780 -7.338 1.00 0.00 C ATOM 1176 O GLY A 73 7.323 -3.241 -7.334 1.00 0.00 O ATOM 0 H GLY A 73 3.354 -2.398 -5.940 1.00 0.00 H new ATOM 0 HA2 GLY A 73 5.587 -4.002 -5.670 1.00 0.00 H new ATOM 0 HA3 GLY A 73 4.452 -4.008 -7.005 1.00 0.00 H new ATOM 1180 N ALA A 74 5.852 -1.752 -8.118 1.00 0.00 N ATOM 1181 CA ALA A 74 6.804 -1.084 -8.995 1.00 0.00 C ATOM 1182 C ALA A 74 7.905 -0.419 -8.166 1.00 0.00 C ATOM 1183 O ALA A 74 9.083 -0.499 -8.515 1.00 0.00 O ATOM 1184 CB ALA A 74 6.097 -0.063 -9.889 1.00 0.00 C ATOM 0 H ALA A 74 4.910 -1.362 -8.157 1.00 0.00 H new ATOM 0 HA ALA A 74 7.263 -1.830 -9.644 1.00 0.00 H new ATOM 0 HB1 ALA A 74 6.828 0.423 -10.535 1.00 0.00 H new ATOM 0 HB2 ALA A 74 5.352 -0.570 -10.502 1.00 0.00 H new ATOM 0 HB3 ALA A 74 5.607 0.687 -9.268 1.00 0.00 H new ATOM 1190 N ILE A 75 7.535 0.152 -7.012 1.00 0.00 N ATOM 1191 CA ILE A 75 8.507 0.801 -6.131 1.00 0.00 C ATOM 1192 C ILE A 75 9.518 -0.276 -5.728 1.00 0.00 C ATOM 1193 O ILE A 75 10.720 -0.124 -5.947 1.00 0.00 O ATOM 1194 CB ILE A 75 7.830 1.493 -4.923 1.00 0.00 C ATOM 1195 CG1 ILE A 75 6.770 2.533 -5.332 1.00 0.00 C ATOM 1196 CG2 ILE A 75 8.854 2.175 -4.010 1.00 0.00 C ATOM 1197 CD1 ILE A 75 7.134 3.394 -6.545 1.00 0.00 C ATOM 0 H ILE A 75 6.574 0.176 -6.671 1.00 0.00 H new ATOM 0 HA ILE A 75 9.020 1.614 -6.644 1.00 0.00 H new ATOM 0 HB ILE A 75 7.331 0.687 -4.385 1.00 0.00 H new ATOM 0 HG12 ILE A 75 5.836 2.012 -5.544 1.00 0.00 H new ATOM 0 HG13 ILE A 75 6.583 3.191 -4.483 1.00 0.00 H new ATOM 0 HG21 ILE A 75 8.338 2.649 -3.175 1.00 0.00 H new ATOM 0 HG22 ILE A 75 9.554 1.431 -3.629 1.00 0.00 H new ATOM 0 HG23 ILE A 75 9.399 2.931 -4.575 1.00 0.00 H new ATOM 0 HD11 ILE A 75 6.324 4.093 -6.751 1.00 0.00 H new ATOM 0 HD12 ILE A 75 8.048 3.950 -6.336 1.00 0.00 H new ATOM 0 HD13 ILE A 75 7.290 2.753 -7.413 1.00 0.00 H new ATOM 1209 N LEU A 76 9.002 -1.391 -5.199 1.00 0.00 N ATOM 1210 CA LEU A 76 9.796 -2.549 -4.814 1.00 0.00 C ATOM 1211 C LEU A 76 10.682 -3.031 -5.975 1.00 0.00 C ATOM 1212 O LEU A 76 11.890 -3.199 -5.812 1.00 0.00 O ATOM 1213 CB LEU A 76 8.867 -3.690 -4.348 1.00 0.00 C ATOM 1214 CG LEU A 76 8.016 -3.396 -3.098 1.00 0.00 C ATOM 1215 CD1 LEU A 76 7.159 -4.626 -2.767 1.00 0.00 C ATOM 1216 CD2 LEU A 76 8.866 -3.028 -1.881 1.00 0.00 C ATOM 0 H LEU A 76 8.004 -1.510 -5.026 1.00 0.00 H new ATOM 0 HA LEU A 76 10.450 -2.255 -3.993 1.00 0.00 H new ATOM 0 HB2 LEU A 76 8.196 -3.945 -5.169 1.00 0.00 H new ATOM 0 HB3 LEU A 76 9.477 -4.571 -4.150 1.00 0.00 H new ATOM 0 HG LEU A 76 7.387 -2.536 -3.327 1.00 0.00 H new ATOM 0 HD11 LEU A 76 6.555 -4.422 -1.883 1.00 0.00 H new ATOM 0 HD12 LEU A 76 6.505 -4.851 -3.609 1.00 0.00 H new ATOM 0 HD13 LEU A 76 7.808 -5.480 -2.574 1.00 0.00 H new ATOM 0 HD21 LEU A 76 8.215 -2.831 -1.029 1.00 0.00 H new ATOM 0 HD22 LEU A 76 9.536 -3.854 -1.642 1.00 0.00 H new ATOM 0 HD23 LEU A 76 9.453 -2.137 -2.103 1.00 0.00 H new ATOM 1228 N LYS A 77 10.078 -3.272 -7.143 1.00 0.00 N ATOM 1229 CA LYS A 77 10.767 -3.793 -8.323 1.00 0.00 C ATOM 1230 C LYS A 77 11.960 -2.932 -8.717 1.00 0.00 C ATOM 1231 O LYS A 77 12.973 -3.458 -9.170 1.00 0.00 O ATOM 1232 CB LYS A 77 9.806 -3.933 -9.511 1.00 0.00 C ATOM 1233 CG LYS A 77 8.887 -5.157 -9.383 1.00 0.00 C ATOM 1234 CD LYS A 77 9.568 -6.492 -9.725 1.00 0.00 C ATOM 1235 CE LYS A 77 9.922 -6.616 -11.213 1.00 0.00 C ATOM 1236 NZ LYS A 77 10.423 -7.965 -11.529 1.00 0.00 N ATOM 0 H LYS A 77 9.083 -3.108 -7.295 1.00 0.00 H new ATOM 0 HA LYS A 77 11.141 -4.781 -8.054 1.00 0.00 H new ATOM 0 HB2 LYS A 77 9.197 -3.032 -9.590 1.00 0.00 H new ATOM 0 HB3 LYS A 77 10.382 -4.010 -10.433 1.00 0.00 H new ATOM 0 HG2 LYS A 77 8.506 -5.207 -8.363 1.00 0.00 H new ATOM 0 HG3 LYS A 77 8.027 -5.022 -10.038 1.00 0.00 H new ATOM 0 HD2 LYS A 77 10.476 -6.594 -9.131 1.00 0.00 H new ATOM 0 HD3 LYS A 77 8.909 -7.313 -9.444 1.00 0.00 H new ATOM 0 HE2 LYS A 77 9.042 -6.401 -11.818 1.00 0.00 H new ATOM 0 HE3 LYS A 77 10.677 -5.874 -11.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 10.655 -8.021 -12.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 11.277 -8.159 -10.967 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 9.692 -8.669 -11.302 1.00 0.00 H new ATOM 1250 N LYS A 78 11.837 -1.612 -8.586 1.00 0.00 N ATOM 1251 CA LYS A 78 12.915 -0.698 -8.929 1.00 0.00 C ATOM 1252 C LYS A 78 14.141 -0.812 -8.004 1.00 0.00 C ATOM 1253 O LYS A 78 15.128 -0.116 -8.237 1.00 0.00 O ATOM 1254 CB LYS A 78 12.339 0.718 -8.995 1.00 0.00 C ATOM 1255 CG LYS A 78 11.521 0.919 -10.280 1.00 0.00 C ATOM 1256 CD LYS A 78 12.231 1.874 -11.248 1.00 0.00 C ATOM 1257 CE LYS A 78 13.575 1.333 -11.756 1.00 0.00 C ATOM 1258 NZ LYS A 78 14.347 2.398 -12.417 1.00 0.00 N ATOM 0 H LYS A 78 10.993 -1.153 -8.242 1.00 0.00 H new ATOM 0 HA LYS A 78 13.311 -0.973 -9.907 1.00 0.00 H new ATOM 0 HB2 LYS A 78 11.707 0.899 -8.125 1.00 0.00 H new ATOM 0 HB3 LYS A 78 13.149 1.446 -8.957 1.00 0.00 H new ATOM 0 HG2 LYS A 78 11.361 -0.043 -10.766 1.00 0.00 H new ATOM 0 HG3 LYS A 78 10.537 1.316 -10.029 1.00 0.00 H new ATOM 0 HD2 LYS A 78 11.579 2.068 -12.100 1.00 0.00 H new ATOM 0 HD3 LYS A 78 12.396 2.829 -10.750 1.00 0.00 H new ATOM 0 HE2 LYS A 78 14.147 0.926 -10.923 1.00 0.00 H new ATOM 0 HE3 LYS A 78 13.403 0.514 -12.455 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 15.187 1.987 -12.871 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 13.755 2.860 -13.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 14.644 3.101 -11.710 1.00 0.00 H new ATOM 1272 N LYS A 79 14.119 -1.686 -6.989 1.00 0.00 N ATOM 1273 CA LYS A 79 15.233 -1.950 -6.084 1.00 0.00 C ATOM 1274 C LYS A 79 15.937 -0.687 -5.561 1.00 0.00 C ATOM 1275 O LYS A 79 17.162 -0.652 -5.476 1.00 0.00 O ATOM 1276 CB LYS A 79 16.242 -2.918 -6.728 1.00 0.00 C ATOM 1277 CG LYS A 79 15.678 -4.317 -7.009 1.00 0.00 C ATOM 1278 CD LYS A 79 16.829 -5.246 -7.430 1.00 0.00 C ATOM 1279 CE LYS A 79 16.368 -6.701 -7.577 1.00 0.00 C ATOM 1280 NZ LYS A 79 17.495 -7.597 -7.893 1.00 0.00 N ATOM 0 H LYS A 79 13.294 -2.245 -6.772 1.00 0.00 H new ATOM 0 HA LYS A 79 14.792 -2.420 -5.205 1.00 0.00 H new ATOM 0 HB2 LYS A 79 16.596 -2.486 -7.664 1.00 0.00 H new ATOM 0 HB3 LYS A 79 17.108 -3.012 -6.072 1.00 0.00 H new ATOM 0 HG2 LYS A 79 15.184 -4.709 -6.120 1.00 0.00 H new ATOM 0 HG3 LYS A 79 14.926 -4.269 -7.797 1.00 0.00 H new ATOM 0 HD2 LYS A 79 17.246 -4.901 -8.376 1.00 0.00 H new ATOM 0 HD3 LYS A 79 17.628 -5.192 -6.690 1.00 0.00 H new ATOM 0 HE2 LYS A 79 15.891 -7.027 -6.653 1.00 0.00 H new ATOM 0 HE3 LYS A 79 15.617 -6.768 -8.364 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 17.306 -8.543 -7.504 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 17.607 -7.663 -8.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 18.368 -7.218 -7.473 1.00 0.00 H new ATOM 1294 N GLY A 80 15.175 0.345 -5.184 1.00 0.00 N ATOM 1295 CA GLY A 80 15.745 1.577 -4.639 1.00 0.00 C ATOM 1296 C GLY A 80 16.086 2.620 -5.698 1.00 0.00 C ATOM 1297 O GLY A 80 16.608 3.684 -5.358 1.00 0.00 O ATOM 0 H GLY A 80 14.157 0.349 -5.248 1.00 0.00 H new ATOM 0 HA2 GLY A 80 15.039 2.010 -3.930 1.00 0.00 H new ATOM 0 HA3 GLY A 80 16.648 1.332 -4.080 1.00 0.00 H new ATOM 1301 N HIS A 81 15.858 2.320 -6.980 1.00 0.00 N ATOM 1302 CA HIS A 81 16.196 3.234 -8.056 1.00 0.00 C ATOM 1303 C HIS A 81 14.915 3.826 -8.629 1.00 0.00 C ATOM 1304 O HIS A 81 14.625 3.719 -9.825 1.00 0.00 O ATOM 1305 CB HIS A 81 17.050 2.497 -9.092 1.00 0.00 C ATOM 1306 CG HIS A 81 18.139 1.665 -8.455 1.00 0.00 C ATOM 1307 ND1 HIS A 81 18.267 0.293 -8.573 1.00 0.00 N ATOM 1308 CD2 HIS A 81 19.012 2.089 -7.487 1.00 0.00 C ATOM 1309 CE1 HIS A 81 19.226 -0.103 -7.715 1.00 0.00 C ATOM 1310 NE2 HIS A 81 19.689 0.970 -7.047 1.00 0.00 N ATOM 0 H HIS A 81 15.438 1.444 -7.291 1.00 0.00 H new ATOM 0 HA HIS A 81 16.794 4.071 -7.695 1.00 0.00 H new ATOM 0 HB2 HIS A 81 16.410 1.853 -9.694 1.00 0.00 H new ATOM 0 HB3 HIS A 81 17.500 3.222 -9.770 1.00 0.00 H new ATOM 0 HD2 HIS A 81 19.144 3.102 -7.137 1.00 0.00 H new ATOM 0 HE1 HIS A 81 19.569 -1.119 -7.584 1.00 0.00 H new ATOM 0 HE2 HIS A 81 20.419 0.958 -6.334 1.00 0.00 H new ATOM 1319 N HIS A 82 14.127 4.446 -7.752 1.00 0.00 N ATOM 1320 CA HIS A 82 12.865 5.026 -8.067 1.00 0.00 C ATOM 1321 C HIS A 82 12.871 6.431 -7.470 1.00 0.00 C ATOM 1322 O HIS A 82 13.696 6.748 -6.617 1.00 0.00 O ATOM 1323 CB HIS A 82 11.738 4.146 -7.499 1.00 0.00 C ATOM 1324 CG HIS A 82 12.016 3.592 -6.119 1.00 0.00 C ATOM 1325 ND1 HIS A 82 12.059 2.261 -5.768 1.00 0.00 N ATOM 1326 CD2 HIS A 82 12.288 4.319 -4.991 1.00 0.00 C ATOM 1327 CE1 HIS A 82 12.343 2.197 -4.460 1.00 0.00 C ATOM 1328 NE2 HIS A 82 