USER MOD reduce.3.24.130724 H: found=0, std=0, add=1312, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1305 hydrogens (45 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 153 HIS : no HE2:sc= -1.96! C(o=-0.94!,f=-16!) USER MOD Set 1.2: A 155 TYR OH : rot 114:sc= 1.02 USER MOD Set 2.1: A 138 LYS NZ :NH3+ 164:sc= 0.683 (180deg=-0.0123) USER MOD Set 2.2: A 141 SER OG : rot 120:sc= -1.5 USER MOD Set 3.1: A 58 THR OG1 : rot -120:sc= -0.0396 USER MOD Set 3.2: A 92 GLN : amide:sc= -0.112 K(o=-0.15,f=-1.8!) USER MOD Set 4.1: A 85 TYR OH : rot -73:sc= 1.21 USER MOD Set 4.2: A 89 HIS : no HE2:sc= -1.45 K(o=-0.24,f=-5.7!) USER MOD Set 5.1: A 63 THR OG1 : rot 27:sc= -0.207 USER MOD Set 5.2: A 65 GLN :FLIP amide:sc= -1.45 F(o=-3.3!,f=-1.7) USER MOD Set 6.1: A 29 TYR OH : rot -116:sc= 0.245 USER MOD Set 6.2: A 33 GLN : amide:sc= -4.8! C(o=-4.6!,f=-12!) USER MOD Single : A 1 THR N :NH3+ -176:sc= -0.29 (180deg=-0.355) USER MOD Single : A 1 THR OG1 : rot 168:sc= -0.0528 USER MOD Single : A 7 GLN :FLIP amide:sc= -1.76! C(o=-2.3!,f=-1.8!) USER MOD Single : A 15 LYS NZ :NH3+ -111:sc= 0.302 (180deg=0) USER MOD Single : A 18 HIS : no HE2:sc= -1.69 K(o=-1.7,f=-2.2) USER MOD Single : A 22 HIS : no HD1:sc= -0.156 X(o=-0.16,f=-0.34) USER MOD Single : A 28 HIS : no HD1:sc= -0.264 X(o=-0.26,f=-0.11) USER MOD Single : A 34 THR OG1 : rot -84:sc= 1.27 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 MET CE :methyl -118:sc= -4.06! (180deg=-10.8!) USER MOD Single : A 45 THR OG1 : rot 67:sc= 0.363 USER MOD Single : A 46 TYR OH : rot 180:sc= -0.0048 USER MOD Single : A 48 SER OG : rot -110:sc= -0.0392 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 ASN : amide:sc= -1.42 K(o=-1.4,f=-7.1!) USER MOD Single : A 64 HIS :FLIP no HE2:sc= -0.401 F(o=-1.2,f=-0.4) USER MOD Single : A 68 TYR OH : rot 180:sc= -0.0552 USER MOD Single : A 69 GLN : amide:sc= -0.0257 X(o=-0.026,f=-0.23) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 HIS : no HE2:sc= -4.29! C(o=-4.3!,f=-10!) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 GLN : amide:sc= -0.112 X(o=-0.11,f=0) USER MOD Single : A 101 GLN : amide:sc= -0.245 X(o=-0.24,f=-0.023) USER MOD Single : A 104 THR OG1 : rot 180:sc= -2.16! USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 SER OG : rot 39:sc= 0.681! USER MOD Single : A 126 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 LYS NZ :NH3+ -130:sc= 0 (180deg=-0.696) USER MOD Single : A 128 MET CE :methyl -133:sc= -6.1! (180deg=-10.4!) USER MOD Single : A 132 ASN : amide:sc= -1.05 K(o=-1,f=-6.4!) USER MOD Single : A 137 THR OG1 : rot -140:sc= -0.351 USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 143 THR OG1 : rot 180:sc= -0.316 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0.00512 USER MOD Single : A 148 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 152 THR OG1 : rot 96:sc= 0.236 USER MOD Single : A 154 THR OG1 : rot -159:sc= -1.62! USER MOD Single : A 159 GLN :FLIP amide:sc= -0.487 F(o=-4.2!,f=-0.49) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 168 NDP O2D : rot -22:sc= -0.0933 USER MOD Single : A 168 NDP O3B : rot 97:sc= 0.0946 USER MOD Single : A 168 NDP O3D : rot -100:sc= -1.02 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -5.582 10.579 3.125 1.00 0.00 N ATOM 2 CA THR A 1 -5.230 9.282 2.483 1.00 0.00 C ATOM 3 C THR A 1 -3.731 9.022 2.644 1.00 0.00 C ATOM 4 O THR A 1 -2.917 9.901 2.453 1.00 0.00 O ATOM 5 CB THR A 1 -5.581 9.337 0.994 1.00 0.00 C ATOM 6 OG1 THR A 1 -6.856 9.939 0.832 1.00 0.00 O ATOM 7 CG2 THR A 1 -5.606 7.921 0.418 1.00 0.00 C ATOM 0 H1 THR A 1 -6.611 10.723 3.075 1.00 0.00 H new ATOM 0 H2 THR A 1 -5.282 10.566 4.121 1.00 0.00 H new ATOM 0 H3 THR A 1 -5.099 11.355 2.628 1.00 0.00 H new ATOM 0 HA THR A 1 -5.791 8.478 2.959 1.00 0.00 H new ATOM 0 HB THR A 1 -4.831 9.926 0.467 1.00 0.00 H new ATOM 0 HG1 THR A 1 -7.000 10.151 -0.114 1.00 0.00 H new ATOM 0 HG21 THR A 1 -5.856 7.964 -0.642 1.00 0.00 H new ATOM 0 HG22 THR A 1 -4.626 7.461 0.541 1.00 0.00 H new ATOM 0 HG23 THR A 1 -6.354 7.328 0.944 1.00 0.00 H new ATOM 17 N ALA A 2 -3.360 7.820 2.996 1.00 0.00 N ATOM 18 CA ALA A 2 -1.912 7.510 3.173 1.00 0.00 C ATOM 19 C ALA A 2 -1.494 6.400 2.207 1.00 0.00 C ATOM 20 O ALA A 2 -2.272 5.532 1.870 1.00 0.00 O ATOM 21 CB ALA A 2 -1.665 7.048 4.610 1.00 0.00 C ATOM 0 H ALA A 2 -3.996 7.041 3.168 1.00 0.00 H new ATOM 0 HA ALA A 2 -1.326 8.406 2.966 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -0.607 6.821 4.742 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -1.955 7.839 5.301 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -2.256 6.155 4.812 1.00 0.00 H new ATOM 27 N PHE A 3 -0.263 6.418 1.774 1.00 0.00 N ATOM 28 CA PHE A 3 0.225 5.362 0.840 1.00 0.00 C ATOM 29 C PHE A 3 1.072 4.367 1.633 1.00 0.00 C ATOM 30 O PHE A 3 1.938 4.756 2.393 1.00 0.00 O ATOM 31 CB PHE A 3 1.103 6.002 -0.238 1.00 0.00 C ATOM 32 CG PHE A 3 0.259 6.562 -1.363 1.00 0.00 C ATOM 33 CD1 PHE A 3 -0.975 7.168 -1.101 1.00 0.00 C ATOM 34 CD2 PHE A 3 0.731 6.484 -2.674 1.00 0.00 C ATOM 35 CE1 PHE A 3 -1.731 7.692 -2.154 1.00 0.00 C ATOM 36 CE2 PHE A 3 -0.026 7.006 -3.726 1.00 0.00 C ATOM 37 CZ PHE A 3 -1.256 7.610 -3.466 1.00 0.00 C ATOM 0 H PHE A 3 0.430 7.122 2.028 1.00 0.00 H new ATOM 0 HA PHE A 3 -0.622 4.859 0.374 1.00 0.00 H new ATOM 0 HB2 PHE A 3 1.703 6.798 0.202 1.00 0.00 H new ATOM 0 HB3 PHE A 3 1.797 5.261 -0.634 1.00 0.00 H new ATOM 0 HD1 PHE A 3 -1.343 7.231 -0.087 1.00 0.00 H new ATOM 0 HD2 PHE A 3 1.684 6.019 -2.876 1.00 0.00 H new ATOM 0 HE1 PHE A 3 -2.683 8.161 -1.953 1.00 0.00 H new ATOM 0 HE2 PHE A 3 0.341 6.942 -4.740 1.00 0.00 H new ATOM 0 HZ PHE A 3 -1.841 8.014 -4.278 1.00 0.00 H new ATOM 47 N LEU A 4 0.841 3.089 1.478 1.00 0.00 N ATOM 48 CA LEU A 4 1.650 2.098 2.242 1.00 0.00 C ATOM 49 C LEU A 4 2.162 1.012 1.290 1.00 0.00 C ATOM 50 O LEU A 4 1.483 0.041 1.027 1.00 0.00 O ATOM 51 CB LEU A 4 0.767 1.468 3.328 1.00 0.00 C ATOM 52 CG LEU A 4 1.465 0.252 3.949 1.00 0.00 C ATOM 53 CD1 LEU A 4 2.806 0.675 4.554 1.00 0.00 C ATOM 54 CD2 LEU A 4 0.574 -0.333 5.046 1.00 0.00 C ATOM 0 H LEU A 4 0.133 2.693 0.860 1.00 0.00 H new ATOM 0 HA LEU A 4 2.503 2.592 2.706 1.00 0.00 H new ATOM 0 HB2 LEU A 4 0.550 2.205 4.102 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -0.188 1.166 2.899 1.00 0.00 H new ATOM 0 HG LEU A 4 1.641 -0.497 3.177 1.00 0.00 H new ATOM 0 HD11 LEU A 4 3.297 -0.193 4.994 1.00 0.00 H new ATOM 0 HD12 LEU A 4 3.441 1.095 3.774 1.00 0.00 H new ATOM 0 HD13 LEU A 4 2.636 1.425 5.326 1.00 0.00 H new ATOM 0 HD21 LEU A 4 1.065 -1.198 5.491 1.00 0.00 H new ATOM 0 HD22 LEU A 4 0.400 0.421 5.814 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -0.380 -0.639 4.616 1.00 0.00 H new ATOM 66 N TRP A 5 3.355 1.165 0.775 1.00 0.00 N ATOM 67 CA TRP A 5 3.897 0.130 -0.150 1.00 0.00 C ATOM 68 C TRP A 