12.506 3.422 -3.945 1.00 0.00 N ATOM 0 H HIS A 82 14.379 4.551 -6.769 1.00 0.00 H new ATOM 0 HA HIS A 82 12.693 5.090 -9.141 1.00 0.00 H new ATOM 0 HB2 HIS A 82 10.819 4.731 -7.465 1.00 0.00 H new ATOM 0 HB3 HIS A 82 11.562 3.315 -8.183 1.00 0.00 H new ATOM 0 HD2 HIS A 82 12.327 5.396 -4.923 1.00 0.00 H new ATOM 0 HE1 HIS A 82 12.429 1.280 -3.896 1.00 0.00 H new ATOM 0 HE2 HIS A 82 12.742 3.653 -2.980 1.00 0.00 H new ATOM 1336 N GLU A 83 11.924 7.240 -7.921 1.00 0.00 N ATOM 1337 CA GLU A 83 11.632 8.613 -7.498 1.00 0.00 C ATOM 1338 C GLU A 83 10.538 9.223 -8.387 1.00 0.00 C ATOM 1339 O GLU A 83 9.573 9.802 -7.886 1.00 0.00 O ATOM 1340 CB GLU A 83 12.880 9.532 -7.401 1.00 0.00 C ATOM 1341 CG GLU A 83 14.012 9.364 -8.435 1.00 0.00 C ATOM 1342 CD GLU A 83 13.570 9.635 -9.866 1.00 0.00 C ATOM 1343 OE1 GLU A 83 13.467 10.831 -10.215 1.00 0.00 O ATOM 1344 OE2 GLU A 83 13.281 8.640 -10.566 1.00 0.00 O ATOM 0 H GLU A 83 11.284 6.933 -8.653 1.00 0.00 H new ATOM 0 HA GLU A 83 11.263 8.546 -6.475 1.00 0.00 H new ATOM 0 HB2 GLU A 83 12.534 10.564 -7.456 1.00 0.00 H new ATOM 0 HB3 GLU A 83 13.315 9.394 -6.411 1.00 0.00 H new ATOM 0 HG2 GLU A 83 14.829 10.039 -8.181 1.00 0.00 H new ATOM 0 HG3 GLU A 83 14.405 8.350 -8.370 1.00 0.00 H new ATOM 1351 N ALA A 84 10.684 9.090 -9.709 1.00 0.00 N ATOM 1352 CA ALA A 84 9.788 9.665 -10.711 1.00 0.00 C ATOM 1353 C ALA A 84 8.350 9.212 -10.484 1.00 0.00 C ATOM 1354 O ALA A 84 7.418 10.001 -10.597 1.00 0.00 O ATOM 1355 CB ALA A 84 10.262 9.260 -12.109 1.00 0.00 C ATOM 0 H ALA A 84 11.453 8.563 -10.122 1.00 0.00 H new ATOM 0 HA ALA A 84 9.811 10.751 -10.621 1.00 0.00 H new ATOM 0 HB1 ALA A 84 9.595 9.688 -12.857 1.00 0.00 H new ATOM 0 HB2 ALA A 84 11.274 9.630 -12.271 1.00 0.00 H new ATOM 0 HB3 ALA A 84 10.255 8.173 -12.195 1.00 0.00 H new ATOM 1361 N GLU A 85 8.190 7.929 -10.161 1.00 0.00 N ATOM 1362 CA GLU A 85 6.910 7.289 -9.915 1.00 0.00 C ATOM 1363 C GLU A 85 6.274 7.864 -8.648 1.00 0.00 C ATOM 1364 O GLU A 85 5.082 8.157 -8.604 1.00 0.00 O ATOM 1365 CB GLU A 85 7.110 5.770 -9.770 1.00 0.00 C ATOM 1366 CG GLU A 85 8.099 5.156 -10.779 1.00 0.00 C ATOM 1367 CD GLU A 85 9.513 4.990 -10.212 1.00 0.00 C ATOM 1368 OE1 GLU A 85 10.085 6.003 -9.744 1.00 0.00 O ATOM 1369 OE2 GLU A 85 10.000 3.842 -10.251 1.00 0.00 O ATOM 0 H GLU A 85 8.979 7.290 -10.061 1.00 0.00 H new ATOM 0 HA GLU A 85 6.244 7.479 -10.757 1.00 0.00 H new ATOM 0 HB2 GLU A 85 7.462 5.558 -8.760 1.00 0.00 H new ATOM 0 HB3 GLU A 85 6.144 5.277 -9.881 1.00 0.00 H new ATOM 0 HG2 GLU A 85 7.726 4.183 -11.098 1.00 0.00 H new ATOM 0 HG3 GLU A 85 8.142 5.787 -11.666 1.00 0.00 H new ATOM 1376 N LEU A 86 7.105 8.036 -7.620 1.00 0.00 N ATOM 1377 CA LEU A 86 6.675 8.520 -6.324 1.00 0.00 C ATOM 1378 C LEU A 86 6.227 9.976 -6.361 1.00 0.00 C ATOM 1379 O LEU A 86 5.164 10.263 -5.832 1.00 0.00 O ATOM 1380 CB LEU A 86 7.772 8.270 -5.291 1.00 0.00 C ATOM 1381 CG LEU A 86 8.000 6.757 -5.104 1.00 0.00 C ATOM 1382 CD1 LEU A 86 9.456 6.390 -5.401 1.00 0.00 C ATOM 1383 CD2 LEU A 86 7.603 6.304 -3.695 1.00 0.00 C ATOM 0 H LEU A 86 8.104 7.839 -7.672 1.00 0.00 H new ATOM 0 HA LEU A 86 5.790 7.958 -6.026 1.00 0.00 H new ATOM 0 HB2 LEU A 86 8.698 8.747 -5.612 1.00 0.00 H new ATOM 0 HB3 LEU A 86 7.494 8.723 -4.339 1.00 0.00 H new ATOM 0 HG LEU A 86 7.360 6.233 -5.814 1.00 0.00 H new ATOM 0 HD11 LEU A 86 9.596 5.318 -5.263 1.00 0.00 H new ATOM 0 HD12 LEU A 86 9.696 6.658 -6.430 1.00 0.00 H new ATOM 0 HD13 LEU A 86 10.114 6.932 -4.722 1.00 0.00 H new ATOM 0 HD21 LEU A 86 7.776 5.232 -3.595 1.00 0.00 H new ATOM 0 HD22 LEU A 86 8.203 6.838 -2.958 1.00 0.00 H new ATOM 0 HD23 LEU A 86 6.547 6.519 -3.528 1.00 0.00 H new ATOM 1395 N LYS A 87 6.980 10.896 -6.974 1.00 0.00 N ATOM 1396 CA LYS A 87 6.606 12.315 -7.028 1.00 0.00 C ATOM 1397 C LYS A 87 5.096 12.611 -7.198 1.00 0.00 C ATOM 1398 O LYS A 87 4.501 13.230 -6.309 1.00 0.00 O ATOM 1399 CB LYS A 87 7.478 13.064 -8.049 1.00 0.00 C ATOM 1400 CG LYS A 87 8.848 13.390 -7.435 1.00 0.00 C ATOM 1401 CD LYS A 87 9.709 14.274 -8.350 1.00 0.00 C ATOM 1402 CE LYS A 87 10.301 13.522 -9.548 1.00 0.00 C ATOM 1403 NZ LYS A 87 11.246 12.477 -9.115 1.00 0.00 N ATOM 0 H LYS A 87 7.860 10.681 -7.444 1.00 0.00 H new ATOM 0 HA LYS A 87 6.814 12.704 -6.031 1.00 0.00 H new ATOM 0 HB2 LYS A 87 7.607 12.456 -8.944 1.00 0.00 H new ATOM 0 HB3 LYS A 87 6.981 13.984 -8.358 1.00 0.00 H new ATOM 0 HG2 LYS A 87 8.703 13.894 -6.480 1.00 0.00 H new ATOM 0 HG3 LYS A 87 9.380 12.461 -7.228 1.00 0.00 H new ATOM 0 HD2 LYS A 87 9.103 15.103 -8.715 1.00 0.00 H new ATOM 0 HD3 LYS A 87 10.521 14.706 -7.765 1.00 0.00 H new ATOM 0 HE2 LYS A 87 9.497 13.069 -10.128 1.00 0.00 H new ATOM 0 HE3 LYS A 87 10.811 14.226 -10.205 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 11.717 12.068 -9.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 11.960 12.894 -8.484 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 10.729 11.730 -8.608 1.00 0.00 H new ATOM 1417 N PRO A 88 4.440 12.202 -8.296 1.00 0.00 N ATOM 1418 CA PRO A 88 3.022 12.470 -8.499 1.00 0.00 C ATOM 1419 C PRO A 88 2.135 11.690 -7.521 1.00 0.00 C ATOM 1420 O PRO A 88 1.031 12.135 -7.200 1.00 0.00 O ATOM 1421 CB PRO A 88 2.740 12.067 -9.948 1.00 0.00 C ATOM 1422 CG PRO A 88 3.778 10.981 -10.226 1.00 0.00 C ATOM 1423 CD PRO A 88 4.984 11.465 -9.422 1.00 0.00 C ATOM 0 HA PRO A 88 2.791 13.519 -8.313 1.00 0.00 H new ATOM 0 HB2 PRO A 88 1.724 11.691 -10.069 1.00 0.00 H new ATOM 0 HB3 PRO A 88 2.851 12.912 -10.628 1.00 0.00 H new ATOM 0 HG2 PRO A 88 3.437 10.000 -9.896 1.00 0.00 H new ATOM 0 HG3 PRO A 88 4.005 10.899 -11.289 1.00 0.00 H new ATOM 0 HD2 PRO A 88 5.590 10.625 -9.083 1.00 0.00 H new ATOM 0 HD3 PRO A 88 5.629 12.100 -10.029 1.00 0.00 H new ATOM 1431 N LEU A 89 2.565 10.494 -7.106 1.00 0.00 N ATOM 1432 CA LEU A 89 1.806 9.683 -6.168 1.00 0.00 C ATOM 1433 C LEU A 89 1.773 10.390 -4.811 1.00 0.00 C ATOM 1434 O LEU A 89 0.721 10.523 -4.190 1.00 0.00 O ATOM 1435 CB LEU A 89 2.404 8.266 -6.140 1.00 0.00 C ATOM 1436 CG LEU A 89 1.506 7.180 -5.529 1.00 0.00 C ATOM 1437 CD1 LEU A 89 1.839 5.832 -6.181 1.00 0.00 C ATOM 1438 CD2 LEU A 89 1.746 7.056 -4.021 1.00 0.00 C ATOM 0 H LEU A 89 3.441 10.070 -7.411 1.00 0.00 H new ATOM 0 HA LEU A 89 0.766 9.568 -6.472 1.00 0.00 H new ATOM 0 HB2 LEU A 89 2.652 7.975 -7.161 1.00 0.00 H new ATOM 0 HB3 LEU A 89 3.339 8.296 -5.581 1.00 0.00 H new ATOM 0 HG LEU A 89 0.466 7.454 -5.704 1.00 0.00 H new ATOM 0 HD11 LEU A 89 1.206 5.055 -5.753 1.00 0.00 H new ATOM 0 HD12 LEU A 89 1.662 5.894 -7.255 1.00 0.00 H new ATOM 0 HD13 LEU A 89 2.886 5.589 -5.999 1.00 0.00 H new ATOM 0 HD21 LEU A 89 1.098 6.281 -3.612 1.00 0.00 H new ATOM 0 HD22 LEU A 89 2.788 6.792 -3.839 1.00 0.00 H new ATOM 0 HD23 LEU A 89 1.523 8.007 -3.538 1.00 0.00 H new ATOM 1450 N ALA A 90 2.924 10.909 -4.384 1.00 0.00 N ATOM 1451 CA ALA A 90 3.072 11.712 -3.185 1.00 0.00 C ATOM 1452 C ALA A 90 2.157 12.922 -3.350 1.00 0.00 C ATOM 1453 O ALA A 90 1.304 13.163 -2.504 1.00 0.00 O ATOM 1454 CB ALA A 90 4.540 12.115 -3.007 1.00 0.00 C ATOM 0 H ALA A 90 3.803 10.774 -4.884 1.00 0.00 H new ATOM 0 HA ALA A 90 2.791 11.161 -2.287 1.00 0.00 H new ATOM 0 HB1 ALA A 90 4.645 12.718 -2.105 1.00 0.00 H new ATOM 0 HB2 ALA A 90 5.155 11.219 -2.919 1.00 0.00 H new ATOM 0 HB3 ALA A 90 4.865 12.695 -3.871 1.00 0.00 H new ATOM 1460 N GLN A 91 2.304 13.664 -4.455 1.00 0.00 N ATOM 1461 CA GLN A 91 1.472 14.828 -4.730 1.00 0.00 C ATOM 1462 C GLN A 91 -0.029 14.523 -4.587 1.00 0.00 C ATOM 1463 O GLN A 91 -0.747 15.310 -3.966 1.00 0.00 O ATOM 1464 CB GLN A 91 1.802 15.411 -6.110 1.00 0.00 C ATOM 1465 CG GLN A 91 1.148 16.786 -6.305 1.00 0.00 C ATOM 1466 CD GLN A 91 1.494 17.382 -7.663 1.00 0.00 C ATOM 1467 OE1 GLN A 91 2.195 18.383 -7.754 1.00 0.00 O ATOM 1468 NE2 GLN A 91 1.005 16.769 -8.737 1.00 0.00 N ATOM 0 H GLN A 91 3.000 13.471 -5.175 1.00 0.00 H new ATOM 0 HA GLN A 91 1.703 15.581 -3.976 1.00 0.00 H new ATOM 0 HB2 GLN A 91 2.883 15.501 -6.220 1.00 0.00 H new ATOM 0 HB3 GLN A 91 1.458 14.729 -6.887 1.00 0.00 H new ATOM 0 HG2 GLN A 91 0.066 16.692 -6.213 1.00 0.00 H new ATOM 0 HG3 GLN A 91 1.477 17.462 -5.516 1.00 0.00 H new ATOM 0 HE21 GLN A 91 0.424 15.937 -8.629 1.00 0.00 H new ATOM 0 HE22 GLN A 91 1.211 17.130 -9.668 1.00 0.00 H new ATOM 1477 N SER A 92 -0.524 13.427 -5.173 1.00 0.00 N ATOM 1478 CA SER A 92 -1.940 13.088 -5.087 1.00 0.00 C ATOM 1479 C SER A 92 -2.343 12.780 -3.641 1.00 0.00 C ATOM 1480 O SER A 92 -3.224 13.439 -3.082 1.00 0.00 O ATOM 1481 CB SER A 92 -2.273 11.939 -6.045 1.00 0.00 C ATOM 1482 OG SER A 92 -1.627 10.740 -5.665 1.00 0.00 O ATOM 0 H SER A 92 0.037 12.765 -5.709 1.00 0.00 H new ATOM 0 HA SER A 92 -2.529 13.951 -5.399 1.00 0.00 H new ATOM 0 HB2 SER A 92 -3.351 11.782 -6.064 1.00 0.00 H new ATOM 0 HB3 SER A 92 -1.972 12.210 -7.057 1.00 0.00 H new ATOM 0 HG SER A 92 -2.162 10.282 -4.984 1.00 0.00 H new ATOM 1488 N HIS A 93 -1.700 11.772 -3.038 1.00 0.00 N ATOM 1489 CA HIS A 93 -1.930 11.382 -1.646 1.00 0.00 C ATOM 1490 C HIS A 93 -1.806 12.575 -0.688 1.00 0.00 C ATOM 1491 O HIS A 93 -2.521 12.661 0.314 1.00 0.00 O ATOM 1492 CB HIS A 93 -1.064 10.176 -1.267 1.00 0.00 C ATOM 1493 CG HIS A 93 -1.457 8.952 -2.065 1.00 0.00 C ATOM 1494 ND1 HIS A 93 -1.264 8.802 -3.420 1.00 0.00 N ATOM 1495 CD2 HIS A 93 -2.297 7.943 -1.665 1.00 0.00 C ATOM 1496 CE1 HIS A 93 -1.994 7.755 -3.819 1.00 0.00 C ATOM 1497 NE2 HIS A 93 -2.629 7.180 -2.787 1.00 0.00 N ATOM 0 H HIS A 93 -0.999 11.200 -3.510 1.00 0.00 H new ATOM 0 HA HIS A 93 -2.964 11.052 -1.544 1.00 0.00 H new ATOM 0 HB2 HIS A 93 -0.014 10.408 -1.444 1.00 0.00 H new ATOM 0 HB3 HIS A 93 -1.169 9.969 -0.202 1.00 0.00 H new ATOM 0 HD1 HIS A 93 -0.672 9.384 -4.012 1.00 0.00 H new ATOM 0 HD2 HIS A 93 -2.642 7.769 -0.656 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -2.063 7.416 -4.842 1.00 0.00 H new ATOM 1505 N ALA A 94 -0.954 13.533 -1.057 1.00 0.00 N ATOM 1506 CA ALA A 94 -0.707 14.771 -0.343 1.00 0.00 C ATOM 1507 C ALA A 94 -1.912 15.700 -0.513 1.00 0.00 C ATOM 1508 O ALA A 94 -2.718 15.844 0.396 1.00 0.00 O ATOM 1509 CB ALA A 94 0.579 15.450 -0.832 1.00 0.00 C ATOM 0 H ALA A 94 -0.393 13.455 -1.905 1.00 0.00 H new ATOM 0 HA ALA A 94 -0.570 14.546 0.715 1.00 0.00 H new ATOM 0 HB1 ALA A 94 0.736 16.375 -0.277 1.00 0.00 H new ATOM 0 HB2 ALA A 94 1.426 14.783 -0.672 1.00 0.00 H new ATOM 0 HB3 ALA A 94 0.490 15.675 -1.895 1.00 0.00 H new ATOM 1515 N THR A 95 -2.003 16.371 -1.663 1.00 0.00 N ATOM 1516 CA THR A 95 -2.981 17.423 -1.907 1.00 0.00 C ATOM 1517 C THR A 95 -4.418 16.982 -2.150 1.00 0.00 C ATOM 1518 O THR A 95 -5.337 17.720 -1.803 1.00 0.00 O ATOM 1519 CB THR A 95 -2.539 18.269 -3.113 1.00 0.00 C ATOM 1520 OG1 THR A 95 -2.414 17.483 -4.284 1.00 0.00 O ATOM 1521 CG2 THR A 95 -1.218 18.987 -2.852 1.00 0.00 C ATOM 0 H THR A 95 -1.390 16.194 -2.459 1.00 0.00 H new ATOM 0 HA THR A 95 -2.999 17.980 -0.970 1.00 0.00 H new ATOM 0 HB THR A 95 -3.321 19.013 -3.263 1.00 0.00 H new ATOM 0 HG1 THR A 95 -1.706 16.818 -4.157 1.00 0.00 H new ATOM 0 HG21 THR A 95 -0.943 19.573 -3.729 1.00 0.00 H new ATOM 0 HG22 THR A 95 -1.327 19.649 -1.993 1.00 0.00 H new ATOM 0 HG23 THR A 95 -0.439 18.253 -2.647 1.00 0.00 H new ATOM 1529 N LYS A 96 -4.623 15.842 -2.806 1.00 0.00 N ATOM 1530 CA LYS A 96 -5.956 15.464 -3.248 1.00 0.00 C ATOM 1531 C LYS A 96 -6.622 14.514 -2.272 1.00 0.00 C ATOM 1532 O LYS A 96 -7.772 14.714 -1.889 1.00 0.00 O ATOM 1533 CB LYS A 96 -5.862 14.862 -4.659 1.00 0.00 C ATOM 1534 CG LYS A 96 -7.251 14.673 -5.289 1.00 0.00 C ATOM 1535 CD LYS A 96 -7.186 13.971 -6.652 1.00 0.00 C ATOM 1536 CE LYS A 96 -6.554 14.843 -7.742 1.00 0.00 C ATOM 1537 NZ LYS A 96 -6.590 14.166 -9.049 1.00 0.00 N ATOM 0 H LYS A 96 -3.890 15.173 -3.040 1.00 0.00 H new ATOM 0 HA LYS A 96 -6.587 16.352 -3.283 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -5.260 15.513 -5.293 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -5.350 13.901 -4.611 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -7.877 14.090 -4.613 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -7.729 15.646 -5.407 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -6.613 13.049 -6.553 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -8.193 13.689 -6.958 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -7.085 15.793 -7.806 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -5.522 15.072 -7.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -6.156 14.778 -9.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -6.063 13.272 -8.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -7.577 13.970 -9.311 1.00 0.00 H new ATOM 1551 N HIS A 97 -5.931 13.426 -1.943 1.00 0.00 N ATOM 1552 CA HIS A 97 -6.561 12.358 -1.194 1.00 0.00 C ATOM 1553 C HIS A 97 -6.616 12.541 0.316 1.00 0.00 C ATOM 1554 O HIS A 97 -7.518 11.959 0.907 1.00 0.00 O ATOM 1555 CB HIS A 97 -5.889 11.034 -1.526 1.00 0.00 C ATOM 1556 CG HIS A 97 -5.823 10.742 -3.005 1.00 0.00 C ATOM 1557 ND1 HIS A 97 -6.813 11.015 -3.927 1.00 0.00 N ATOM 1558 CD2 HIS A 97 -4.760 10.214 -3.678 1.00 0.00 C ATOM 1559 CE1 HIS A 97 -6.352 10.645 -5.135 1.00 0.00 C ATOM 1560 NE2 HIS A 97 -5.119 10.130 -5.003 1.00 0.00 N ATOM 0 H HIS A 97 -4.952 13.267 -2.181 1.00 0.00 H new ATOM 0 HA HIS A 97 -7.603 12.374 -1.513 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -4.878 11.038 -1.120 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -6.429 10.228 -1.029 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -3.814 9.917 -3.250 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -6.890 10.746 -6.066 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -4.548 9.744 -5.755 1.00 0.00 H new ATOM 1569 N LYS A 98 -5.631 13.168 0.983 1.00 0.00 N ATOM 1570 CA LYS A 98 -5.751 13.269 2.446 1.00 0.00 C ATOM 1571 C LYS A 98 -4.721 14.120 3.168 1.00 0.00 C ATOM 1572 O LYS A 98 -5.033 15.017 3.946 1.00 0.00 O ATOM 1573 CB LYS A 98 -5.820 11.878 3.130 1.00 0.00 C ATOM 1574 CG LYS A 98 -5.054 10.701 2.486 1.00 0.00 C ATOM 1575 CD LYS A 98 -3.645 10.475 3.041 1.00 0.00 C ATOM 1576 CE LYS A 98 -3.025 9.211 2.443 1.00 0.00 C ATOM 1577 NZ LYS A 98 -1.623 9.087 2.874 1.00 0.00 N ATOM 0 H LYS A 98 -4.798 13.586 0.568 1.00 0.00 H new ATOM 0 HA LYS A 98 -6.695 13.803 2.549 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -5.455 11.992 4.151 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -6.870 11.593 3.197 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -5.635 9.789 2.623 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -4.983 10.875 1.412 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -3.017 11.336 2.814 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -3.686 10.387 4.127 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -3.590 8.334 2.759 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -3.078 9.250 1.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -1.412 8.091 3.088 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -0.995 9.418 2.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -1.469 9.664 3.725 1.00 0.00 H new ATOM 1591 N ILE A 99 -3.497 13.742 2.890 1.00 0.00 N ATOM 1592 CA ILE A 99 -2.205 14.162 3.408 1.00 0.00 C ATOM 1593 C ILE A 99 -1.534 13.101 4.301 1.00 0.00 C ATOM 1594 O ILE A 99 -0.522 12.563 3.871 1.00 0.00 O ATOM 1595 CB ILE A 99 -2.067 15.594 4.002 1.00 0.00 C ATOM 1596 CG1 ILE A 99 -2.646 16.744 3.156 1.00 0.00 C ATOM 1597 CG2 ILE A 99 -0.567 15.886 4.193 1.00 0.00 C ATOM 1598 CD1 ILE A 99 -2.974 17.977 4.005 1.00 0.00 C ATOM 0 H ILE A 99 -3.360 13.019 2.184 1.00 0.00 H new ATOM 0 HA ILE A 99 -1.644 14.250 2.477 1.00 0.00 H new ATOM 0 HB ILE A 99 -2.649 15.576 4.923 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -1.931 17.018 2.381 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -3.549 16.402 2.650 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -0.441 16.886 4.609 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -0.137 15.152 4.875 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -0.059 15.827 3.230 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -3.379 18.761 3.366 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -3.710 17.711 4.764 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -2.067 18.337 4.490 1.00 0.00 H new ATOM 1610 N PRO A 100 -1.942 12.873 5.564 1.00 0.00 N ATOM 1611 CA PRO A 100 -1.201 12.033 6.501 1.00 0.00 C ATOM 1612 C PRO A 100 -0.728 10.646 6.052 1.00 0.00 C ATOM 1613 O PRO A 100 -1.509 9.777 5.672 1.00 0.00 O ATOM 1614 CB PRO A 100 -2.015 11.973 7.798 1.00 0.00 C ATOM 1615 CG PRO A 100 -3.408 12.426 7.363 1.00 0.00 C ATOM 1616 CD PRO A 100 -3.094 13.427 6.254 1.00 0.00 C ATOM 0 HA PRO A 100 -0.234 12.522 6.618 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -2.032 10.966 8.216 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -1.600 12.629 8.564 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -4.011 11.594 7.001 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -3.960 12.887 8.182 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -3.940 13.545 5.577 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -2.873 14.413 6.663 1.00 0.00 H new ATOM 1624 N ILE A 101 0.573 10.404 6.259 1.00 0.00 N ATOM 1625 CA ILE A 101 1.284 9.160 5.969 1.00 0.00 C