5 5.363 -0.162 0.186 1.00 0.00 C ATOM 69 O TRP A 5 5.958 0.472 1.038 1.00 0.00 O ATOM 70 CB TRP A 5 3.770 0.612 -1.604 1.00 0.00 C ATOM 71 CG TRP A 5 4.816 1.637 -1.926 1.00 0.00 C ATOM 72 CD1 TRP A 5 5.946 1.396 -2.631 1.00 0.00 C ATOM 73 CD2 TRP A 5 4.841 3.054 -1.587 1.00 0.00 C ATOM 74 NE1 TRP A 5 6.664 2.573 -2.745 1.00 0.00 N ATOM 75 CE2 TRP A 5 6.024 3.624 -2.119 1.00 0.00 C ATOM 76 CE3 TRP A 5 3.962 3.893 -0.877 1.00 0.00 C ATOM 77 CZ2 TRP A 5 6.322 4.976 -1.954 1.00 0.00 C ATOM 78 CZ3 TRP A 5 4.261 5.255 -0.710 1.00 0.00 C ATOM 79 CH2 TRP A 5 5.437 5.795 -1.248 1.00 0.00 C ATOM 0 H TRP A 5 3.972 1.957 0.954 1.00 0.00 H new ATOM 0 HA TRP A 5 3.323 -0.789 -0.031 1.00 0.00 H new ATOM 0 HB2 TRP A 5 3.867 -0.236 -2.281 1.00 0.00 H new ATOM 0 HB3 TRP A 5 2.779 1.036 -1.765 1.00 0.00 H new ATOM 0 HD1 TRP A 5 6.240 0.440 -3.038 1.00 0.00 H new ATOM 0 HE1 TRP A 5 7.557 2.654 -3.232 1.00 0.00 H new ATOM 0 HE3 TRP A 5 3.053 3.487 -0.458 1.00 0.00 H new ATOM 0 HZ2 TRP A 5 7.230 5.387 -2.369 1.00 0.00 H new ATOM 0 HZ3 TRP A 5 3.580 5.891 -0.163 1.00 0.00 H new ATOM 0 HH2 TRP A 5 5.659 6.844 -1.117 1.00 0.00 H new ATOM 90 N ALA A 6 5.944 -1.118 -0.485 1.00 0.00 N ATOM 91 CA ALA A 6 7.369 -1.464 -0.228 1.00 0.00 C ATOM 92 C ALA A 6 8.100 -1.518 -1.567 1.00 0.00 C ATOM 93 O ALA A 6 7.561 -1.978 -2.554 1.00 0.00 O ATOM 94 CB ALA A 6 7.452 -2.829 0.461 1.00 0.00 C ATOM 0 H ALA A 6 5.488 -1.678 -1.206 1.00 0.00 H new ATOM 0 HA ALA A 6 7.826 -0.715 0.419 1.00 0.00 H new ATOM 0 HB1 ALA A 6 8.496 -3.079 0.648 1.00 0.00 H new ATOM 0 HB2 ALA A 6 6.913 -2.792 1.408 1.00 0.00 H new ATOM 0 HB3 ALA A 6 7.006 -3.588 -0.181 1.00 0.00 H new ATOM 100 N GLN A 7 9.310 -1.034 -1.622 1.00 0.00 N ATOM 101 CA GLN A 7 10.045 -1.053 -2.917 1.00 0.00 C ATOM 102 C GLN A 7 11.534 -1.301 -2.686 1.00 0.00 C ATOM 103 O GLN A 7 12.069 -1.022 -1.632 1.00 0.00 O ATOM 104 CB GLN A 7 9.857 0.288 -3.628 1.00 0.00 C ATOM 105 CG GLN A 7 10.202 1.429 -2.668 1.00 0.00 C ATOM 106 CD GLN A 7 10.896 2.556 -3.435 1.00 0.00 C ATOM 107 OE1 GLN A 7 12.195 2.539 -3.561 1.00 0.00 O flip ATOM 108 NE2 GLN A 7 10.250 3.462 -3.924 1.00 0.00 N flip ATOM 0 H GLN A 7 9.817 -0.630 -0.835 1.00 0.00 H new ATOM 0 HA GLN A 7 9.647 -1.859 -3.533 1.00 0.00 H new ATOM 0 HB2 GLN A 7 10.495 0.336 -4.511 1.00 0.00 H new ATOM 0 HB3 GLN A 7 8.828 0.388 -3.973 1.00 0.00 H new ATOM 0 HG2 GLN A 7 9.296 1.804 -2.193 1.00 0.00 H new ATOM 0 HG3 GLN A 7 10.851 1.064 -1.872 1.00 0.00 H new ATOM 0 HE21 GLN A 7 9.235 3.475 -3.826 1.00 0.00 H new ATOM 0 HE22 GLN A 7 10.723 4.209 -4.433 1.00 0.00 H new ATOM 117 N ASP A 8 12.202 -1.828 -3.677 1.00 0.00 N ATOM 118 CA ASP A 8 13.659 -2.104 -3.540 1.00 0.00 C ATOM 119 C ASP A 8 14.451 -0.823 -3.816 1.00 0.00 C ATOM 120 O ASP A 8 13.902 0.261 -3.852 1.00 0.00 O ATOM 121 CB ASP A 8 14.063 -3.193 -4.538 1.00 0.00 C ATOM 122 CG ASP A 8 13.683 -2.759 -5.955 1.00 0.00 C ATOM 123 OD1 ASP A 8 14.149 -1.714 -6.379 1.00 0.00 O ATOM 124 OD2 ASP A 8 12.935 -3.480 -6.593 1.00 0.00 O ATOM 0 H ASP A 8 11.798 -2.080 -4.579 1.00 0.00 H new ATOM 0 HA ASP A 8 13.875 -2.445 -2.527 1.00 0.00 H new ATOM 0 HB2 ASP A 8 15.136 -3.375 -4.478 1.00 0.00 H new ATOM 0 HB3 ASP A 8 13.566 -4.131 -4.289 1.00 0.00 H new ATOM 129 N ARG A 9 15.740 -0.938 -4.000 1.00 0.00 N ATOM 130 CA ARG A 9 16.571 0.274 -4.260 1.00 0.00 C ATOM 131 C ARG A 9 16.093 0.986 -5.533 1.00 0.00 C ATOM 132 O ARG A 9 15.989 2.197 -5.567 1.00 0.00 O ATOM 133 CB ARG A 9 18.042 -0.129 -4.412 1.00 0.00 C ATOM 134 CG ARG A 9 18.178 -1.259 -5.439 1.00 0.00 C ATOM 135 CD ARG A 9 18.711 -0.699 -6.762 1.00 0.00 C ATOM 136 NE ARG A 9 19.991 -1.385 -7.113 1.00 0.00 N ATOM 137 CZ ARG A 9 21.134 -0.983 -6.607 1.00 0.00 C ATOM 138 NH1 ARG A 9 21.186 0.033 -5.783 1.00 0.00 N ATOM 139 NH2 ARG A 9 22.235 -1.605 -6.930 1.00 0.00 N ATOM 0 H ARG A 9 16.253 -1.819 -3.981 1.00 0.00 H new ATOM 0 HA ARG A 9 16.469 0.957 -3.417 1.00 0.00 H new ATOM 0 HB2 ARG A 9 18.632 0.732 -4.727 1.00 0.00 H new ATOM 0 HB3 ARG A 9 18.439 -0.452 -3.450 1.00 0.00 H new ATOM 0 HG2 ARG A 9 18.853 -2.027 -5.061 1.00 0.00 H new ATOM 0 HG3 ARG A 9 17.211 -1.735 -5.599 1.00 0.00 H new ATOM 0 HD2 ARG A 9 17.977 -0.848 -7.554 1.00 0.00 H new ATOM 0 HD3 ARG A 9 18.873 0.375 -6.675 1.00 0.00 H new ATOM 0 HE ARG A 9 19.977 -2.177 -7.755 1.00 0.00 H new ATOM 0 HH11 ARG A 9 20.330 0.525 -5.525 1.00 0.00 H new ATOM 0 HH12 ARG A 9 22.082 0.333 -5.399 1.00 0.00 H new ATOM 0 HH21 ARG A 9 22.204 -2.397 -7.571 1.00 0.00 H new ATOM 0 HH22 ARG A 9 23.127 -1.299 -6.541 1.00 0.00 H new ATOM 153 N ASP A 10 15.808 0.256 -6.581 1.00 0.00 N ATOM 154 CA ASP A 10 15.346 0.907 -7.844 1.00 0.00 C ATOM 155 C ASP A 10 13.937 1.475 -7.645 1.00 0.00 C ATOM 156 O ASP A 10 13.579 2.488 -8.214 1.00 0.00 O ATOM 157 CB ASP A 10 15.327 -0.127 -8.973 1.00 0.00 C ATOM 158 CG ASP A 10 16.540 0.084 -9.881 1.00 0.00 C ATOM 159 OD1 ASP A 10 16.480 0.968 -10.721 1.00 0.00 O ATOM 160 OD2 ASP A 10 17.508 -0.640 -9.721 1.00 0.00 O ATOM 0 H ASP A 10 15.875 -0.761 -6.617 1.00 0.00 H new ATOM 0 HA ASP A 10 16.027 1.717 -8.104 1.00 0.00 H new ATOM 0 HB2 ASP A 10 15.342 -1.135 -8.558 1.00 0.00 H new ATOM 0 HB3 ASP A 10 14.407 -0.034 -9.550 1.00 0.00 H new ATOM 165 N GLY A 11 13.145 0.837 -6.828 1.00 0.00 N ATOM 166 CA GLY A 11 11.765 1.347 -6.577 1.00 0.00 C ATOM 167 C GLY A 11 10.723 0.413 -7.201 1.00 0.00 C ATOM 168 O GLY A 11 9.725 0.857 -7.733 1.00 0.00 O ATOM 0 H GLY A 11 13.392 -0.014 -6.323 1.00 0.00 H new ATOM 0 HA2 GLY A 11 11.591 1.429 -5.504 1.00 0.00 H new ATOM 0 HA3 GLY A 11 11.660 2.348 -6.994 1.00 0.00 H new ATOM 172 N LEU A 12 10.934 -0.873 -7.126 1.00 0.00 N ATOM 173 CA LEU A 12 9.941 -1.829 -7.702 1.00 0.00 C ATOM 174 C LEU A 12 8.838 -2.073 -6.670 1.00 0.00 C ATOM 175 O LEU A 12 9.016 -1.797 -5.502 1.00 0.00 O ATOM 176 CB LEU A 12 10.642 -3.151 -8.021 1.00 0.00 C ATOM 177 CG LEU A 12 9.801 -3.952 -9.013 1.00 0.00 C ATOM 178 CD1 LEU A 12 9.930 -3.333 -10.406 1.00 0.00 C ATOM 179 CD2 LEU A 12 10.296 -5.399 -9.044 1.00 0.00 C ATOM 0 H LEU A 12 11.750 -1.304 -6.691 1.00 0.00 H new ATOM 0 HA LEU A 12 9.510 -1.418 -8.615 1.00 0.00 H new ATOM 0 HB2 LEU A 12 11.630 -2.958 -8.439 1.00 0.00 H new ATOM 0 HB3 LEU A 12 10.789 -3.726 -7.107 1.00 0.00 H new ATOM 0 HG LEU A 12 8.755 -3.934 -8.706 1.00 0.00 H new ATOM 0 HD11 LEU A 12 9.330 -3.904 -11.115 1.00 0.00 H new ATOM 0 HD12 LEU A 12 9.577 -2.302 -10.380 1.00 0.00 H new ATOM 0 HD13 LEU A 12 10.975 -3.352 -10.717 1.00 0.00 H new ATOM 0 HD21 LEU A 12 9.698 -5.973 -9.751 1.00 0.00 H new ATOM 0 HD22 LEU A 12 11.341 -5.419 -9.353 1.00 0.00 H new ATOM 0 HD23 LEU A 12 10.202 -5.837 -8.050 1.00 0.00 H new ATOM 191 N ILE A 13 7.702 -2.588 -7.075 1.00 0.00 N ATOM 192 CA ILE A 13 6.612 -2.845 -6.084 1.00 0.00 C ATOM 193 C ILE A 13 6.025 -4.247 -6.289 1.00 0.00 C ATOM 194 O ILE A 13 