ATOM 1626 C ILE A 101 0.790 8.044 6.891 1.00 0.00 C ATOM 1627 O ILE A 101 0.916 6.866 6.572 1.00 0.00 O ATOM 1628 CB ILE A 101 2.798 9.410 6.124 1.00 0.00 C ATOM 1629 CG1 ILE A 101 3.126 10.545 5.142 1.00 0.00 C ATOM 1630 CG2 ILE A 101 3.646 8.156 5.870 1.00 0.00 C ATOM 1631 CD1 ILE A 101 4.606 10.724 4.793 1.00 0.00 C ATOM 0 H ILE A 101 1.189 11.114 6.656 1.00 0.00 H new ATOM 0 HA ILE A 101 1.088 8.838 4.946 1.00 0.00 H new ATOM 0 HB ILE A 101 3.043 9.682 7.151 1.00 0.00 H new ATOM 0 HG12 ILE A 101 2.574 10.370 4.218 1.00 0.00 H new ATOM 0 HG13 ILE A 101 2.757 11.480 5.562 1.00 0.00 H new ATOM 0 HG21 ILE A 101 4.701 8.399 5.995 1.00 0.00 H new ATOM 0 HG22 ILE A 101 3.366 7.378 6.580 1.00 0.00 H new ATOM 0 HG23 ILE A 101 3.473 7.800 4.854 1.00 0.00 H new ATOM 0 HD11 ILE A 101 4.717 11.553 4.094 1.00 0.00 H new ATOM 0 HD12 ILE A 101 5.171 10.937 5.701 1.00 0.00 H new ATOM 0 HD13 ILE A 101 4.985 9.810 4.336 1.00 0.00 H new ATOM 1643 N LYS A 102 0.200 8.404 8.029 1.00 0.00 N ATOM 1644 CA LYS A 102 -0.360 7.437 8.965 1.00 0.00 C ATOM 1645 C LYS A 102 -1.393 6.562 8.251 1.00 0.00 C ATOM 1646 O LYS A 102 -1.514 5.377 8.543 1.00 0.00 O ATOM 1647 CB LYS A 102 -0.949 8.138 10.195 1.00 0.00 C ATOM 1648 CG LYS A 102 -1.213 7.113 11.306 1.00 0.00 C ATOM 1649 CD LYS A 102 -1.605 7.808 12.616 1.00 0.00 C ATOM 1650 CE LYS A 102 -1.867 6.781 13.722 1.00 0.00 C ATOM 1651 NZ LYS A 102 -0.660 5.998 14.047 1.00 0.00 N ATOM 0 H LYS A 102 0.098 9.374 8.326 1.00 0.00 H new ATOM 0 HA LYS A 102 0.438 6.788 9.327 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -0.261 8.904 10.552 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -1.877 8.643 9.927 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -2.009 6.435 10.998 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -0.321 6.507 11.465 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -0.809 8.486 12.925 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -2.497 8.414 12.458 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -2.218 7.294 14.617 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -2.663 6.106 13.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -0.842 5.413 14.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -0.418 5.384 13.243 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 0.132 6.644 14.240 1.00 0.00 H new ATOM 1665 N TYR A 103 -2.116 7.119 7.277 1.00 0.00 N ATOM 1666 CA TYR A 103 -3.038 6.315 6.494 1.00 0.00 C ATOM 1667 C TYR A 103 -2.239 5.232 5.739 1.00 0.00 C ATOM 1668 O TYR A 103 -2.645 4.069 5.714 1.00 0.00 O ATOM 1669 CB TYR A 103 -3.885 7.232 5.600 1.00 0.00 C ATOM 1670 CG TYR A 103 -5.033 7.992 6.259 1.00 0.00 C ATOM 1671 CD1 TYR A 103 -5.218 7.991 7.656 1.00 0.00 C ATOM 1672 CD2 TYR A 103 -6.086 8.425 5.432 1.00 0.00 C ATOM 1673 CE1 TYR A 103 -6.473 8.312 8.202 1.00 0.00 C ATOM 1674 CE2 TYR A 103 -7.333 8.766 5.979 1.00 0.00 C ATOM 1675 CZ TYR A 103 -7.537 8.681 7.364 1.00 0.00 C ATOM 1676 OH TYR A 103 -8.785 8.874 7.881 1.00 0.00 O ATOM 0 H TYR A 103 -2.079 8.105 7.020 1.00 0.00 H new ATOM 0 HA TYR A 103 -3.750 5.783 7.125 1.00 0.00 H new ATOM 0 HB2 TYR A 103 -3.219 7.962 5.139 1.00 0.00 H new ATOM 0 HB3 TYR A 103 -4.301 6.626 4.795 1.00 0.00 H new ATOM 0 HD1 TYR A 103 -4.394 7.743 8.309 1.00 0.00 H new ATOM 0 HD2 TYR A 103 -5.933 8.496 4.365 1.00 0.00 H new ATOM 0 HE1 TYR A 103 -6.619 8.275 9.271 1.00 0.00 H new ATOM 0 HE2 TYR A 103 -8.135 9.094 5.334 1.00 0.00 H new ATOM 0 HH TYR A 103 -9.401 9.126 7.162 1.00 0.00 H new ATOM 1686 N LEU A 104 -1.042 5.569 5.235 1.00 0.00 N ATOM 1687 CA LEU A 104 -0.168 4.581 4.599 1.00 0.00 C ATOM 1688 C LEU A 104 0.327 3.571 5.643 1.00 0.00 C ATOM 1689 O LEU A 104 0.478 2.390 5.342 1.00 0.00 O ATOM 1690 CB LEU A 104 1.006 5.226 3.844 1.00 0.00 C ATOM 1691 CG LEU A 104 0.611 6.414 2.957 1.00 0.00 C ATOM 1692 CD1 LEU A 104 1.827 7.002 2.232 1.00 0.00 C ATOM 1693 CD2 LEU A 104 -0.419 6.033 1.896 1.00 0.00 C ATOM 0 H LEU A 104 -0.661 6.515 5.257 1.00 0.00 H new ATOM 0 HA LEU A 104 -0.758 4.056 3.848 1.00 0.00 H new ATOM 0 HB2 LEU A 104 1.749 5.560 4.568 1.00 0.00 H new ATOM 0 HB3 LEU A 104 1.484 4.468 3.224 1.00 0.00 H new ATOM 0 HG LEU A 104 0.179 7.150 3.635 1.00 0.00 H new ATOM 0 HD11 LEU A 104 1.511 7.841 1.613 1.00 0.00 H new ATOM 0 HD12 LEU A 104 2.556 7.347 2.965 1.00 0.00 H new ATOM 0 HD13 LEU A 104 2.280 6.237 1.602 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -0.664 6.909 1.296 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -0.008 5.255 1.252 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -1.322 5.662 2.382 1.00 0.00 H new ATOM 1705 N GLU A 105 0.525 4.008 6.892 1.00 0.00 N ATOM 1706 CA GLU A 105 0.895 3.121 7.992 1.00 0.00 C ATOM 1707 C GLU A 105 -0.246 2.118 8.235 1.00 0.00 C ATOM 1708 O GLU A 105 -0.011 0.942 8.519 1.00 0.00 O ATOM 1709 CB GLU A 105 1.227 3.939 9.251 1.00 0.00 C ATOM 1710 CG GLU A 105 1.864 3.094 10.359 1.00 0.00 C ATOM 1711 CD GLU A 105 2.068 3.925 11.625 1.00 0.00 C ATOM 1712 OE1 GLU A 105 1.038 4.301 12.230 1.00 0.00 O ATOM 1713 OE2 GLU A 105 3.244 4.182 11.958 1.00 0.00 O ATOM 0 H GLU A 105 0.432 4.986 7.165 1.00 0.00 H new ATOM 0 HA GLU A 105 1.793 2.559 7.734 1.00 0.00 H new ATOM 0 HB2 GLU A 105 1.905 4.749 8.983 1.00 0.00 H new ATOM 0 HB3 GLU A 105 0.315 4.399 9.631 1.00 0.00 H new ATOM 0 HG2 GLU A 105 1.228 2.237 10.580 1.00 0.00 H new ATOM 0 HG3 GLU A 105 2.822 2.701 10.018 1.00 0.00 H new ATOM 1720 N PHE A 106 -1.495 2.581 8.175 1.00 0.00 N ATOM 1721 CA PHE A 106 -2.620 1.677 8.303 1.00 0.00 C ATOM 1722 C PHE A 106 -2.607 0.643 7.167 1.00 0.00 C ATOM 1723 O PHE A 106 -2.856 -0.542 7.404 1.00 0.00 O ATOM 1724 CB PHE A 106 -3.942 2.456 8.389 1.00 0.00 C ATOM 1725 CG PHE A 106 -4.121 3.442 9.543 1.00 0.00 C ATOM 1726 CD1 PHE A 106 -3.581 3.174 10.819 1.00 0.00 C ATOM 1727 CD2 PHE A 106 -5.025 4.518 9.397 1.00 0.00 C ATOM 1728 CE1 PHE A 106 -3.975 3.941 11.934 1.00 0.00 C ATOM 1729 CE2 PHE A 106 -5.430 5.275 10.513 1.00 0.00 C ATOM 1730 CZ PHE A 106 -4.915 4.976 11.787 1.00 0.00 C ATOM 0 H PHE A 106 -1.743 3.561 8.041 1.00 0.00 H new ATOM 0 HA PHE A 106 -2.529 1.123 9.237 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -4.066 3.007 7.457 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -4.754 1.731 8.441 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -2.862 2.377 10.942 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -5.410 4.763 8.418 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -3.553 3.733 12.906 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -6.135 6.084 10.391 1.00 0.00 H new ATOM 0 HZ PHE A 106 -5.240 5.539 12.649 1.00 0.00 H new ATOM 1740 N ILE A 107 -2.337 1.055 5.922 1.00 0.00 N ATOM 1741 CA ILE A 107 -2.219 0.077 4.857 1.00 0.00 C ATOM 1742 C ILE A 107 -0.995 -0.813 5.082 1.00 0.00 C ATOM 1743 O ILE A 107 -0.999 -1.968 4.654 1.00 0.00 O ATOM 1744 CB ILE A 107 -2.307 0.749 3.474 1.00 0.00 C ATOM 1745 CG1 ILE A 107 -3.764 0.701 2.984 1.00 0.00 C ATOM 1746 CG2 ILE A 107 -1.344 0.145 2.455 1.00 0.00 C ATOM 1747 CD1 ILE A 107 -3.943 1.143 1.529 1.00 0.00 C ATOM 0 H ILE A 107 -2.202 2.027 5.642 1.00 0.00 H new ATOM 0 HA ILE A 107 -3.070 -0.603 4.879 1.00 0.00 H new ATOM 0 HB ILE A 107 -1.995 1.788 3.580 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -4.141 -0.316 3.094 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -4.374 1.338 3.625 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -1.453 0.661 1.501 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -0.320 0.256 2.812 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -1.570 -0.913 2.324 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -4.997 1.082 1.257 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -3.598 2.171 1.416 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -3.362 0.491 0.877 1.00 0.00 H new ATOM 1759 N SER A 108 0.075 -0.271 5.669 1.00 0.00 N ATOM 1760 CA SER A 108 1.236 -1.073 6.002 1.00 0.00 C ATOM 1761 C SER A 108 0.800 -2.218 6.916 1.00 0.00 C ATOM 1762 O SER A 108 1.143 -3.374 6.675 1.00 0.00 O ATOM 1763 CB SER A 108 2.351 -0.240 6.645 1.00 0.00 C ATOM 1764 OG SER A 108 2.747 0.834 5.809 1.00 0.00 O ATOM 0 H SER A 108 0.154 0.715 5.919 1.00 0.00 H new ATOM 0 HA SER A 108 1.655 -1.479 5.081 1.00 0.00 H new ATOM 0 HB2 SER A 108 2.008 0.151 7.603 1.00 0.00 H new ATOM 0 HB3 SER A 108 3.210 -0.878 6.851 1.00 0.00 H new ATOM 0 HG SER A 108 1.976 1.413 5.633 1.00 0.00 H new ATOM 1770 N GLU A 109 0.044 -1.891 7.968 1.00 0.00 N ATOM 1771 CA GLU A 109 -0.498 -2.889 8.879 1.00 0.00 C ATOM 1772 C GLU A 109 -1.274 -3.946 8.081 1.00 0.00 C ATOM 1773 O GLU A 109 -1.078 -5.145 8.282 1.00 0.00 O ATOM 1774 CB GLU A 109 -1.350 -2.185 9.950 1.00 0.00 C ATOM 1775 CG GLU A 109 -1.946 -3.137 11.002 1.00 0.00 C ATOM 1776 CD GLU A 109 -3.471 -3.205 10.924 1.00 0.00 C ATOM 1777 OE1 GLU A 109 -4.106 -2.144 11.127 1.00 0.00 O ATOM 1778 OE2 GLU A 109 -3.973 -4.320 10.667 1.00 0.00 O ATOM 0 H GLU A 109 -0.205 -0.931 8.207 1.00 0.00 H new ATOM 0 HA GLU A 109 0.300 -3.417 9.401 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -0.736 -1.440 10.456 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -2.162 -1.649 9.459 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -1.532 -4.136 10.861 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -1.650 -2.807 11.997 1.00 0.00 H new ATOM 1785 N ALA A 110 -2.152 -3.507 7.173 1.00 0.00 N ATOM 1786 CA ALA A 110 -2.925 -4.424 6.347 1.00 0.00 C ATOM 1787 C ALA A 110 -2.017 -5.346 5.518 1.00 0.00 C ATOM 1788 O ALA A 110 -2.046 -6.562 5.709 1.00 0.00 O ATOM 1789 CB ALA A 110 -3.942 -3.654 5.504 1.00 0.00 C ATOM 0 H ALA A 110 -2.341 -2.520 6.996 1.00 0.00 H new ATOM 0 HA ALA A 110 -3.493 -5.088 6.999 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -4.512 -4.354 4.892 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -4.621 -3.110 6.160 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -3.419 -2.949 4.857 1.00 0.00 H new ATOM 1795 N ILE A 111 -1.132 -4.807 4.668 1.00 0.00 N ATOM 1796 CA ILE A 111 -0.295 -5.678 3.836 1.00 0.00 C ATOM 1797 C ILE A 111 0.537 -6.623 4.712 1.00 0.00 C ATOM 1798 O ILE A 111 0.583 -7.825 4.446 1.00 0.00 O ATOM 1799 CB ILE A 111 0.545 -4.904 2.797 1.00 0.00 C ATOM 1800 CG1 ILE A 111 1.343 -5.820 1.850 1.00 0.00 C ATOM 1801 CG2 ILE A 111 1.553 -3.956 3.447 1.00 0.00 C ATOM 1802 CD1 ILE A 111 0.476 -6.742 0.992 1.00 0.00 C ATOM 0 H ILE A 111 -0.980 -3.806 4.541 1.00 0.00 H new ATOM 0 HA ILE A 111 -0.961 -6.297 3.235 1.00 0.00 H new ATOM 0 HB ILE A 111 -0.199 -4.345 2.229 1.00 0.00 H new ATOM 0 HG12 ILE A 111 1.955 -5.201 1.194 1.00 0.00 H new ATOM 0 HG13 ILE A 111 2.026 -6.429 2.442 1.00 0.00 H new ATOM 0 HG21 ILE A 111 2.117 -3.437 2.672 1.00 0.00 H new ATOM 0 HG22 ILE A 111 1.024 -3.227 4.060 1.00 0.00 H new ATOM 0 HG23 ILE A 111 2.238 -4.527 4.073 1.00 0.00 H new ATOM 0 HD11 ILE A 111 1.115 -7.353 0.354 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -0.117 -7.389 1.638 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -0.189 -6.142 0.371 1.00 0.00 H new ATOM 1814 N ILE A 112 1.118 -6.126 5.813 1.00 0.00 N ATOM 1815 CA ILE A 112 1.899 -6.971 6.711 1.00 0.00 C ATOM 1816 C ILE A 112 1.004 -8.101 7.237 1.00 0.00 C ATOM 1817 O ILE A 112 1.414 -9.261 7.227 1.00 0.00 O ATOM 1818 CB ILE A 112 2.555 -6.135 7.829 1.00 0.00 C ATOM 1819 CG1 ILE A 112 3.608 -5.143 7.284 1.00 0.00 C ATOM 1820 CG2 ILE A 112 3.185 -7.030 8.907 1.00 0.00 C ATOM 1821 CD1 ILE A 112 4.943 -5.758 6.851 1.00 0.00 C ATOM 0 H ILE A 112 1.059 -5.148 6.097 1.00 0.00 H new ATOM 0 HA ILE A 112 2.727 -7.430 6.171 1.00 0.00 H new ATOM 0 HB ILE A 112 1.752 -5.553 8.282 1.00 0.00 H new ATOM 0 HG12 ILE A 112 3.178 -4.618 6.431 1.00 0.00 H new ATOM 0 HG13 ILE A 112 3.806 -4.395 8.052 1.00 0.00 H new ATOM 0 HG21 ILE A 112 3.638 -6.407 9.678 1.00 0.00 H new ATOM 0 HG22 ILE A 112 2.415 -7.658 9.354 1.00 0.00 H new ATOM 0 HG23 ILE A 112 3.950 -7.661 8.455 1.00 0.00 H new ATOM 0 HD11 ILE A 112 5.604 -4.972 6.486 1.00 0.00 H new ATOM 0 HD12 ILE A 112 5.407 -6.257 7.702 1.00 0.00 H new ATOM 0 HD13 ILE A 112 4.769 -6.483 6.056 1.00 0.00 H new ATOM 1833 N HIS A 113 -0.236 -7.800 7.646 1.00 0.00 N ATOM 1834 CA HIS A 113 -1.165 -8.828 8.100 1.00 0.00 C ATOM 1835 C HIS A 113 -1.384 -9.897 7.022 1.00 0.00 C ATOM 1836 O HIS A 113 -1.317 -11.096 7.312 1.00 0.00 O ATOM 1837 CB HIS A 113 -2.504 -8.237 8.556 1.00 0.00 C ATOM 1838 CG HIS A 113 -3.430 -9.319 9.042 1.00 0.00 C ATOM 1839 ND1 HIS A 113 -3.341 -9.957 10.265 1.00 0.00 N ATOM 1840 CD2 HIS A 113 -4.340 -9.993 8.273 1.00 0.00 C ATOM 1841 CE1 HIS A 113 -4.222 -10.973 10.258 1.00 0.00 C ATOM 1842 NE2 HIS A 113 -4.840 -11.010 9.062 1.00 0.00 N ATOM 0 H HIS A 113 -0.613 -6.852 7.670 1.00 0.00 H new ATOM 0 HA HIS A 113 -0.707 -9.304 8.967 1.00 0.00 H new ATOM 0 HB2 HIS A 113 -2.334 -7.513 9.353 1.00 0.00 H new ATOM 0 HB3 HIS A 113 -2.969 -7.699 7.730 1.00 0.00 H new ATOM 0 HD2 HIS A 113 -4.613 -9.773 7.251 1.00 0.00 H new ATOM 0 HE1 HIS A 113 -4.405 -11.650 11.079 1.00 0.00 H new ATOM 0 HE2 HIS A 113 -5.559 -11.679 8.785 1.00 0.00 H new ATOM 1851 N VAL A 114 -1.609 -9.485 5.767 1.00 0.00 N ATOM 1852 CA VAL A 114 -1.841 -10.461 4.705 1.00 0.00 C ATOM 1853 C VAL A 114 -0.586 -11.322 4.531 1.00 0.00 C ATOM 1854 O VAL A 114 -0.685 -12.543 4.537 1.00 0.00 O ATOM 1855 CB VAL A 114 -2.337 -9.834 3.386 1.00 0.00 C ATOM 1856 CG1 VAL A 114 -2.754 -10.945 2.414 1.00 0.00 C ATOM 1857 CG2 VAL A 114 -3.578 -8.979 3.677 1.00 0.00 C ATOM 0 H VAL A 114 -1.634 -8.509 5.472 1.00 0.00 H new ATOM 0 HA VAL A 114 -2.666 -11.105 5.009 1.00 0.00 H new ATOM 0 HB VAL A 114 -1.539 -9.231 2.954 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -3.104 -10.501 1.482 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -1.899 -11.590 2.210 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -3.555 -11.535 2.858 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -3.937 -8.531 2.750 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -4.361 -9.607 4.103 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -3.319 -8.191 4.384 1.00 0.00 H new ATOM 1867 N LEU A 115 0.599 -10.706 4.469 1.00 0.00 N ATOM 1868 CA LEU A 115 1.856 -11.440 4.344 1.00 0.00 C ATOM 1869 C LEU A 115 2.005 -12.455 5.480 1.00 0.00 C ATOM 1870 O LEU A 115 2.217 -13.639 5.228 1.00 0.00 O ATOM 1871 CB LEU A 115 3.038 -10.473 4.286 1.00 0.00 C ATOM 1872 CG LEU A 115 2.974 -9.532 3.073 1.00 0.00 C ATOM 1873 CD1 LEU A 115 4.116 -8.525 3.186 1.00 0.00 C ATOM 1874 CD2 LEU A 115 3.092 -10.288 1.750 1.00 0.00 C ATOM 0 H LEU A 115 0.711 -9.693 4.504 1.00 0.00 H new ATOM 0 HA LEU A 115 1.844 -11.999 3.408 1.00 0.00 H new ATOM 0 HB2 LEU A 115 3.062 -9.880 5.200 1.00 0.00 H new ATOM 0 HB3 LEU A 115 3.967 -11.042 4.251 1.00 0.00 H new ATOM 0 HG LEU A 115 2.005 -9.032 3.075 1.00 0.00 H new ATOM 0 HD11 LEU A 115 4.089 -7.847 2.333 1.00 0.00 H new ATOM 0 HD12 LEU A 115 4.007 -7.954 4.108 1.00 0.00 H new ATOM 0 HD13 LEU A 115 5.068 -9.055 3.198 1.00 0.00 H new ATOM 0 HD21 LEU A 115 3.042 -9.582 0.921 1.00 0.00 H new ATOM 0 HD22 LEU A 115 4.044 -10.818 1.717 1.00 0.00 H new ATOM 0 HD23 LEU A 115 2.275 -11.004 1.666 1.00 0.00 H new ATOM 1886 N HIS A 116 1.823 -12.003 6.722 1.00 0.00 N ATOM 1887 CA HIS A 116 1.857 -12.827 7.919 1.00 0.00 C ATOM 1888 C HIS A 116 0.968 -14.062 7.767 1.00 0.00 C ATOM 1889 O HIS A 116 1.403 -15.190 7.982 1.00 0.00 O ATOM 1890 CB HIS A 116 1.386 -11.956 9.097 1.00 0.00 C ATOM 1891 CG HIS A 116 0.902 -12.729 10.289 1.00 0.00 C ATOM 1892 ND1 HIS A 116 -0.346 -13.311 10.439 1.00 0.00 N ATOM 1893 CD2 HIS A 116 1.669 -13.062 11.363 1.00 0.00 C ATOM 1894 CE1 HIS A 116 -0.332 -13.983 11.604 1.00 0.00 C ATOM 1895 NE2 HIS A 116 0.877 -13.842 12.182 1.00 0.00 N ATOM 0 H HIS A 116 1.642 -11.019 6.923 1.00 0.00 H new ATOM 0 HA HIS A 116 2.870 -13.189 8.094 1.00 0.00 H new ATOM 0 HB2 HIS A 116 2.209 -11.312 9.407 1.00 0.00 H new ATOM 0 HB3 HIS A 116 0.583 -11.304 8.752 1.00 0.00 H new ATOM 0 HD1 HIS A 116 -1.129 -13.243 9.788 1.00 0.00 H new ATOM 0 HD2 HIS A 116 2.695 -12.773 11.540 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -1.159 -14.546 12.011 1.00 0.00 H new ATOM 1904 N SER A 117 -0.303 -13.828 7.443 1.00 0.00 N ATOM 1905 CA SER A 117 -1.309 -14.874 7.437 1.00 0.00 C ATOM 1906 C SER A 117 -1.223 -15.804 6.222 1.00 0.00 C ATOM 1907 O SER A 117 -1.248 -17.022 6.364 1.00 0.00 O ATOM 1908 CB SER A 117 -2.676 -14.197 7.562 1.00 0.00 C ATOM 1909 OG SER A 117 -2.613 -13.210 8.581 1.00 0.00 O ATOM 0 H SER A 117 -0.658 -12.909 7.179 1.00 0.00 H new ATOM 0 HA SER A 117 -1.137 -15.539 8.283 1.00 0.00 H new ATOM 0 HB2 SER A 117 -2.958 -13.741 6.613 1.00 0.00 H new ATOM 0 HB3 SER A 117 -3.441 -14.936 7.800 1.00 0.00 H new ATOM 0 HG SER A 117 -2.238 -12.383 8.212 1.00 0.00 H new ATOM 1915 N ARG A 118 -1.109 -15.224 5.028 1.00 0.00 N ATOM 1916 CA ARG A 118 -1.156 -15.930 3.755 1.00 0.00 C ATOM 1917 C ARG A 118 0.208 -16.369 3.226 1.00 0.00 C ATOM 1918 O ARG A 118 0.263 -17.316 2.433 1.00 0.00 O ATOM 1919 CB ARG A 118 -1.838 -15.027 2.719 1.00 0.00 C ATOM 1920 CG ARG A 118 -3.245 -14.557 3.114 1.00 0.00 C ATOM 1921 CD ARG A 118 -4.186 -15.710 3.490 1.00 0.00 C ATOM 1922 NE ARG A 118 -4.132 -16.811 2.517 1.00 0.00 N ATOM 1923 CZ ARG A 118 -4.598 -16.771 1.260 1.00 0.00 C ATOM 1924 NH1 ARG A 118 -5.248 -15.693 0.810 1.00 0.00 N ATOM 1925 NH2 ARG A 118 -4.404 -17.822 0.457 1.00 0.00 N ATOM 0 H ARG A 118 -0.977 -14.218 4.920 1.00 0.00 H new ATOM 0 HA ARG A 118 -1.718 -16.848 3.927 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -1.211 -14.152 2.549 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -1.900 -15.564 1.772 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -3.168 -13.870 3.957 1.00 0.00 H new ATOM 0 HG3 ARG A 118 -3.680 -13.998 2.286 1.00 0.00 H new ATOM 0 HD2 ARG A 118 -3.920 -16.087 4.478 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -5.208 -15.336 3.556 1.00 0.00 H new ATOM 0 HE ARG A 118 -3.702 -17.683 2.825 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -5.393 -14.892 1.424 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -5.599 -15.672 -0.148 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -3.906 -18.643 0.802 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -4.754 -17.803 -0.501 1.00 0.00 H new ATOM 1939 N HIS A 119 1.305 -15.700 3.612 1.00 0.00 N ATOM 1940 CA HIS A 119 2.603 -16.026 3.057 1.00 0.00 C ATOM 1941 C HIS A 119 3.686 -16.338 4.098 1.00 0.00 C ATOM 1942 O HIS A 119 4.809 -15.857 3.958 1.00 0.00 O ATOM 1943 CB HIS A 119 3.006 -14.907 2.082 1.00 0.00 C ATOM 1944 CG HIS A 119 1.994 -14.731 0.978 1.00 0.00 C ATOM 1945 ND1 HIS A 119 1.697 -15.705 0.034 1.00 0.00 N ATOM 1946 CD2 HIS A 119 0.955 -13.835 0.994 1.00 0.00 C ATOM 1947 CE1 HIS A 119 0.496 -15.419 -0.503 1.00 0.00 C ATOM 1948 NE2 HIS A 119 0.034 -14.287 0.065 1.00 0.00 N ATOM 0 H HIS A 119 1.309 -14.943 4.296 1.00 0.00 H new ATOM 0 HA HIS A 119 2.512 -16.969 2.519 1.00 0.00 H new ATOM 0 HB2 HIS A 119 3.113 -13.970 2.629 1.00 0.00 H new ATOM 0 HB3 HIS A 119 3.980 -15.136 1.649 1.00 0.00 H new ATOM 0 HD1 HIS A 119 2.287 -16.500 -0.211 1.00 0.00 H new ATOM 0 HD2 HIS A 119 0.872 -12.952 1.610 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -0.011 -15.998 -1.260 1.00 0.00 H new ATOM 1957 N PRO A 120 3.411 -17.147 5.137 1.00 0.00 N ATOM 1958 CA PRO A 120 4.424 -17.513 6.113 1.00 0.00 C ATOM 1959 C PRO A 120 5.492 -18.384 5.446 1.00 0.00 C ATOM 1960 O PRO A 120 5.342 -18.823 4.305 1.00 0.00 O ATOM 1961 CB PRO A 120 3.674 -18.259 7.222 1.00 0.00 C ATOM 1962 CG PRO A 120 2.495 -18.882 6.476 1.00 0.00 C ATOM 1963 CD PRO A 120 2.156 -17.817 5.434 1.00 0.00 C ATOM 0 HA PRO A 120 4.948 -16.651 6.524 1.00 0.00 H new ATOM 0 HB2 PRO A 120 4.300 -19.017 7.694 1.00 0.00 H new ATOM 0 HB3 PRO A 120 3.342 -17.584 8.010 1.00 0.00 H new ATOM 0 HG2 PRO A 120 2.765 -19.831 6.012 1.00 0.00 H new ATOM 0 HG3 PRO A 120 1.654 -19.080 7.141 1.00 0.00 H new ATOM 0 HD2 PRO A 120 1.730 -18.267 4.537 1.00 0.00 H new ATOM 0 HD3 PRO A 120 1.418 -17.113 5.819 1.00 0.00 H new ATOM 1971 N GLY A 121 6.609 -18.614 6.140 1.00 0.00 N ATOM 1972 CA GLY A 121 7.722 -19.382 5.598 1.00 0.00 C ATOM 1973 C GLY A 121 8.537 -18.478 4.679 1.00 0.00 C ATOM 1974 O GLY A 121 9.705 -18.202 4.952 1.00 0.00 O ATOM 0 H GLY A 121 6.763 -18.273 7.089 1.00 0.00 H new ATOM 0 HA2 GLY A 121 8.347 -19.763 6.406 1.00 0.00 H new ATOM 0 HA3 GLY A 121 7.352 -20.246 5.047 1.00 0.00 H new ATOM 1978 N ASP A 122 7.921 -17.990 3.597 1.00 0.00 N ATOM 1979 CA ASP A 122 8.580 -16.994 2.770 1.00 0.00 C ATOM 1980 C ASP A 122 8.609 -15.683 3.550 1.00 0.00 C ATOM 1981 O ASP A 122 9.608 -14.961 3.519 1.00 0.00 O ATOM 1982 CB ASP A 122 7.941 -16.861 1.380 1.00 0.00 C ATOM 1983 CG ASP A 122 6.529 -16.303 1.428 1.00 0.00 C ATOM 1984 OD1 ASP A 122 6.412 -15.061 1.352 1.00 0.00 O ATOM 1985 OD2 ASP A 122 5.598 -17.132 1.518 1.00 0.00 O ATOM 0 H ASP A 122 6.990 -18.265 3.285 1.00 0.00 H new ATOM 0 HA ASP A 122 9.603 -17.307 2.559 1.00 0.00 H new ATOM 0 HB2 ASP A 122 8.561 -16.213 0.761 1.00 0.00 H new ATOM 0 HB3 ASP A 122 7.923 -17.839 0.899 1.00 0.00 H new ATOM 1990 N PHE A 123 7.513 -15.343 4.236 1.00 0.00 N ATOM 1991 CA PHE A 123 7.495 -14.173 5.079 1.00 0.00 C ATOM 1992 C PHE A 123 8.022 -14.547 6.466 1.00 0.00 C ATOM 1993 O PHE A 123 7.296 -14.514 7.459 1.00 0.00 O ATOM 1994 CB PHE A 123 6.104 -13.521 5.086 1.00 0.00 C ATOM 1995 CG PHE A 123 6.058 -12.135 5.690 1.00 0.00 C ATOM 1996 CD1 PHE A 123 6.660 -11.053 5.025 1.00 0.00 C ATOM 1997 CD2 PHE A 123 5.338 -11.912 6.876 1.00 0.00 C ATOM 1998 CE1 PHE A 123 6.467 -9.744 5.498 1.00 0.00 C ATOM 1999 CE2 PHE A 123 5.123 -10.601 7.336 1.00 0.00 C ATOM 2000 CZ PHE A 123 5.672 -9.516 6.632 1.00 0.00 C ATOM 0 H PHE A 123 6.638 -15.867 4.216 1.00 0.00 H new ATOM 0 HA PHE A 123 8.161 -13.407 4.683 1.00 0.00 H new ATOM 0 HB2 PHE A 123 5.738 -13.468 4.061 1.00 0.00 H new ATOM 0 HB3 PHE A 123 5.419 -14.165 5.637 1.00 0.00 H new ATOM 0 HD1 PHE A 123 7.270 -11.227 4.151 1.00 0.00 H new ATOM 0 HD2 PHE A 123 4.949 -12.750 7.436 1.00 0.00 H new ATOM 0 HE1 PHE A 123 6.931 -8.912 4.988 1.00 0.00 H new ATOM 0 HE2 PHE A 123 4.538 -10.428 8.227 1.00 0.00 H new ATOM 0 HZ PHE A 123 5.482 -8.506 6.964 1.00 0.00 H new ATOM 2010 N GLY A 124 9.292 -14.963 6.522 1.00 0.00 N ATOM 2011 CA GLY A 124 9.948 -15.266 7.781 1.00 0.00 C ATOM 2012 C GLY A 124 10.461 -13.962 8.393 1.00 0.00 C ATOM 2013 O GLY A 124 10.425 -12.927 7.736 1.00 0.00 O ATOM 0 H GLY A 124 9.882 -15.095 5.700 1.00 0.00 H new ATOM 0 HA2 GLY A 124 9.251 -15.755 8.462 1.00 0.00 H new ATOM 0 HA3 GLY A 124 10.774 -15.958 7.620 1.00 0.00 H new ATOM 2017 N ALA A 125 10.943 -13.976 9.641 1.00 0.00 N ATOM 2018 CA ALA A 125 11.385 -12.760 10.330 1.00 0.00 C ATOM 2019 C ALA A 125 12.384 -11.949 9.490 1.00 0.00 C ATOM 2020 O ALA A 125 12.239 -10.739 9.319 1.00 0.00 O ATOM 2021 CB ALA A 125 11.982 -13.125 11.691 1.00 0.00 C ATOM 0 H ALA A 125 11.037 -14.825 10.198 1.00 0.00 H new ATOM 0 HA ALA A 125 10.514 -12.123 10.480 1.00 0.00 H new ATOM 0 HB1 ALA A 125 12.309 -12.218 12.200 1.00 0.00 H new ATOM 0 HB2 ALA A 125 11.228 -13.628 12.296 1.00 0.00 H new ATOM 0 HB3 ALA A 125 12.835 -13.789 11.548 1.00 0.00 H new ATOM 2027 N ASP A 126 13.357 -12.632 8.882 1.00 0.00 N ATOM 2028 CA ASP A 126 14.363 -11.994 8.036 1.00 0.00 C ATOM 2029 C ASP A 126 13.686 -11.254 6.879 1.00 0.00 C ATOM 2030 O ASP A 126 14.015 -10.107 6.571 1.00 0.00 O ATOM 2031 CB ASP A 126 15.366 -13.041 7.517 1.00 0.00 C ATOM 2032 CG ASP A 126 14.748 -14.061 6.559 1.00 0.00 C ATOM 2033 OD1 ASP A 126 13.696 -14.631 6.932 1.00 0.00 O ATOM 2034 OD2 ASP A 126 15.328 -14.242 5.467 1.00 0.00 O ATOM 0 H ASP A 126 13.468 -13.643 8.964 1.00 0.00 H new ATOM 0 HA ASP A 126 14.915 -11.264 8.628 1.00 0.00 H new ATOM 0 HB2 ASP A 126 16.184 -12.528 7.010 1.00 0.00 H new ATOM 0 HB3 ASP A 126 15.799 -13.569 8.367 1.00 0.00 H new ATOM 2039 N ALA A 127 12.716 -11.920 6.246 1.00 0.00 N ATOM 2040 CA ALA A 127 11.965 -11.362 5.139 1.00 0.00 C ATOM 2041 C ALA A 127 11.160 -10.166 5.641 1.00 0.00 C ATOM 2042 O ALA A 127 11.236 -9.100 5.049 1.00 0.00 O ATOM 2043 CB ALA A 127 11.085 -12.441 4.514 1.00 0.00 C ATOM 0 H ALA A 127 12.435 -12.868 6.496 1.00 0.00 H new ATOM 0 HA ALA A 127 12.636 -11.008 4.356 1.00 0.00 H new ATOM 0 HB1 ALA A 127 10.523 -12.016 3.683 1.00 0.00 H new ATOM 0 HB2 ALA A 127 11.711 -13.255 4.150 1.00 0.00 H new ATOM 0 HB3 ALA A 127 10.391 -12.824 5.263 1.00 0.00 H new ATOM 2049 N GLN A 128 10.475 -10.317 6.778 1.00 0.00 N ATOM 2050 CA GLN A 128 9.714 -9.268 7.445 1.00 0.00 C ATOM 2051 C GLN A 128 10.565 -8.007 7.576 1.00 0.00 C ATOM 2052 O GLN A 128 10.130 -6.922 7.199 1.00 0.00 O ATOM 2053 CB GLN A 128 9.237 -9.773 8.814 1.00 0.00 C ATOM 2054 CG GLN A 128 8.085 -8.929 9.370 1.00 0.00 C ATOM 2055 CD GLN A 128 7.370 -9.642 10.513 1.00 0.00 C ATOM 2056 OE1 GLN A 128 7.381 -9.180 11.649 1.00 0.00 O ATOM 2057 NE2 GLN A 128 6.737 -10.776 10.226 1.00 0.00 N ATOM 0 H GLN A 128 10.437 -11.208 7.274 1.00 0.00 H new ATOM 0 HA GLN A 128 8.836 -9.014 6.851 1.00 0.00 H new ATOM 0 HB2 GLN A 128 8.916 -10.811 8.725 1.00 0.00 H new ATOM 0 HB3 GLN A 128 10.070 -9.756 9.517 1.00 0.00 H new ATOM 0 HG2 GLN A 128 8.471 -7.972 9.721 1.00 0.00 H new ATOM 0 HG3 GLN A 128 7.374 -8.713 8.573 1.00 0.00 H new ATOM 0 HE21 GLN A 128 6.745 -11.137 9.272 1.00 0.00 H new ATOM 0 HE22 GLN A 128 6.244 -11.285 10.960 1.00 0.00 H new ATOM 2066 N GLY A 129 11.798 -8.161 8.063 1.00 0.00 N ATOM 2067 CA GLY A 129 12.734 -7.056 8.168 1.00 0.00 C ATOM 2068 C GLY A 129 12.968 -6.400 6.805 1.00 0.00 C ATOM 2069 O GLY A 129 12.853 -5.183 6.671 1.00 0.00 O ATOM 0 H GLY A 129 12.168 -9.053 8.392 1.00 0.00 H new ATOM 0 HA2 GLY A 129 12.350 -6.316 8.870 1.00 0.00 H new ATOM 0 HA3 GLY A 129 13.682 -7.415 8.570 1.00 0.00 H new ATOM 2073 N ALA A 130 13.313 -7.196 5.791 1.00 0.00 N ATOM 2074 