5.326 -4.756 -5.435 1.00 0.00 O ATOM 195 CB ILE A 13 5.497 -1.809 -6.236 1.00 0.00 C ATOM 196 CG1 ILE A 13 5.147 -1.635 -7.719 1.00 0.00 C ATOM 197 CG2 ILE A 13 5.960 -0.475 -5.650 1.00 0.00 C ATOM 198 CD1 ILE A 13 3.628 -1.717 -7.904 1.00 0.00 C ATOM 0 H ILE A 13 7.484 -2.839 -8.039 1.00 0.00 H new ATOM 0 HA ILE A 13 7.039 -2.772 -5.084 1.00 0.00 H new ATOM 0 HB ILE A 13 4.610 -2.150 -5.702 1.00 0.00 H new ATOM 0 HG12 ILE A 13 5.516 -0.675 -8.079 1.00 0.00 H new ATOM 0 HG13 ILE A 13 5.637 -2.407 -8.311 1.00 0.00 H new ATOM 0 HG21 ILE A 13 5.167 0.265 -5.757 1.00 0.00 H new ATOM 0 HG22 ILE A 13 6.195 -0.604 -4.594 1.00 0.00 H new ATOM 0 HG23 ILE A 13 6.849 -0.133 -6.181 1.00 0.00 H new ATOM 0 HD11 ILE A 13 3.383 -1.593 -8.959 1.00 0.00 H new ATOM 0 HD12 ILE A 13 3.271 -2.688 -7.560 1.00 0.00 H new ATOM 0 HD13 ILE A 13 3.148 -0.928 -7.325 1.00 0.00 H new ATOM 210 N GLY A 14 6.309 -4.890 -7.395 1.00 0.00 N ATOM 211 CA GLY A 14 5.761 -6.263 -7.604 1.00 0.00 C ATOM 212 C GLY A 14 5.437 -6.488 -9.078 1.00 0.00 C ATOM 213 O GLY A 14 5.102 -5.572 -9.797 1.00 0.00 O ATOM 0 H GLY A 14 6.889 -4.528 -8.152 1.00 0.00 H new ATOM 0 HA2 GLY A 14 6.484 -7.005 -7.267 1.00 0.00 H new ATOM 0 HA3 GLY A 14 4.862 -6.398 -7.003 1.00 0.00 H new ATOM 217 N LYS A 15 5.538 -7.708 -9.532 1.00 0.00 N ATOM 218 CA LYS A 15 5.239 -7.996 -10.962 1.00 0.00 C ATOM 219 C LYS A 15 4.270 -9.175 -11.066 1.00 0.00 C ATOM 220 O LYS A 15 4.422 -10.179 -10.398 1.00 0.00 O ATOM 221 CB LYS A 15 6.536 -8.340 -11.698 1.00 0.00 C ATOM 222 CG LYS A 15 6.316 -8.212 -13.209 1.00 0.00 C ATOM 223 CD LYS A 15 7.009 -9.371 -13.931 1.00 0.00 C ATOM 224 CE LYS A 15 6.790 -9.239 -15.440 1.00 0.00 C ATOM 225 NZ LYS A 15 8.097 -9.371 -16.145 1.00 0.00 N ATOM 0 H LYS A 15 5.814 -8.516 -8.974 1.00 0.00 H new ATOM 0 HA LYS A 15 4.783 -7.115 -11.414 1.00 0.00 H new ATOM 0 HB2 LYS A 15 7.336 -7.672 -11.378 1.00 0.00 H new ATOM 0 HB3 LYS A 15 6.849 -9.354 -11.450 1.00 0.00 H new ATOM 0 HG2 LYS A 15 5.249 -8.217 -13.433 1.00 0.00 H new ATOM 0 HG3 LYS A 15 6.712 -7.261 -13.565 1.00 0.00 H new ATOM 0 HD2 LYS A 15 8.076 -9.367 -13.706 1.00 0.00 H new ATOM 0 HD3 LYS A 15 6.612 -10.323 -13.577 1.00 0.00 H new ATOM 0 HE2 LYS A 15 6.099 -10.007 -15.787 1.00 0.00 H new ATOM 0 HE3 LYS A 15 6.337 -8.275 -15.670 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 8.364 -8.454 -16.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 8.827 -9.672 -15.469 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 8.013 -10.079 -16.902 1.00 0.00 H new ATOM 239 N ASP A 16 3.292 -9.067 -11.923 1.00 0.00 N ATOM 240 CA ASP A 16 2.316 -10.178 -12.116 1.00 0.00 C ATOM 241 C ASP A 16 1.722 -10.658 -10.783 1.00 0.00 C ATOM 242 O ASP A 16 1.822 -11.821 -10.441 1.00 0.00 O ATOM 243 CB ASP A 16 3.023 -11.346 -12.807 1.00 0.00 C ATOM 244 CG ASP A 16 3.014 -11.124 -14.321 1.00 0.00 C ATOM 245 OD1 ASP A 16 3.724 -10.242 -14.774 1.00 0.00 O ATOM 246 OD2 ASP A 16 2.298 -11.840 -15.001 1.00 0.00 O ATOM 0 H ASP A 16 3.125 -8.246 -12.505 1.00 0.00 H new ATOM 0 HA ASP A 16 1.495 -9.806 -12.729 1.00 0.00 H new ATOM 0 HB2 ASP A 16 4.048 -11.429 -12.447 1.00 0.00 H new ATOM 0 HB3 ASP A 16 2.523 -12.283 -12.563 1.00 0.00 H new ATOM 251 N GLY A 17 1.064 -9.797 -10.048 1.00 0.00 N ATOM 252 CA GLY A 17 0.424 -10.237 -8.770 1.00 0.00 C ATOM 253 C GLY A 17 1.458 -10.507 -7.671 1.00 0.00 C ATOM 254 O GLY A 17 1.624 -9.721 -6.759 1.00 0.00 O ATOM 0 H GLY A 17 0.942 -8.810 -10.277 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -0.273 -9.470 -8.431 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -0.159 -11.141 -8.949 1.00 0.00 H new ATOM 258 N HIS A 18 2.128 -11.627 -7.733 1.00 0.00 N ATOM 259 CA HIS A 18 3.125 -11.971 -6.672 1.00 0.00 C ATOM 260 C HIS A 18 4.151 -10.847 -6.503 1.00 0.00 C ATOM 261 O HIS A 18 4.056 -9.801 -7.114 1.00 0.00 O ATOM 262 CB HIS A 18 3.846 -13.266 -7.055 1.00 0.00 C ATOM 263 CG HIS A 18 4.462 -13.117 -8.418 1.00 0.00 C ATOM 264 ND1 HIS A 18 5.752 -12.645 -8.598 1.00 0.00 N ATOM 265 CD2 HIS A 18 3.978 -13.375 -9.676 1.00 0.00 C ATOM 266 CE1 HIS A 18 5.999 -12.634 -9.921 1.00 0.00 C ATOM 267 NE2 HIS A 18 4.950 -13.069 -10.624 1.00 0.00 N ATOM 0 H HIS A 18 2.029 -12.321 -8.474 1.00 0.00 H new ATOM 0 HA HIS A 18 2.597 -12.102 -5.727 1.00 0.00 H new ATOM 0 HB2 HIS A 18 4.617 -13.496 -6.320 1.00 0.00 H new ATOM 0 HB3 HIS A 18 3.144 -14.100 -7.052 1.00 0.00 H new ATOM 0 HD1 HIS A 18 6.397 -12.358 -7.862 1.00 0.00 H new ATOM 0 HD2 HIS A 18 2.992 -13.757 -9.897 1.00 0.00 H new ATOM 0 HE1 HIS A 18 6.932 -12.313 -10.361 1.00 0.00 H new ATOM 275 N LEU A 19 5.142 -11.071 -5.678 1.00 0.00 N ATOM 276 CA LEU A 19 6.193 -10.037 -5.459 1.00 0.00 C ATOM 277 C LEU A 19 7.536 -10.597 -5.935 1.00 0.00 C ATOM 278 O LEU A 19 7.661 -11.784 -6.161 1.00 0.00 O ATOM 279 CB LEU A 19 6.278 -9.694 -3.970 1.00 0.00 C ATOM 280 CG LEU A 19 5.289 -8.574 -3.649 1.00 0.00 C ATOM 281 CD1 LEU A 19 4.896 -8.645 -2.173 1.00 0.00 C ATOM 282 CD2 LEU A 19 5.940 -7.219 -3.936 1.00 0.00 C ATOM 0 H LEU A 19 5.267 -11.931 -5.145 1.00 0.00 H new ATOM 0 HA LEU A 19 5.947 -9.133 -6.016 1.00 0.00 H new ATOM 0 HB2 LEU A 19 6.054 -10.575 -3.369 1.00 0.00 H new ATOM 0 HB3 LEU A 19 7.291 -9.384 -3.714 1.00 0.00 H new ATOM 0 HG LEU A 19 4.399 -8.690 -4.268 1.00 0.00 H new ATOM 0 HD11 LEU A 19 4.191 -7.846 -1.945 1.00 0.00 H new ATOM 0 HD12 LEU A 19 4.431 -9.609 -1.966 1.00 0.00 H new ATOM 0 HD13 LEU A 19 5.786 -8.531 -1.554 1.00 0.00 H new ATOM 0 HD21 LEU A 19 5.234 -6.420 -3.707 1.00 0.00 H new ATOM 0 HD22 LEU A 19 6.830 -7.105 -3.318 1.00 0.00 H new ATOM 0 HD23 LEU A 19 6.220 -7.165 -4.988 1.00 0.00 H new ATOM 294 N PRO A 20 8.501 -9.727 -6.085 1.00 0.00 N ATOM 295 CA PRO A 20 9.891 -10.043 -6.555 1.00 0.00 C ATOM 296 C PRO A 20 10.750 -10.551 -5.394 1.00 0.00 C ATOM 297 O PRO A 20 11.568 -11.434 -5.560 1.00 0.00 O ATOM 298 CB PRO A 20 10.459 -8.733 -7.101 1.00 0.00 C ATOM 299 CG PRO A 20 9.480 -7.631 -6.741 1.00 0.00 C ATOM 300 CD PRO A 20 8.433 -8.249 -5.823 1.00 0.00 C ATOM 0 HA PRO A 20 9.884 -10.825 -7.314 1.00 0.00 H new ATOM 0 HB2 PRO A 20 11.440 -8.531 -6.671 1.00 0.00 H new ATOM 0 HB3 PRO A 20 10.591 -8.792 -8.181 1.00 0.00 H new ATOM 0 HG2 PRO A 20 9.992 -6.808 -6.243 1.00 0.00 H new ATOM 0 HG3 PRO A 20 9.014 -7.221 -7.637 1.00 0.00 H new ATOM 0 HD2 PRO A 20 8.644 -8.024 -4.778 1.00 0.00 H new ATOM 0 HD3 PRO A 20 7.439 -7.856 -6.039 1.00 0.00 H new ATOM 308 N TRP A 21 10.590 -9.986 -4.228 1.00 0.00 N ATOM 309 CA TRP A 21 11.414 -10.422 -3.066 1.00 0.00 C ATOM 310 C TRP A 21 10.525 -11.049 -1.987 1.00 0.00 C ATOM 311 O TRP A 21 9.471 -10.541 -1.661 1.00 0.00 O ATOM 312 CB TRP A 21 12.122 -9.197 -2.480 1.00 0.00 C ATOM 313 CG TRP A 21 11.102 -8.152 -2.154 1.00 0.00 C ATOM 314 CD1 TRP A 21 10.303 -8.160 -1.062 1.00 0.00 C ATOM 315 CD2 TRP A 21 10.750 -6.956 -2.909 1.00 0.00 C ATOM 316 NE1 TRP A 21 9.477 -7.053 -1.103 1.00 0.00 N ATOM 317 CE2 TRP A 21 9.716 -6.278 -2.219 1.00 0.00 C ATOM 318 CE3 TRP A 21 11.220 -6.399 -4.112 1.00 0.00 C ATOM 319 CZ2 TRP A 21 9.167 -5.091 -2.705 1.00 0.00 C ATOM 320 CZ3 TRP A 21 10.669 -5.203 -4.604 1.00 0.00 C ATOM 321 CH2 TRP A 21 9.645 -4.552 -3.902 1.00 0.00 C ATOM 0 H TRP A 21 9.923 -9.240 -4.030 1.00 0.00 H new ATOM 0 HA TRP A 21 12.141 -11.163 -3.399 1.00 0.00 H new ATOM 0 HB2 TRP A 21 12.675 -9.476 -1.583 1.00 0.00 H new ATOM 0 HB3 TRP A 21 12.847 -8.805 -3.193 1.00 0.00 H new ATOM 0 HD1 TRP A 21 10.310 -8.910 -0.285 1.00 0.00 H new ATOM 0 HE1 TRP A 21 8.776 -6.835 -0.395 1.00 0.00 H new ATOM 0 HE3 TRP A 21 12.008 -6.893 -4.661 1.00 0.00 H new ATOM 0 HZ2 TRP A 21 8.379 -4.593 -2.160 1.00 0.00 H new ATOM 0 HZ3 TRP A 21 11.037 -4.783 -5.529 1.00 0.00 H new ATOM 0 HH2 TRP A 21 9.226 -3.634 -4.286 1.00 0.00 H new ATOM 332 N HIS A 22 10.951 -12.146 -1.422 1.00 0.00 N ATOM 333 CA HIS A 22 10.143 -12.794 -0.352 1.00 0.00 C ATOM 334 C HIS A 22 10.614 -12.255 1.002 1.00 0.00 C ATOM 335 O HIS A 22 11.618 -12.686 1.533 1.00 0.00 O ATOM 336 CB HIS A 22 10.342 -14.310 -0.401 1.00 0.00 C ATOM 337 CG HIS A 22 9.134 -14.992 0.180 1.00 0.00 C ATOM 338 ND1 HIS A 22 7.858 -14.788 -0.321 1.00 0.00 N ATOM 339 CD2 HIS A 22 8.991 -15.874 1.222 1.00 0.00 C ATOM 340 CE1 HIS A 22 7.010 -15.532 0.413 1.00 0.00 C ATOM 341 NE2 HIS A 22 7.649 -16.214 1.367 1.00 0.00 N ATOM 0 H HIS A 22 11.823 -12.621 -1.656 1.00 0.00 H new ATOM 0 HA HIS A 22 9.085 -12.574 -0.496 1.00 0.00 H new ATOM 0 HB2 HIS A 22 10.496 -14.634 -1.430 1.00 0.00 H new ATOM 0 HB3 HIS A 22 11.235 -14.589 0.159 1.00 0.00 H new ATOM 0 HD2 HIS A 22 9.797 -16.247 1.836 1.00 0.00 H new ATOM 0 HE1 HIS A 22 5.943 -15.573 0.250 1.00 0.00 H new ATOM 0 HE2 HIS A 22 7.241 -16.848 2.054 1.00 0.00 H new ATOM 349 N LEU A 23 9.903 -11.309 1.560 1.00 0.00 N ATOM 350 CA LEU A 23 10.320 -10.736 2.874 1.00 0.00 C ATOM 351 C LEU A 23 9.133 -10.753 3.846 1.00 0.00 C ATOM 352 O LEU A 23 8.220 -9.961 3.715 1.00 0.00 O ATOM 353 CB LEU A 23 10.791 -9.291 2.667 1.00 0.00 C ATOM 354 CG LEU A 23 11.308 -8.717 3.990 1.00 0.00 C ATOM 355 CD1 LEU A 23 12.638 -9.377 4.351 1.00 0.00 C ATOM 356 CD2 LEU A 23 11.516 -7.203 3.850 1.00 0.00 C ATOM 0 H LEU A 23 9.053 -10.909 1.163 1.00 0.00 H new ATOM 0 HA LEU A 23 11.132 -11.332 3.290 1.00 0.00 H new ATOM 0 HB2 LEU A 23 11.579 -9.260 1.915 1.00 0.00 H new ATOM 0 HB3 LEU A 23 9.969 -8.681 2.293 1.00 0.00 H new ATOM 0 HG LEU A 23 10.578 -8.914 4.775 1.00 0.00 H new ATOM 0 HD11 LEU A 23 13.004 -8.967 5.292 1.00 0.00 H new ATOM 0 HD12 LEU A 23 12.494 -10.452 4.455 1.00 0.00 H new ATOM 0 HD13 LEU A 23 13.366 -9.183 3.563 1.00 0.00 H new ATOM 0 HD21 LEU A 23 11.884 -6.798 4.793 1.00 0.00 H new ATOM 0 HD22 LEU A 23 12.243 -7.007 3.062 1.00 0.00 H new ATOM 0 HD23 LEU A 23 10.569 -6.728 3.596 1.00 0.00 H new ATOM 368 N PRO A 24 9.182 -11.653 4.799 1.00 0.00 N ATOM 369 CA PRO A 24 8.131 -11.844 5.858 1.00 0.00 C ATOM 370 C PRO A 24 8.125 -10.638 6.802 1.00 0.00 C ATOM 371 O PRO A 24 7.091 -10.224 7.288 1.00 0.00 O ATOM 372 CB PRO A 24 8.488 -13.113 6.627 1.00 0.00 C ATOM 373 CG PRO A 24 9.804 -13.629 6.089 1.00 0.00 C ATOM 374 CD PRO A 24 10.283 -12.657 5.016 1.00 0.00 C ATOM 0 HA PRO A 24 7.140 -11.933 5.414 1.00 0.00 H new ATOM 0 HB2 PRO A 24 8.568 -12.903 7.694 1.00 0.00 H new ATOM 0 HB3 PRO A 24 7.707 -13.864 6.508 1.00 0.00 H new ATOM 0 HG2 PRO A 24 10.540 -13.707 6.890 1.00 0.00 H new ATOM 0 HG3 PRO A 24 9.680 -14.628 5.671 1.00 0.00 H new ATOM 0 HD2 PRO A 24 11.201 -12.159 5.330 1.00 0.00 H new ATOM 0 HD3 PRO A 24 10.508 -13.187 4.090 1.00 0.00 H new ATOM 382 N ASP A 25 9.273 -10.069 7.059 1.00 0.00 N ATOM 383 CA ASP A 25 9.337 -8.887 7.965 1.00 0.00 C ATOM 384 C ASP A 25 8.594 -7.712 7.324 1.00 0.00 C ATOM 385 O ASP A 25 8.063 -6.854 8.004 1.00 0.00 O ATOM 386 CB ASP A 25 10.800 -8.502 8.196 1.00 0.00 C ATOM 387 CG ASP A 25 10.945 -7.840 9.567 1.00 0.00 C ATOM 388 OD1 ASP A 25 10.758 -8.528 10.558 1.00 0.00 O ATOM 389 OD2 ASP A 25 11.240 -6.657 9.604 1.00 0.00 O ATOM 0 H ASP A 25 10.170 -10.373 6.680 1.00 0.00 H new ATOM 0 HA ASP A 25 8.871 -9.133 8.919 1.00 0.00 H new ATOM 0 HB2 ASP A 25 11.433 -9.388 8.140 1.00 0.00 H new ATOM 0 HB3 ASP A 25 11.135 -7.820 7.414 1.00 0.00 H new ATOM 394 N ASP A 26 8.550 -7.667 6.019 1.00 0.00 N ATOM 395 CA ASP A 26 7.840 -6.551 5.335 1.00 0.00 C ATOM 396 C ASP A 26 6.333 -6.793 5.439 1.00 0.00 C ATOM 397 O ASP A 26 5.565 -5.877 5.660 1.00 0.00 O ATOM 398 CB ASP A 26 8.274 -6.494 3.865 1.00 0.00 C ATOM 399 CG ASP A 26 7.378 -5.526 3.084 1.00 0.00 C ATOM 400 OD1 ASP A 26 7.254 -4.382 3.503 1.00 0.00 O ATOM 401 OD2 ASP A 26 6.822 -5.953 2.088 1.00 0.00 O ATOM 0 H ASP A 26 8.976 -8.356 5.398 1.00 0.00 H new ATOM 0 HA ASP A 26 8.086 -5.599 5.806 1.00 0.00 H new ATOM 0 HB2 ASP A 26 9.314 -6.173 3.798 1.00 0.00 H new ATOM 0 HB3 ASP A 26 8.218 -7.489 3.423 1.00 0.00 H new ATOM 406 N LEU A 27 5.903 -8.021 5.293 1.00 0.00 N ATOM 407 CA LEU A 27 4.444 -8.317 5.399 1.00 0.00 C ATOM 408 C LEU A 27 3.939 -7.839 6.761 1.00 0.00 C ATOM 409 O LEU A 27 2.946 -7.144 6.858 1.00 0.00 O ATOM 410 CB LEU A 27 4.215 -9.825 5.273 1.00 0.00 C ATOM 411 CG LEU A 27 4.750 -10.316 3.927 1.00 0.00 C ATOM 412 CD1 LEU A 27 5.007 -11.822 4.000 1.00 0.00 C ATOM 413 CD2 LEU A 27 3.719 -10.028 2.833 1.00 0.00 C ATOM 0 H LEU A 27 6.498 -8.828 5.106 1.00 0.00 H new ATOM 0 HA LEU A 27 3.906 -7.804 4.602 1.00 0.00 H new ATOM 0 HB2 LEU A 27 4.716 -10.348 6.087 1.00 0.00 H new ATOM 0 HB3 LEU A 27 3.152 -10.050 5.357 1.00 0.00 H new ATOM 0 HG LEU A 27 5.681 -9.799 3.695 1.00 0.00 H new ATOM 0 HD11 LEU A 27 5.388 -12.173 3.041 1.00 0.00 H new ATOM 0 HD12 LEU A 27 5.740 -12.029 4.780 1.00 0.00 H new ATOM 0 HD13 LEU A 27 4.076 -12.339 4.231 1.00 0.00 H new ATOM 0 HD21 LEU A 27 4.100 -10.378 1.873 1.00 0.00 H new ATOM 0 HD22 LEU A 27 2.788 -10.546 3.065 1.00 0.00 H new ATOM 0 HD23 LEU A 27 3.534 -8.955 2.781 1.00 0.00 H new ATOM 425 N HIS A 28 4.627 -8.195 7.816 1.00 0.00 N ATOM 426 CA HIS A 28 4.201 -7.753 9.175 1.00 0.00 C ATOM 427 C HIS A 28 4.093 -6.227 9.193 1.00 0.00 C ATOM 428 O HIS A 28 3.205 -5.663 9.801 1.00 0.00 O ATOM 429 CB HIS A 28 5.238 -8.202 10.207 1.00 0.00 C ATOM 430 CG HIS A 28 5.288 -9.704 10.253 1.00 0.00 C ATOM 431 ND1 HIS A 28 4.156 -10.475 10.464 1.00 0.00 N ATOM 432 CD2 HIS A 28 6.326 -10.592 10.118 1.00 0.00 C ATOM 433 CE1 HIS A 28 4.536 -11.766 10.450 1.00 0.00 C ATOM 434 NE2 HIS A 28 5.849 -11.894 10.243 1.00 0.00 N ATOM 0 H HIS A 28 5.467 -8.774 7.793 1.00 0.00 H new ATOM 0 HA HIS A 28 3.235 -8.194 9.419 1.00 0.00 H new ATOM 0 HB2 HIS A 28 6.219 -7.803 9.948 1.00 0.00 H new ATOM 0 HB3 HIS A 28 4.982 -7.807 11.190 1.00 0.00 H new ATOM 0 HD2 HIS A 28 7.357 -10.322 9.942 1.00 0.00 H new ATOM 0 HE1 HIS A 28 3.861 -12.597 10.589 1.00 0.00 H new ATOM 0 HE2 HIS A 28 6.387 -12.759 10.188 1.00 0.00 H new ATOM 442 N TYR A 29 4.988 -5.559 8.514 1.00 0.00 N ATOM 443 CA TYR A 29 4.936 -4.070 8.471 1.00 0.00 C ATOM 444 C TYR A 29 3.648 -3.630 7.771 1.00 0.00 C ATOM 445 O TYR A 29 3.033 -2.647 8.135 1.00 0.00 O ATOM 446 CB TYR A 29 6.145 -3.542 7.696 1.00 0.00 C ATOM 447 CG TYR A 29 6.308 -2.066 7.963 1.00 0.00 C ATOM 448 CD1 TYR A 29 6.794 -1.628 9.200 1.00 0.00 C ATOM 449 CD2 TYR A 29 5.974 -1.136 6.972 1.00 0.00 C ATOM 450 CE1 TYR A 29 6.945 -0.258 9.447 1.00 0.00 C ATOM 451 CE2 TYR A 29 6.126 0.233 7.219 1.00 0.00 C ATOM 452 CZ TYR A 29 6.611 0.673 8.457 1.00 0.00 C ATOM 453 OH TYR A 29 6.760 2.023 8.702 1.00 0.00 O ATOM 0 H TYR A 29 5.753 -5.981 7.987 1.00 0.00 H new ATOM 0 HA TYR A 29 4.954 -3.672 9.486 1.00 0.00 H new ATOM 0 HB2 TYR A 29 7.045 -4.078 7.996 1.00 0.00 H new ATOM 0 HB3 TYR A 29 6.011 -3.717 6.629 1.00 0.00 H new ATOM 0 HD1 TYR A 29 7.053 -2.346 9.964 1.00 0.00 H new ATOM 0 HD2 TYR A 29 5.599 -1.475 6.017 1.00 0.00 H new ATOM 0 HE1 TYR A 29 7.319 0.080 10.402 1.00 0.00 H new ATOM 0 HE2 TYR A 29 5.869 0.951 6.454 1.00 0.00 H new ATOM 0 HH TYR A 29 5.882 2.458 8.684 1.00 0.00 H new ATOM 463 N PHE A 30 3.240 -4.357 6.764 1.00 0.00 N ATOM 464 CA PHE A 30 1.994 -3.996 6.028 1.00 0.00 C ATOM 465 C PHE A 30 0.791 -4.142 6.962 1.00 0.00 C ATOM 466 O PHE A 30 -0.055 -3.273 7.042 1.00 0.00 O ATOM 467 CB PHE A 30 1.827 -4.931 4.826 1.00 0.00 C ATOM 468 CG PHE A 30 0.603 -4.533 4.033 1.00 0.00 C ATOM 469 CD1 PHE A 30 0.481 -3.232 3.532 1.00 0.00 C ATOM 470 CD2 PHE A 30 -0.409 -5.471 3.797 1.00 0.00 C ATOM 471 CE1 PHE A 30 -0.653 -2.868 2.795 1.00 0.00 C ATOM 472 CE2 PHE A 30 -1.543 -5.109 3.060 1.00 0.00 C ATOM 473 CZ PHE A 30 -1.666 -3.807 2.559 1.00 0.00 C ATOM 0 H PHE A 30 3.719 -5.189 6.419 1.00 0.00 H new ATOM 0 HA PHE A 30 2.059 -2.965 5.681 1.00 0.00 H new ATOM 0 HB2 PHE A 30 2.713 -4.885 4.192 1.00 0.00 H new ATOM 0 HB3 PHE A 30 1.732 -5.962 5.166 1.00 0.00 H new ATOM 0 HD1 PHE A 30 1.262 -2.508 3.714 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -0.315 -6.475 4.184 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -0.747 -1.864 2.409 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -2.323 -5.834 2.878 1.00 0.00 H new ATOM 0 HZ PHE A 30 -2.541 -3.527 1.991 1.00 0.00 H new ATOM 483 N ARG A 31 0.713 -5.234 7.672 1.00 0.00 N ATOM 484 CA ARG A 31 -0.430 -5.444 8.605 1.00 0.00 C ATOM 485 C ARG A 31 -0.377 -4.400 9.723 1.00 0.00 C ATOM 486 O ARG A 31 -1.286 -3.612 9.894 1.00 0.00 O ATOM 487 CB ARG A 31 -0.330 -6.845 9.211 1.00 0.00 C ATOM 488 CG ARG A 31 -1.670 -7.239 9.836 1.00 0.00 C ATOM 489 CD ARG A 31 -1.529 -8.602 10.517 1.00 0.00 C ATOM 490 NE ARG A 31 -1.078 -8.409 11.927 1.00 0.00 N ATOM 491 CZ ARG A 31 -0.378 -9.332 12.545 1.00 0.00 C ATOM 492 NH1 ARG A 31 -0.072 -10.457 11.948 1.00 0.00 N ATOM 493 NH2 ARG A 31 0.008 -9.131 13.775 1.00 0.00 N ATOM 0 H ARG A 31 1.394 -5.993 7.646 1.00 0.00 H new ATOM 0 HA ARG A 31 -1.370 -5.343 8.062 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -0.052 -7.565 8.441 1.00 0.00 H new ATOM 0 HB3 ARG A 31 0.455 -6.868 9.967 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -1.981 -6.487 10.562 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -2.444 -7.281 9.069 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -2.482 -9.130 10.498 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -0.812 -9.219 9.976 1.00 0.00 H new ATOM 0 HE ARG A 31 -1.317 -7.547 12.418 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -0.378 -10.626 10.990 1.00 0.00 H new ATOM 0 HH12 ARG A 31 0.473 -11.164 12.441 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -0.234 -8.261 14.250 1.00 0.00 H new ATOM 0 HH22 ARG A 31 0.552 -9.843 14.262 1.00 0.00 H new ATOM 507 N ALA A 32 0.681 -4.401 10.488 1.00 0.00 N ATOM 508 CA ALA A 32 0.812 -3.427 11.614 1.00 0.00 C ATOM 509 C ALA A 32 0.523 -1.997 11.135 1.00 0.00 C ATOM 510 O ALA A 32 -0.093 -1.217 11.833 1.00 0.00 O ATOM 511 CB ALA A 32 2.234 -3.497 12.177 1.00 0.00 C ATOM 0 H ALA A 32 1.468 -5.040 10.381 1.00 0.00 H new ATOM 0 HA ALA A 32 0.089 -3.686 12.387 1.00 0.00 H new ATOM 0 HB1 ALA A 32 2.335 -2.788 12.999 1.00 0.00 H new ATOM 0 HB2 ALA A 32 2.432 -4.505 12.541 1.00 0.00 H new ATOM 0 HB3 ALA A 32 2.949 -3.247 11.393 1.00 0.00 H new ATOM 517 N GLN A 33 0.979 -1.638 9.965 1.00 0.00 N ATOM 518 CA GLN A 33 0.743 -0.250 9.465 1.00 0.00 C ATOM 519 C GLN A 33 -0.733 -0.051 9.096 1.00 0.00 C ATOM 520 O GLN A 33 -1.197 1.065 8.964 1.00 0.00 O ATOM 521 CB GLN A 33 1.611 -0.004 8.229 1.00 0.00 C ATOM 522 CG GLN A 33 3.067 0.199 8.656 1.00 0.00 C ATOM 523 CD GLN A 33 3.398 1.693 8.659 1.00 0.00 C ATOM 524 OE1 GLN A 33 4.345 2.118 8.027 1.00 0.00 O ATOM 525 NE2 GLN A 33 2.655 2.513 9.350 1.00 0.00 N ATOM 0 H GLN A 33 1.504 -2.244 9.334 1.00 0.00 H new ATOM 0 HA GLN A 33 1.005 0.456 10.254 1.00 0.00 H new ATOM 0 HB2 GLN A 33 1.536 -0.850 7.546 1.00 0.00 H new ATOM 0 HB3 GLN A 33 1.254 0.874 7.690 1.00 0.00 H new ATOM 0 HG2 GLN A 33 3.227 -0.221 9.649 1.00 0.00 H new ATOM 0 HG3 GLN A 33 3.733 -0.330 7.975 1.00 0.00 H new ATOM 0 HE21 GLN A 33 1.860 2.157 9.881 1.00 0.00 H new ATOM 0 HE22 GLN A 33 2.869 3.510 9.360 1.00 0.00 H new ATOM 534 N THR A 34 -1.472 -1.113 8.911 1.00 0.00 N ATOM 535 CA THR A 34 -2.909 -0.957 8.534 1.00 0.00 C ATOM 536 C THR A 34 -3.817 -1.544 9.618 1.00 0.00 C ATOM 537 O THR A 34 -4.904 -2.009 9.337 1.00 0.00 O ATOM 538 CB THR A 34 -3.173 -1.674 7.205 1.00 0.00 C ATOM 539 OG1 THR A 34 -2.729 -3.025 7.282 1.00 0.00 O ATOM 540 CG2 THR A 34 -2.427 -0.953 6.082 1.00 0.00 C ATOM 0 H THR A 34 -1.147 -2.075 9.004 1.00 0.00 H new ATOM 0 HA THR A 34 -3.128 0.106 8.430 1.00 0.00 H new ATOM 0 HB THR A 34 -4.243 -1.664 7.000 1.00 0.00 H new ATOM 0 HG1 THR A 34 -1.768 -3.065 7.093 1.00 0.00 H new ATOM 0 HG21 THR A 34 -2.614 -1.462 5.136 1.00 0.00 H new ATOM 0 HG22 THR A 34 -2.777 0.077 6.015 1.00 0.00 H new ATOM 0 HG23 THR A 34 -1.358 -0.960 6.293 1.00 0.00 H new ATOM 548 N VAL A 35 -3.395 -1.513 10.854 1.00 0.00 N ATOM 549 CA VAL A 35 -4.255 -2.061 11.944 1.00 0.00 C ATOM 550 C VAL A 35 -5.330 -1.035 12.311 1.00 0.00 C ATOM 551 O VAL A 35 -5.036 0.027 12.824 1.00 0.00 O ATOM 552 CB VAL A 35 -3.405 -2.362 13.182 1.00 0.00 C ATOM 553 CG1 VAL A 35 -2.471 -3.537 12.891 1.00 0.00 C ATOM 554 CG2 VAL A 35 -2.579 -1.126 13.555 1.00 0.00 C ATOM 0 H VAL A 35 -2.497 -1.134 11.155 1.00 0.00 H new ATOM 0 HA VAL A 35 -4.724 -2.981 11.596 1.00 0.00 H new ATOM 0 HB VAL A 35 -4.060 -2.620 14.014 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -1.867 -3.749 13.773 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -3.062 -4.417 12.635 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -1.817 -3.284 12.056 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -1.976 -1.344 14.436 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -1.925 -0.861 12.724 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -3.248 -0.293 13.770 1.00 0.00 H new ATOM 564 N GLY A 36 -6.574 -1.348 12.062 1.00 0.00 N ATOM 565 CA GLY A 36 -7.670 -0.397 12.408 1.00 0.00 C ATOM 566 C GLY A 36 -7.763 0.720 11.362 1.00 0.00 C ATOM 567 O GLY A 36 -8.409 1.724 11.583 1.00 0.00 O ATOM 0 H GLY A 36 -6.878 -2.222 11.634 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -8.619 -0.931 12.463 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -7.488 0.033 13.393 1.00 0.00 H new ATOM 571 N LYS A 37 -7.121 0.564 10.232 1.00 0.00 N ATOM 572 CA LYS A 37 -7.180 1.632 9.188 1.00 0.00 C ATOM 573 C LYS A 37 -7.848 1.084 7.922 1.00 0.00 C ATOM 574 O LYS A 37 -7.930 -0.112 7.722 1.00 0.00 O ATOM 575 CB LYS A 37 -5.760 2.093 8.856 1.00 0.00 C ATOM 576 CG LYS A 37 -5.273 3.059 9.939 1.00 0.00 C ATOM 577 CD LYS A 37 -3.776 3.328 9.753 1.00 0.00 C ATOM 578 CE LYS A 37 -3.526 4.837 9.714 1.00 0.00 C ATOM 579 NZ LYS A 37 -2.215 5.141 10.354 1.00 0.00 N ATOM 0 H LYS A 37 -6.561 -0.253 9.988 1.00 0.00 H new ATOM 0 HA LYS A 37 -7.761 2.474 9.564 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -5.092 1.234 8.793 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -5.743 2.582 7.882 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -5.830 3.994 9.884 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -5.457 2.636 10.927 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -3.211 2.877 10.569 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -3.426 2.867 8.829 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -3.530 5.190 8.683 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -4.327 5.363 10.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -2.045 6.167 10.327 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -2.228 4.818 11.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -1.456 4.651 9.839 1.00 0.00 H new ATOM 593 N ILE A 38 -8.331 1.951 7.065 1.00 0.00 N ATOM 594 CA ILE A 38 -8.993 1.479 5.814 1.00 0.00 C ATOM 595 C ILE A 38 -7.925 1.083 4.791 1.00 0.00 C ATOM 596 O ILE A 38 -7.076 1.874 4.435 1.00 0.00 O ATOM 597 CB ILE A 38 -9.851 2.601 5.227 1.00 0.00 C ATOM 598 CG1 ILE A 38 -10.796 3.148 6.299 1.00 0.00 C ATOM 599 CG2 ILE A 38 -10.673 2.047 4.065 1.00 0.00 C ATOM 600 CD1 ILE A 38 -11.587 4.326 5.727 1.00 0.00 C ATOM 0 H ILE A 38 -8.294 2.964 7.180 1.00 0.00 H new ATOM 0 HA ILE A 38 -9.623 0.620 6.046 1.00 0.00 H new ATOM 0 HB ILE A 38 -9.204 3.405 4.875 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -11.478 2.365 6.632 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -10.227 3.468 7.172 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -11.287 2.842 3.642 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -10.003 1.659 3.298 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -11.316 1.244 4.425 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -12.261 4.717 6.490 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -10.897 5.111 5.416 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -12.167 3.991 4.867 1.00 0.00 H new ATOM 612 N MET A 39 -7.957 -0.135 4.319 1.00 0.00 N ATOM 613 CA MET A 39 -6.939 -0.581 3.323 1.00 0.00 C ATOM 614 C MET A 39 -7.544 -0.549 1.915 1.00 0.00 C ATOM 615 O MET A 39 -8.348 -1.388 1.560 1.00 0.00 O ATOM 616 CB MET A 39 -6.500 -2.008 3.657 1.00 0.00 C ATOM 617 CG MET A 39 -5.248 -2.361 2.854 1.00 0.00 C ATOM 618 SD MET A 39 -4.974 -4.149 2.919 1.00 0.00 S ATOM 619 CE MET A 39 -6.364 -4.628 1.864 1.00 0.00 C ATOM 0 H MET A 39 -8.645 -0.841 4.580 1.00 0.00 H new ATOM 0 HA MET A 39 -6.078 0.087 3.359 1.00 0.00 H new ATOM 0 HB2 MET A 39 -6.297 -2.096 4.724 1.00 0.00 H new ATOM 0 HB3 MET A 39 -7.302 -2.709 3.426 1.00 0.00 H new ATOM 0 HG2 MET A 39 -5.363 -2.037 1.820 1.00 0.00 H new ATOM 0 HG3 MET A 39 -4.383 -1.835 3.258 1.00 0.00 H new ATOM 0 HE1 MET A 39 -7.059 -5.244 2.435 1.00 0.00 H new ATOM 0 HE2 MET A 39 -6.878 -3.734 1.511 1.00 0.00 H new ATOM 0 HE3 MET A 39 -5.994 -5.195 1.010 1.00 0.00 H new ATOM 629 N VAL A 40 -7.170 0.415 1.112 1.00 0.00 N ATOM 630 CA VAL A 40 -7.734 0.500 -0.269 1.00 0.00 C ATOM 631 C VAL A 40 -6.845 -0.275 -1.246 1.00 0.00 C ATOM 632 O VAL A 40 -5.683 0.043 -1.443 1.00 0.00 O ATOM 633 CB VAL A 40 -7.805 1.966 -0.703 1.00 0.00 C ATOM 634 CG1 VAL A 40 -8.565 2.068 -2.027 1.00 0.00 C ATOM 635 CG2 VAL A 40 -8.534 2.782 0.367 1.00 0.00 C ATOM 0 H VAL A 40 -6.500 1.145 1.353 1.00 0.00 H new ATOM 0 HA VAL A 40 -8.734 0.067 -0.272 1.00 0.00 H new ATOM 0 HB VAL A 40 -6.795 2.356 -0.831 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -8.616 3.112 -2.338 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -8.046 1.488 -2.790 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -9.574 1.678 -1.898 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -8.584 3.826 0.057 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -9.544 2.393 0.496 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -7.994 2.709 1.311 1.00 0.00 H new ATOM 645 N VAL A 41 -7.389 -1.294 -1.859 1.00 0.00 N ATOM 646 CA VAL A 41 -6.595 -2.105 -2.825 1.00 0.00 C ATOM 647 C VAL A 41 -7.254 -2.068 -4.207 1.00 0.00 C ATOM 648 O VAL A 41 -8.294 -1.468 -4.403 1.00 0.00 O ATOM 649 CB VAL A 41 -6.533 -3.559 -2.349 1.00 0.00 C ATOM 650 CG1 VAL A 41 -5.498 -3.694 -1.232 1.00 0.00 C ATOM 651 CG2 VAL A 41 -7.908 -3.985 -1.828 1.00 0.00 C ATOM 0 H VAL A 41 -8.354 -1.599 -1.730 1.00 0.00 H new ATOM 0 HA VAL A 41 -5.589 -1.689 -2.887 1.00 0.00 H new ATOM 0 HB VAL A 41 -6.246 -4.199 -3.183 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -5.458 -4.730 -0.897 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -4.519 -3.395 -1.605 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -5.779 -3.053 -0.396 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -7.864 -5.020 -1.489 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -8.197 -3.343 -0.996 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -8.644 -3.896 -2.627 1.00 0.00 H new ATOM 661 N GLY A 42 -6.668 -2.748 -5.153 1.00 0.00 N ATOM 662 CA GLY A 42 -7.254 -2.800 -6.525 1.00 0.00 C ATOM 663 C GLY A 42 -7.831 -4.198 -6.772 1.00 0.00 C ATOM 664 O GLY A 42 -7.254 -5.193 -6.377 1.00 0.00 O ATOM 0 H GLY A 42 -5.802 -3.274 -5.035 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -8.035 -2.047 -6.629 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -6.491 -2.572 -7.269 1.00 0.00 H new ATOM 668 N ARG A 43 -8.978 -4.281 -7.402 1.00 0.00 N ATOM 669 CA ARG A 43 -9.621 -5.610 -7.661 1.00 0.00 C ATOM 670 C ARG A 43 -8.600 -6.628 -8.182 1.00 0.00 C ATOM 671 O ARG A 43 -8.762 -7.820 -8.007 1.00 0.00 O ATOM 672 CB ARG A 43 -10.730 -5.436 -8.702 1.00 0.00 C ATOM 673 CG ARG A 43 -11.550 -6.727 -8.802 1.00 0.00 C