CA ALA A 130 13.564 -6.701 4.441 1.00 0.00 C ATOM 2075 C ALA A 130 12.340 -5.978 3.847 1.00 0.00 C ATOM 2076 O ALA A 130 12.467 -4.939 3.195 1.00 0.00 O ATOM 2077 CB ALA A 130 14.028 -7.872 3.569 1.00 0.00 C ATOM 0 H ALA A 130 13.426 -8.205 5.886 1.00 0.00 H new ATOM 0 HA ALA A 130 14.352 -5.948 4.476 1.00 0.00 H new ATOM 0 HB1 ALA A 130 14.220 -7.518 2.556 1.00 0.00 H new ATOM 0 HB2 ALA A 130 14.942 -8.295 3.985 1.00 0.00 H new ATOM 0 HB3 ALA A 130 13.252 -8.637 3.545 1.00 0.00 H new ATOM 2083 N MET A 131 11.149 -6.549 4.031 1.00 0.00 N ATOM 2084 CA MET A 131 9.905 -5.967 3.578 1.00 0.00 C ATOM 2085 C MET A 131 9.672 -4.642 4.290 1.00 0.00 C ATOM 2086 O MET A 131 9.421 -3.634 3.633 1.00 0.00 O ATOM 2087 CB MET A 131 8.754 -6.963 3.792 1.00 0.00 C ATOM 2088 CG MET A 131 7.434 -6.496 3.154 1.00 0.00 C ATOM 2089 SD MET A 131 6.903 -7.386 1.665 1.00 0.00 S ATOM 2090 CE MET A 131 8.274 -7.037 0.553 1.00 0.00 C ATOM 0 H MET A 131 11.030 -7.443 4.508 1.00 0.00 H new ATOM 0 HA MET A 131 9.953 -5.758 2.509 1.00 0.00 H new ATOM 0 HB2 MET A 131 9.033 -7.929 3.372 1.00 0.00 H new ATOM 0 HB3 MET A 131 8.603 -7.112 4.861 1.00 0.00 H new ATOM 0 HG2 MET A 131 6.645 -6.578 3.901 1.00 0.00 H new ATOM 0 HG3 MET A 131 7.529 -5.439 2.905 1.00 0.00 H new ATOM 0 HE1 MET A 131 8.046 -7.427 -0.439 1.00 0.00 H new ATOM 0 HE2 MET A 131 8.429 -5.960 0.493 1.00 0.00 H new ATOM 0 HE3 MET A 131 9.179 -7.513 0.931 1.00 0.00 H new ATOM 2100 N ASN A 132 9.736 -4.634 5.624 1.00 0.00 N ATOM 2101 CA ASN A 132 9.537 -3.409 6.385 1.00 0.00 C ATOM 2102 C ASN A 132 10.567 -2.364 5.964 1.00 0.00 C ATOM 2103 O ASN A 132 10.216 -1.201 5.827 1.00 0.00 O ATOM 2104 CB ASN A 132 9.560 -3.639 7.897 1.00 0.00 C ATOM 2105 CG ASN A 132 9.197 -2.350 8.642 1.00 0.00 C ATOM 2106 OD1 ASN A 132 8.325 -1.589 8.223 1.00 0.00 O ATOM 2107 ND2 ASN A 132 9.857 -2.091 9.767 1.00 0.00 N ATOM 0 H ASN A 132 9.923 -5.460 6.192 1.00 0.00 H new ATOM 0 HA ASN A 132 8.538 -3.038 6.155 1.00 0.00 H new ATOM 0 HB2 ASN A 132 8.857 -4.429 8.161 1.00 0.00 H new ATOM 0 HB3 ASN A 132 10.550 -3.977 8.204 1.00 0.00 H new ATOM 0 HD21 ASN A 132 9.644 -1.248 10.301 1.00 0.00 H new ATOM 0 HD22 ASN A 132 10.576 -2.735 10.096 1.00 0.00 H new ATOM 2114 N LYS A 133 11.824 -2.751 5.721 1.00 0.00 N ATOM 2115 CA LYS A 133 12.823 -1.818 5.212 1.00 0.00 C ATOM 2116 C LYS A 133 12.308 -1.186 3.912 1.00 0.00 C ATOM 2117 O LYS A 133 12.189 0.032 3.820 1.00 0.00 O ATOM 2118 CB LYS A 133 14.153 -2.533 4.957 1.00 0.00 C ATOM 2119 CG LYS A 133 15.037 -2.704 6.196 1.00 0.00 C ATOM 2120 CD LYS A 133 16.320 -3.428 5.762 1.00 0.00 C ATOM 2121 CE LYS A 133 17.348 -3.518 6.890 1.00 0.00 C ATOM 2122 NZ LYS A 133 18.551 -4.241 6.437 1.00 0.00 N ATOM 0 H LYS A 133 12.168 -3.700 5.869 1.00 0.00 H new ATOM 0 HA LYS A 133 12.993 -1.040 5.956 1.00 0.00 H new ATOM 0 HB2 LYS A 133 13.946 -3.517 4.537 1.00 0.00 H new ATOM 0 HB3 LYS A 133 14.711 -1.976 4.204 1.00 0.00 H new ATOM 0 HG2 LYS A 133 15.275 -1.734 6.632 1.00 0.00 H new ATOM 0 HG3 LYS A 133 14.515 -3.278 6.961 1.00 0.00 H new ATOM 0 HD2 LYS A 133 16.070 -4.433 5.421 1.00 0.00 H new ATOM 0 HD3 LYS A 133 16.760 -2.904 4.914 1.00 0.00 H new ATOM 0 HE2 LYS A 133 17.622 -2.516 7.221 1.00 0.00 H new ATOM 0 HE3 LYS A 133 16.911 -4.029 7.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 19.239 -4.293 7.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 18.288 -5.203 6.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 18.976 -3.737 5.633 1.00 0.00 H new ATOM 2136 N ALA A 134 11.932 -2.004 2.925 1.00 0.00 N ATOM 2137 CA ALA A 134 11.440 -1.497 1.646 1.00 0.00 C ATOM 2138 C ALA A 134 10.203 -0.602 1.813 1.00 0.00 C ATOM 2139 O ALA A 134 10.059 0.433 1.159 1.00 0.00 O ATOM 2140 CB ALA A 134 11.175 -2.671 0.702 1.00 0.00 C ATOM 0 H ALA A 134 11.960 -3.022 2.990 1.00 0.00 H new ATOM 0 HA ALA A 134 12.208 -0.861 1.207 1.00 0.00 H new ATOM 0 HB1 ALA A 134 10.808 -2.294 -0.253 1.00 0.00 H new ATOM 0 HB2 ALA A 134 12.100 -3.225 0.542 1.00 0.00 H new ATOM 0 HB3 ALA A 134 10.428 -3.331 1.143 1.00 0.00 H new ATOM 2146 N LEU A 135 9.279 -1.008 2.681 1.00 0.00 N ATOM 2147 CA LEU A 135 8.074 -0.239 2.932 1.00 0.00 C ATOM 2148 C LEU A 135 8.430 1.078 3.630 1.00 0.00 C ATOM 2149 O LEU A 135 7.935 2.141 3.263 1.00 0.00 O ATOM 2150 CB LEU A 135 7.062 -1.113 3.682 1.00 0.00 C ATOM 2151 CG LEU A 135 5.626 -0.572 3.669 1.00 0.00 C ATOM 2152 CD1 LEU A 135 5.060 -0.366 2.258 1.00 0.00 C ATOM 2153 CD2 LEU A 135 4.742 -1.593 4.389 1.00 0.00 C ATOM 0 H LEU A 135 9.347 -1.870 3.222 1.00 0.00 H new ATOM 0 HA LEU A 135 7.588 0.051 2.000 1.00 0.00 H new ATOM 0 HB2 LEU A 135 7.066 -2.111 3.243 1.00 0.00 H new ATOM 0 HB3 LEU A 135 7.388 -1.219 4.717 1.00 0.00 H new ATOM 0 HG LEU A 135 5.638 0.404 4.155 1.00 0.00 H new ATOM 0 HD11 LEU A 135 4.042 0.018 2.327 1.00 0.00 H new ATOM 0 HD12 LEU A 135 5.681 0.348 1.717 1.00 0.00 H new ATOM 0 HD13 LEU A 135 5.054 -1.317 1.726 1.00 0.00 H new ATOM 0 HD21 LEU A 135 3.711 -1.239 4.398 1.00 0.00 H new ATOM 0 HD22 LEU A 135 4.793 -2.549 3.869 1.00 0.00 H new ATOM 0 HD23 LEU A 135 5.092 -1.719 5.414 1.00 0.00 H new ATOM 2165 N GLU A 136 9.393 1.038 4.553 1.00 0.00 N ATOM 2166 CA GLU A 136 9.876 2.203 5.273 1.00 0.00 C ATOM 2167 C GLU A 136 10.514 3.142 4.256 1.00 0.00 C ATOM 2168 O GLU A 136 10.306 4.348 4.320 1.00 0.00 O ATOM 2169 CB GLU A 136 10.854 1.802 6.396 1.00 0.00 C ATOM 2170 CG GLU A 136 11.307 3.000 7.245 1.00 0.00 C ATOM 2171 CD GLU A 136 10.163 3.713 7.961 1.00 0.00 C ATOM 2172 OE1 GLU A 136 9.265 2.997 8.451 1.00 0.00 O ATOM 2173 OE2 GLU A 136 10.212 4.960 8.015 1.00 0.00 O ATOM 0 H GLU A 136 9.864 0.174 4.821 1.00 0.00 H new ATOM 0 HA GLU A 136 9.052 2.714 5.771 1.00 0.00 H new ATOM 0 HB2 GLU A 136 10.377 1.065 7.041 1.00 0.00 H new ATOM 0 HB3 GLU A 136 11.728 1.322 5.956 1.00 0.00 H new ATOM 0 HG2 GLU A 136 12.029 2.657 7.986 1.00 0.00 H new ATOM 0 HG3 GLU A 136 11.823 3.714 6.603 1.00 0.00 H new ATOM 2180 N LEU A 137 11.289 2.598 3.312 1.00 0.00 N ATOM 2181 CA LEU A 137 11.891 3.378 2.245 1.00 0.00 C ATOM 2182 C LEU A 137 10.757 4.078 1.487 1.00 0.00 C ATOM 2183 O LEU A 137 10.785 5.298 1.356 1.00 0.00 O ATOM 2184 CB LEU A 137 12.783 2.495 1.354 1.00 0.00 C ATOM 2185 CG LEU A 137 13.292 3.202 0.085 1.00 0.00 C ATOM 2186 CD1 LEU A 137 14.156 4.422 0.423 1.00 0.00 C ATOM 2187 CD2 LEU A 137 14.113 2.208 -0.744 1.00 0.00 C ATOM 0 H LEU A 137 11.512 1.603 3.273 1.00 0.00 H new ATOM 0 HA LEU A 137 12.561 4.141 2.640 1.00 0.00 H new ATOM 0 HB2 LEU A 137 13.639 2.155 1.937 1.00 0.00 H new ATOM 0 HB3 LEU A 137 12.223 1.606 1.063 1.00 0.00 H new ATOM 0 HG LEU A 137 12.429 3.552 -0.481 1.00 0.00 H new ATOM 0 HD11 LEU A 137 14.496 4.894 -0.499 1.00 0.00 H new ATOM 0 HD12 LEU A 137 13.568 5.136 1.000 1.00 0.00 H new ATOM 0 HD13 LEU A 137 15.019 4.106 1.008 1.00 0.00 H new ATOM 0 HD21 LEU A 137 14.478 2.700 -1.645 1.00 0.00 H new ATOM 0 HD22 LEU A 137 14.960 1.855 -0.155 1.00 0.00 H new ATOM 0 HD23 LEU A 137 13.486 1.361 -1.022 1.00 0.00 H new ATOM 2199 N PHE A 138 9.691 3.351 1.114 1.00 0.00 N ATOM 2200 CA PHE A 138 8.558 3.948 0.411 1.00 0.00 C ATOM 2201 C PHE A 138 8.005 5.128 1.230 1.00 0.00 C ATOM 2202 O PHE A 138 8.008 6.269 0.763 1.00 0.00 O ATOM 2203 CB PHE A 138 7.514 2.856 0.110 1.00 0.00 C ATOM 2204 CG PHE A 138 6.112 3.351 -0.181 1.00 0.00 C ATOM 2205 CD1 PHE A 138 5.765 3.752 -1.478 1.00 0.00 C ATOM 2206 CD2 PHE A 138 5.175 3.475 0.863 1.00 0.00 C ATOM 2207 CE1 PHE A 138 4.480 4.254 -1.745 1.00 0.00 C ATOM 2208 CE2 PHE A 138 3.913 4.057 0.615 1.00 0.00 C ATOM 2209 CZ PHE A 138 3.575 4.471 -0.689 1.00 0.00 C ATOM 0 H PHE A 138 9.596 2.351 1.290 1.00 0.00 H new ATOM 0 HA PHE A 138 8.865 4.360 -0.550 1.00 0.00 H new ATOM 0 HB2 PHE A 138 7.859 2.275 -0.745 1.00 0.00 H new ATOM 0 HB3 PHE A 138 7.470 2.176 0.961 1.00 0.00 H new ATOM 0 HD1 PHE A 138 6.489 3.675 -2.276 1.00 0.00 H new ATOM 0 HD2 PHE A 138 5.422 3.125 1.854 1.00 0.00 H new ATOM 0 HE1 PHE A 138 4.187 4.473 -2.761 1.00 0.00 H new ATOM 0 HE2 PHE A 138 3.208 4.185 1.423 1.00 0.00 H new ATOM 0 HZ PHE A 138 2.627 4.952 -0.877 1.00 0.00 H new ATOM 2219 N ARG A 139 7.626 4.875 2.490 1.00 0.00 N ATOM 2220 CA ARG A 139 7.091 5.903 3.382 1.00 0.00 C ATOM 2221 C ARG A 139 8.039 7.112 3.475 1.00 0.00 C ATOM 2222 O ARG A 139 7.615 8.261 3.356 1.00 0.00 O ATOM 2223 CB ARG A 139 6.808 5.303 4.774 1.00 0.00 C ATOM 2224 CG ARG A 139 5.683 4.252 4.749 1.00 0.00 C ATOM 2225 CD ARG A 139 5.328 3.698 6.139 1.00 0.00 C ATOM 2226 NE ARG A 139 6.427 2.903 6.715 1.00 0.00 N ATOM 2227 CZ ARG A 139 6.432 1.584 6.985 1.00 0.00 C ATOM 2228 NH1 ARG A 139 5.382 0.795 6.731 