ATOM 674 CD ARG A 43 -11.182 -7.473 -10.086 1.00 0.00 C ATOM 675 NE ARG A 43 -11.501 -6.619 -11.268 1.00 0.00 N ATOM 676 CZ ARG A 43 -11.315 -7.067 -12.487 1.00 0.00 C ATOM 677 NH1 ARG A 43 -10.853 -8.274 -12.692 1.00 0.00 N ATOM 678 NH2 ARG A 43 -11.596 -6.303 -13.508 1.00 0.00 N ATOM 0 H ARG A 43 -9.501 -3.478 -7.751 1.00 0.00 H new ATOM 0 HA ARG A 43 -10.032 -5.983 -6.723 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -11.376 -4.604 -8.424 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -10.297 -5.193 -9.672 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -11.358 -7.359 -7.935 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -12.615 -6.494 -8.798 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -10.121 -7.725 -10.082 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -11.732 -8.412 -10.144 1.00 0.00 H new ATOM 0 HE ARG A 43 -11.867 -5.678 -11.127 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -10.633 -8.877 -11.900 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -10.713 -8.611 -13.644 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -11.959 -5.362 -13.356 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -11.453 -6.647 -14.457 1.00 0.00 H new ATOM 692 N ARG A 44 -7.551 -6.176 -8.812 1.00 0.00 N ATOM 693 CA ARG A 44 -6.528 -7.129 -9.329 1.00 0.00 C ATOM 694 C ARG A 44 -5.604 -7.553 -8.184 1.00 0.00 C ATOM 695 O ARG A 44 -5.273 -8.715 -8.036 1.00 0.00 O ATOM 696 CB ARG A 44 -5.715 -6.446 -10.427 1.00 0.00 C ATOM 697 CG ARG A 44 -6.392 -6.667 -11.783 1.00 0.00 C ATOM 698 CD ARG A 44 -5.617 -7.719 -12.579 1.00 0.00 C ATOM 699 NE ARG A 44 -4.633 -7.040 -13.472 1.00 0.00 N ATOM 700 CZ ARG A 44 -3.644 -7.711 -14.013 1.00 0.00 C ATOM 701 NH1 ARG A 44 -3.500 -8.992 -13.785 1.00 0.00 N ATOM 702 NH2 ARG A 44 -2.794 -7.094 -14.788 1.00 0.00 N ATOM 0 H ARG A 44 -7.358 -5.191 -8.991 1.00 0.00 H new ATOM 0 HA ARG A 44 -7.018 -8.012 -9.739 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -5.632 -5.379 -10.221 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -4.702 -6.847 -10.446 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -7.422 -6.993 -11.638 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -6.429 -5.730 -12.339 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -5.101 -8.397 -11.900 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -6.305 -8.323 -13.171 1.00 0.00 H new ATOM 0 HE ARG A 44 -4.730 -6.043 -13.664 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -4.161 -9.480 -13.181 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -2.727 -9.502 -14.212 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -2.901 -6.096 -14.970 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -2.023 -7.610 -15.212 1.00 0.00 H new ATOM 716 N THR A 45 -5.193 -6.621 -7.363 1.00 0.00 N ATOM 717 CA THR A 45 -4.298 -6.974 -6.222 1.00 0.00 C ATOM 718 C THR A 45 -5.086 -7.788 -5.193 1.00 0.00 C ATOM 719 O THR A 45 -4.687 -8.871 -4.810 1.00 0.00 O ATOM 720 CB THR A 45 -3.777 -5.696 -5.560 1.00 0.00 C ATOM 721 OG1 THR A 45 -3.250 -4.829 -6.553 1.00 0.00 O ATOM 722 CG2 THR A 45 -2.678 -6.050 -4.556 1.00 0.00 C ATOM 0 H THR A 45 -5.438 -5.633 -7.434 1.00 0.00 H new ATOM 0 HA THR A 45 -3.457 -7.560 -6.592 1.00 0.00 H new ATOM 0 HB THR A 45 -4.596 -5.198 -5.040 1.00 0.00 H new ATOM 0 HG1 THR A 45 -3.976 -4.513 -7.130 1.00 0.00 H new ATOM 0 HG21 THR A 45 -2.308 -5.139 -4.085 1.00 0.00 H new ATOM 0 HG22 THR A 45 -3.083 -6.714 -3.792 1.00 0.00 H new ATOM 0 HG23 THR A 45 -1.859 -6.549 -5.074 1.00 0.00 H new ATOM 730 N TYR A 46 -6.202 -7.275 -4.742 1.00 0.00 N ATOM 731 CA TYR A 46 -7.023 -8.018 -3.737 1.00 0.00 C ATOM 732 C TYR A 46 -7.289 -9.440 -4.241 1.00 0.00 C ATOM 733 O TYR A 46 -7.246 -10.394 -3.488 1.00 0.00 O ATOM 734 CB TYR A 46 -8.354 -7.291 -3.530 1.00 0.00 C ATOM 735 CG TYR A 46 -9.062 -7.856 -2.320 1.00 0.00 C ATOM 736 CD1 TYR A 46 -8.687 -7.450 -1.034 1.00 0.00 C ATOM 737 CD2 TYR A 46 -10.098 -8.783 -2.485 1.00 0.00 C ATOM 738 CE1 TYR A 46 -9.347 -7.970 0.085 1.00 0.00 C ATOM 739 CE2 TYR A 46 -10.758 -9.302 -1.366 1.00 0.00 C ATOM 740 CZ TYR A 46 -10.383 -8.895 -0.081 1.00 0.00 C ATOM 741 OH TYR A 46 -11.034 -9.407 1.023 1.00 0.00 O ATOM 0 H TYR A 46 -6.581 -6.372 -5.027 1.00 0.00 H new ATOM 0 HA TYR A 46 -6.483 -8.066 -2.791 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -8.179 -6.224 -3.395 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -8.981 -7.402 -4.415 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -7.888 -6.735 -0.905 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -10.388 -9.098 -3.477 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -9.056 -7.657 1.077 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -11.557 -10.017 -1.494 1.00 0.00 H new ATOM 0 HH TYR A 46 -11.728 -10.035 0.732 1.00 0.00 H new ATOM 751 N GLU A 47 -7.556 -9.589 -5.512 1.00 0.00 N ATOM 752 CA GLU A 47 -7.817 -10.949 -6.068 1.00 0.00 C ATOM 753 C GLU A 47 -6.501 -11.730 -6.158 1.00 0.00 C ATOM 754 O GLU A 47 -6.496 -12.936 -6.312 1.00 0.00 O ATOM 755 CB GLU A 47 -8.430 -10.820 -7.464 1.00 0.00 C ATOM 756 CG GLU A 47 -9.952 -10.722 -7.347 1.00 0.00 C ATOM 757 CD GLU A 47 -10.598 -11.234 -8.637 1.00 0.00 C ATOM 758 OE1 GLU A 47 -10.547 -12.431 -8.867 1.00 0.00 O ATOM 759 OE2 GLU A 47 -11.133 -10.419 -9.371 1.00 0.00 O ATOM 0 H GLU A 47 -7.605 -8.828 -6.189 1.00 0.00 H new ATOM 0 HA GLU A 47 -8.508 -11.480 -5.414 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -8.036 -9.936 -7.965 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -8.156 -11.681 -8.074 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -10.300 -11.308 -6.496 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -10.248 -9.689 -7.165 1.00 0.00 H new ATOM 766 N SER A 48 -5.385 -11.054 -6.060 1.00 0.00 N ATOM 767 CA SER A 48 -4.072 -11.758 -6.134 1.00 0.00 C ATOM 768 C SER A 48 -3.531 -11.998 -4.718 1.00 0.00 C ATOM 769 O SER A 48 -2.682 -12.843 -4.509 1.00 0.00 O ATOM 770 CB SER A 48 -3.080 -10.903 -6.923 1.00 0.00 C ATOM 771 OG SER A 48 -1.995 -11.717 -7.349 1.00 0.00 O ATOM 0 H SER A 48 -5.328 -10.044 -5.932 1.00 0.00 H new ATOM 0 HA SER A 48 -4.205 -12.717 -6.634 1.00 0.00 H new ATOM 0 HB2 SER A 48 -3.574 -10.454 -7.785 1.00 0.00 H new ATOM 0 HB3 SER A 48 -2.714 -10.084 -6.303 1.00 0.00 H new ATOM 0 HG SER A 48 -1.186 -11.470 -6.854 1.00 0.00 H new ATOM 777 N PHE A 49 -4.009 -11.258 -3.746 1.00 0.00 N ATOM 778 CA PHE A 49 -3.522 -11.437 -2.339 1.00 0.00 C ATOM 779 C PHE A 49 -3.529 -12.929 -1.968 1.00 0.00 C ATOM 780 O PHE A 49 -4.153 -13.728 -2.639 1.00 0.00 O ATOM 781 CB PHE A 49 -4.459 -10.691 -1.383 1.00 0.00 C ATOM 782 CG PHE A 49 -3.815 -9.415 -0.889 1.00 0.00 C ATOM 783 CD1 PHE A 49 -3.860 -8.256 -1.670 1.00 0.00 C ATOM 784 CD2 PHE A 49 -3.191 -9.390 0.363 1.00 0.00 C ATOM 785 CE1 PHE A 49 -3.278 -7.073 -1.198 