1.00 0.00 N ATOM 2229 NH2 ARG A 139 7.528 1.040 7.530 1.00 0.00 N ATOM 0 H ARG A 139 7.683 3.950 2.916 1.00 0.00 H new ATOM 0 HA ARG A 139 6.151 6.264 2.966 1.00 0.00 H new ATOM 0 HB2 ARG A 139 7.719 4.846 5.160 1.00 0.00 H new ATOM 0 HB3 ARG A 139 6.537 6.104 5.462 1.00 0.00 H new ATOM 0 HG2 ARG A 139 4.792 4.696 4.306 1.00 0.00 H new ATOM 0 HG3 ARG A 139 5.983 3.426 4.104 1.00 0.00 H new ATOM 0 HD2 ARG A 139 5.089 4.525 6.808 1.00 0.00 H new ATOM 0 HD3 ARG A 139 4.434 3.079 6.065 1.00 0.00 H new ATOM 0 HE ARG A 139 7.284 3.411 6.935 1.00 0.00 H new ATOM 0 HH11 ARG A 139 4.537 1.188 6.317 1.00 0.00 H new ATOM 0 HH12 ARG A 139 5.427 -0.200 6.951 1.00 0.00 H new ATOM 0 HH21 ARG A 139 8.340 1.623 7.733 1.00 0.00 H new ATOM 0 HH22 ARG A 139 7.551 0.042 7.742 1.00 0.00 H new ATOM 2243 N LYS A 140 9.335 6.860 3.663 1.00 0.00 N ATOM 2244 CA LYS A 140 10.350 7.897 3.771 1.00 0.00 C ATOM 2245 C LYS A 140 10.527 8.669 2.465 1.00 0.00 C ATOM 2246 O LYS A 140 10.754 9.877 2.509 1.00 0.00 O ATOM 2247 CB LYS A 140 11.691 7.300 4.208 1.00 0.00 C ATOM 2248 CG LYS A 140 11.691 6.941 5.699 1.00 0.00 C ATOM 2249 CD LYS A 140 13.022 6.314 6.141 1.00 0.00 C ATOM 2250 CE LYS A 140 14.245 7.218 5.930 1.00 0.00 C ATOM 2251 NZ LYS A 140 14.069 8.549 6.538 1.00 0.00 N ATOM 0 H LYS A 140 9.710 5.915 3.745 1.00 0.00 H new ATOM 0 HA LYS A 140 10.004 8.600 4.529 1.00 0.00 H new ATOM 0 HB2 LYS A 140 11.902 6.408 3.619 1.00 0.00 H new ATOM 0 HB3 LYS A 140 12.490 8.013 4.005 1.00 0.00 H new ATOM 0 HG2 LYS A 140 11.500 7.838 6.288 1.00 0.00 H new ATOM 0 HG3 LYS A 140 10.877 6.246 5.904 1.00 0.00 H new ATOM 0 HD2 LYS A 140 12.955 6.053 7.197 1.00 0.00 H new ATOM 0 HD3 LYS A 140 13.173 5.384 5.592 1.00 0.00 H new ATOM 0 HE2 LYS A 140 15.126 6.739 6.358 1.00 0.00 H new ATOM 0 HE3 LYS A 140 14.431 7.331 4.862 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 14.945 9.099 6.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 13.287 9.046 6.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 13.851 8.443 7.549 1.00 0.00 H new ATOM 2265 N ASP A 141 10.388 8.022 1.302 1.00 0.00 N ATOM 2266 CA ASP A 141 10.552 8.730 0.047 1.00 0.00 C ATOM 2267 C ASP A 141 9.398 9.709 -0.049 1.00 0.00 C ATOM 2268 O ASP A 141 9.592 10.907 -0.244 1.00 0.00 O ATOM 2269 CB ASP A 141 10.595 7.762 -1.140 1.00 0.00 C ATOM 2270 CG ASP A 141 10.801 8.538 -2.436 1.00 0.00 C ATOM 2271 OD1 ASP A 141 9.776 8.942 -3.022 1.00 0.00 O ATOM 2272 OD2 ASP A 141 11.976 8.729 -2.814 1.00 0.00 O ATOM 0 H ASP A 141 10.167 7.030 1.213 1.00 0.00 H new ATOM 0 HA ASP A 141 11.502 9.263 0.016 1.00 0.00 H new ATOM 0 HB2 ASP A 141 11.403 7.043 -1.005 1.00 0.00 H new ATOM 0 HB3 ASP A 141 9.667 7.193 -1.190 1.00 0.00 H new ATOM 2277 N ILE A 142 8.183 9.198 0.145 1.00 0.00 N ATOM 2278 CA ILE A 142 6.993 10.026 0.112 1.00 0.00 C ATOM 2279 C ILE A 142 7.112 11.160 1.136 1.00 0.00 C ATOM 2280 O ILE A 142 6.778 12.300 0.830 1.00 0.00 O ATOM 2281 CB ILE A 142 5.737 9.146 0.238 1.00 0.00 C ATOM 2282 CG1 ILE A 142 5.754 8.208 -0.984 1.00 0.00 C ATOM 2283 CG2 ILE A 142 4.494 10.036 0.329 1.00 0.00 C ATOM 2284 CD1 ILE A 142 4.377 7.647 -1.339 1.00 0.00 C ATOM 0 H ILE A 142 8.004 8.210 0.327 1.00 0.00 H new ATOM 0 HA ILE A 142 6.891 10.528 -0.850 1.00 0.00 H new ATOM 0 HB ILE A 142 5.720 8.541 1.145 1.00 0.00 H new ATOM 0 HG12 ILE A 142 6.150 8.750 -1.843 1.00 0.00 H new ATOM 0 HG13 ILE A 142 6.436 7.380 -0.788 1.00 0.00 H new ATOM 0 HG21 ILE A 142 3.605 9.412 0.418 1.00 0.00 H new ATOM 0 HG22 ILE A 142 4.573 10.682 1.203 1.00 0.00 H new ATOM 0 HG23 ILE A 142 4.418 10.648 -0.569 1.00 0.00 H new ATOM 0 HD11 ILE A 142 4.463 6.995 -2.208 1.00 0.00 H new ATOM 0 HD12 ILE A 142 3.988 7.077 -0.495 1.00 0.00 H new ATOM 0 HD13 ILE A 142 3.697 8.468 -1.567 1.00 0.00 H new ATOM 2296 N ALA A 143 7.619 10.872 2.335 1.00 0.00 N ATOM 2297 CA ALA A 143 7.847 11.872 3.372 1.00 0.00 C ATOM 2298 C ALA A 143 8.810 12.955 2.872 1.00 0.00 C ATOM 2299 O ALA A 143 8.562 14.142 3.065 1.00 0.00 O ATOM 2300 CB ALA A 143 8.376 11.209 4.645 1.00 0.00 C ATOM 0 H ALA A 143 7.885 9.928 2.614 1.00 0.00 H new ATOM 0 HA ALA A 143 6.897 12.351 3.610 1.00 0.00 H new ATOM 0 HB1 ALA A 143 8.541 11.969 5.409 1.00 0.00 H new ATOM 0 HB2 ALA A 143 7.648 10.483 5.006 1.00 0.00 H new ATOM 0 HB3 ALA A 143 9.316 10.703 4.428 1.00 0.00 H new ATOM 2306 N ALA A 144 9.907 12.564 2.223 1.00 0.00 N ATOM 2307 CA ALA A 144 10.840 13.519 1.645 1.00 0.00 C ATOM 2308 C ALA A 144 10.154 14.360 0.565 1.00 0.00 C ATOM 2309 O ALA A 144 10.369 15.571 0.487 1.00 0.00 O ATOM 2310 CB ALA A 144 12.067 12.782 1.103 1.00 0.00 C ATOM 0 H ALA A 144 10.168 11.587 2.086 1.00 0.00 H new ATOM 0 HA ALA A 144 11.177 14.208 2.420 1.00 0.00 H new ATOM 0 HB1 ALA A 144 12.762 13.502 0.671 1.00 0.00 H new ATOM 0 HB2 ALA A 144 12.558 12.246 1.915 1.00 0.00 H new ATOM 0 HB3 ALA A 144 11.756 12.073 0.336 1.00 0.00 H new ATOM 2316 N LYS A 145 9.317 13.733 -0.267 1.00 0.00 N ATOM 2317 CA LYS A 145 8.576 14.477 -1.279 1.00 0.00 C ATOM 2318 C LYS A 145 7.646 15.476 -0.589 1.00 0.00 C ATOM 2319 O LYS A 145 7.647 16.656 -0.925 1.00 0.00 O ATOM 2320 CB LYS A 145 7.824 13.540 -2.230 1.00 0.00 C ATOM 2321 CG LYS A 145 8.657 13.140 -3.455 1.00 0.00 C ATOM 2322 CD LYS A 145 9.901 12.321 -3.101 1.00 0.00 C ATOM 2323 CE LYS A 145 10.708 11.920 -4.341 1.00 0.00 C ATOM 2324 NZ LYS A 145 11.322 13.089 -4.997 1.00 0.00 N ATOM 0 H LYS A 145 9.140 12.729 -0.258 1.00 0.00 H new ATOM 0 HA LYS A 145 9.277 15.033 -1.901 1.00 0.00 H new ATOM 0 HB2 LYS A 145 7.528 12.641 -1.689 1.00 0.00 H new ATOM 0 HB3 LYS A 145 6.908 14.027 -2.563 1.00 0.00 H new ATOM 0 HG2 LYS A 145 8.033 12.563 -4.137 1.00 0.00 H new ATOM 0 HG3 LYS A 145 8.963 14.041 -3.987 1.00 0.00 H new ATOM 0 HD2 LYS A 145 10.535 12.900 -2.430 1.00 0.00 H new ATOM 0 HD3 LYS A 145 9.600 11.423 -2.560 1.00 0.00 H new ATOM 0 HE2 LYS A 145 11.487 11.213 -4.055 1.00 0.00 H new ATOM 0 HE3 LYS A 145 10.056 11.407 -5.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 11.941 12.769 -5.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 10.576 13.702 -5.383 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 11.883 13.622 -4.302 1.00 0.00 H new ATOM 2338 N TYR A 146 6.948 15.040 0.458 1.00 0.00 N ATOM 2339 CA TYR A 146 6.062 15.889 1.232 1.00 0.00 C ATOM 2340 C TYR A 146 6.852 17.078 1.781 1.00 0.00 C ATOM 2341 O TYR A 146 6.440 18.222 1.622 1.00 0.00 O ATOM 2342 CB TYR A 146 5.477 15.096 2.396 1.00 0.00 C ATOM 2343 CG TYR A 146 4.225 14.288 2.143 1.00 0.00 C ATOM 2344 CD1 TYR A 146 3.909 13.733 0.880 1.00 0.00 C ATOM 2345 CD2 TYR A 146 3.387 14.037 3.243 1.00 0.00 C ATOM 2346 CE1 TYR A 146 2.773 12.916 0.742 1.00 0.00 C ATOM 2347 CE2 TYR A 146 2.311 13.153 3.118 1.00 0.00 C ATOM 2348 CZ TYR A 146 1.987 12.604 1.863 1.00 0.00 C ATOM 2349 OH TYR A 146 0.912 11.781 1.725 1.00 0.00 O ATOM 0 H TYR A 146 6.986 14.077 0.791 1.00 0.00 H new ATOM 0 HA TYR A 146 5.254 16.245 0.593 1.00 0.00 H new ATOM 0 HB2 TYR A 146 6.247 14.415 2.757 1.00 0.00 H new ATOM 0 HB3 TYR A 146 5.266 15.796 3.205 1.00 0.00 H new ATOM 0 HD1 TYR A 146 4.538 13.936 0.026 1.00 0.00 H new ATOM 0 HD2 TYR A 146 3.575 14.528 4.187 1.00 0.00 H new ATOM 0 HE1 TYR A 146 2.504 12.527 -0.229 1.00 0.00 H new ATOM 0 HE2 TYR A 146 1.726 12.890 3.987 1.00 0.00 H new ATOM 0 HH TYR A 146 0.391 11.781 2.555 1.00 0.00 H new ATOM 2359 N LYS A 147 8.003 16.820 2.408 1.00 0.00 N ATOM 2360 CA LYS A 147 8.852 17.870 2.949 1.00 0.00 C ATOM 2361 C LYS A 147 9.219 18.868 1.849 1.00 0.00 C ATOM 2362 O LYS A 147 9.130 20.074 2.062 1.00 0.00 O ATOM 2363 CB LYS A 147 10.098 17.258 3.608 1.00 0.00 C ATOM 2364 CG LYS A 147 10.900 18.310 4.389 1.00 0.00 C ATOM 2365 CD LYS A 147 12.258 17.766 4.852 1.00 0.00 C ATOM 2366 CE LYS A 147 12.120 16.574 5.807 1.00 0.00 C ATOM 2367 NZ LYS A 147 13.430 16.166 6.343 1.00 0.00 N ATOM 0 H LYS A 147 8.367 15.878 2.552 1.00 0.00 H new ATOM 0 HA LYS A 147 8.308 18.415 3.720 1.00 0.00 H new ATOM 0 HB2 LYS A 147 9.797 16.456 4.282 1.00 0.00 H new ATOM 0 HB3 LYS A 147 10.732 16.811 2.843 1.00 0.00 H new ATOM 0 HG2 LYS A 147 11.055 19.188 3.762 1.00 0.00 H new ATOM 0 HG3 LYS A 147 10.325 18.635 5.256 1.00 0.00 H new ATOM 0 HD2 LYS A 147 12.840 17.464 3.982 1.00 0.00 H new ATOM 0 HD3 LYS A 147 12.814 18.562 5.348 1.00 0.00 H new ATOM 0 HE2 LYS A 147 11.454 16.838 6.629 1.00 0.00 H new ATOM 0 HE3 LYS A 147 11.662 15.736 5.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 13.306 15.358 6.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 14.056 15.892 5.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 13.855 16.960 6.863 1.00 0.00 H new