1.00 0.00 C ATOM 786 CE2 PHE A 49 -2.608 -8.211 0.832 1.00 0.00 C ATOM 787 CZ PHE A 49 -2.651 -7.051 0.052 1.00 0.00 C ATOM 0 H PHE A 49 -4.718 -10.535 -3.866 1.00 0.00 H new ATOM 0 HA PHE A 49 -2.508 -11.044 -2.260 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -5.395 -10.459 -1.891 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -4.707 -11.331 -0.536 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -4.343 -8.273 -2.636 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -3.160 -10.284 0.968 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -3.313 -6.177 -1.800 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -2.124 -8.195 1.797 1.00 0.00 H new ATOM 0 HZ PHE A 49 -2.200 -6.139 0.415 1.00 0.00 H new ATOM 797 N PRO A 50 -2.838 -13.258 -0.902 1.00 0.00 N ATOM 798 CA PRO A 50 -2.698 -14.640 -0.336 1.00 0.00 C ATOM 799 C PRO A 50 -3.869 -14.952 0.604 1.00 0.00 C ATOM 800 O PRO A 50 -4.581 -15.920 0.420 1.00 0.00 O ATOM 801 CB PRO A 50 -1.387 -14.644 0.445 1.00 0.00 C ATOM 802 CG PRO A 50 -0.979 -13.196 0.641 1.00 0.00 C ATOM 803 CD PRO A 50 -2.041 -12.332 -0.031 1.00 0.00 C ATOM 0 HA PRO A 50 -2.700 -15.394 -1.123 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -1.513 -15.142 1.406 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -0.617 -15.191 -0.099 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -0.904 -12.958 1.702 1.00 0.00 H new ATOM 0 HG3 PRO A 50 0.002 -13.010 0.203 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -2.678 -11.849 0.710 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -1.582 -11.539 -0.622 1.00 0.00 H new ATOM 811 N LYS A 51 -4.071 -14.144 1.616 1.00 0.00 N ATOM 812 CA LYS A 51 -5.190 -14.406 2.568 1.00 0.00 C ATOM 813 C LYS A 51 -6.076 -13.162 2.685 1.00 0.00 C ATOM 814 O LYS A 51 -5.756 -12.227 3.393 1.00 0.00 O ATOM 815 CB LYS A 51 -4.613 -14.749 3.945 1.00 0.00 C ATOM 816 CG LYS A 51 -4.940 -16.203 4.292 1.00 0.00 C ATOM 817 CD LYS A 51 -4.966 -16.369 5.813 1.00 0.00 C ATOM 818 CE LYS A 51 -5.741 -17.638 6.180 1.00 0.00 C ATOM 819 NZ LYS A 51 -6.920 -17.277 7.016 1.00 0.00 N ATOM 0 H LYS A 51 -3.510 -13.317 1.822 1.00 0.00 H new ATOM 0 HA LYS A 51 -5.788 -15.240 2.200 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -3.533 -14.599 3.946 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -5.028 -14.082 4.701 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -5.905 -16.481 3.868 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -4.196 -16.869 3.855 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -3.949 -16.428 6.200 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -5.433 -15.499 6.276 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -6.067 -18.152 5.276 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -5.094 -18.327 6.723 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -7.446 -18.139 7.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -6.598 -16.805 7.885 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -7.540 -16.635 6.483 1.00 0.00 H new ATOM 833 N ARG A 52 -7.188 -13.146 2.001 1.00 0.00 N ATOM 834 CA ARG A 52 -8.092 -11.963 2.078 1.00 0.00 C ATOM 835 C ARG A 52 -9.423 -12.372 2.720 1.00 0.00 C ATOM 836 O ARG A 52 -9.924 -13.449 2.465 1.00 0.00 O ATOM 837 CB ARG A 52 -8.362 -11.424 0.671 1.00 0.00 C ATOM 838 CG ARG A 52 -7.059 -11.381 -0.126 1.00 0.00 C ATOM 839 CD ARG A 52 -6.980 -12.599 -1.049 1.00 0.00 C ATOM 840 NE ARG A 52 -8.102 -12.553 -2.032 1.00 0.00 N ATOM 841 CZ ARG A 52 -8.213 -13.470 -2.962 1.00 0.00 C ATOM 842 NH1 ARG A 52 -7.343 -14.444 -3.048 1.00 0.00 N ATOM 843 NH2 ARG A 52 -9.203 -13.412 -3.811 1.00 0.00 N ATOM 0 H ARG A 52 -7.509 -13.900 1.393 1.00 0.00 H new ATOM 0 HA ARG A 52 -7.614 -11.190 2.680 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -9.089 -12.057 0.163 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -8.795 -10.426 0.731 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -7.010 -10.464 -0.713 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -6.206 -11.371 0.553 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -6.024 -12.610 -1.573 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -7.033 -13.517 -0.463 1.00 0.00 H new ATOM 0 HE ARG A 52 -8.789 -11.801 -1.980 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -6.568 -14.495 -2.387 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -7.440 -15.152 -3.776 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -9.885 -12.656 -3.748 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -9.295 -14.123 -4.537 1.00 0.00 H new ATOM 857 N PRO A 53 -9.965 -11.491 3.525 1.00 0.00 N ATOM 858 CA PRO A 53 -9.409 -10.144 3.890 1.00 0.00 C ATOM 859 C PRO A 53 -8.472 -10.273 5.097 1.00 0.00 C ATOM 860 O PRO A 53 -8.296 -11.342 5.647 1.00 0.00 O ATOM 861 CB PRO A 53 -10.615 -9.284 4.255 1.00 0.00 C ATOM 862 CG PRO A 53 -11.773 -10.230 4.519 1.00 0.00 C ATOM 863 CD PRO A 53 -11.274 -11.647 4.241 1.00 0.00 C ATOM 0 HA PRO A 53 -8.835 -9.709 3.072 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -10.404 -8.678 5.136 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -10.857 -8.596 3.445 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -12.117 -10.139 5.549 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -12.621 -9.988 3.878 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -11.147 -12.205 5.169 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -11.989 -12.200 3.631 1.00 0.00 H new ATOM 871 N LEU A 54 -7.878 -9.187 5.515 1.00 0.00 N ATOM 872 CA LEU A 54 -6.961 -9.241 6.691 1.00 0.00 C ATOM 873 C LEU A 54 -7.790 -9.358 7.977 1.00 0.00 C ATOM 874 O LEU A 54 -8.907 -8.882 8.034 1.00 0.00 O ATOM 875 CB LEU A 54 -6.117 -7.967 6.741 1.00 0.00 C ATOM 876 CG LEU A 54 -5.120 -7.973 5.582 1.00 0.00 C ATOM 877 CD1 LEU A 54 -4.829 -6.533 5.153 1.00 0.00 C ATOM 878 CD2 LEU A 54 -3.818 -8.650 6.027 1.00 0.00 C ATOM 0 H LEU A 54 -7.988 -8.265 5.093 1.00 0.00 H new ATOM 0 HA LEU A 54 -6.304 -10.106 6.601 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -6.760 -7.089 6.678 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -5.587 -7.906 7.691 1.00 0.00 H new ATOM 0 HG LEU A 54 -5.543 -8.524 4.742 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -4.118 -6.536 4.327 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -5.755 -6.054 4.834 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -4.407 -5.981 5.993 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -3.108 -8.653 5.200 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -3.392 -8.103 6.868 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -4.027 -9.676 6.330 1.00 0.00 H new ATOM 890 N PRO A 55 -7.218 -9.989 8.976 1.00 0.00 N ATOM 891 CA PRO A 55 -7.838 -10.224 10.326 1.00 0.00 C ATOM 892 C PRO A 55 -7.791 -8.941 11.161 1.00 0.00 C ATOM 893 O PRO A 55 -6.807 -8.231 11.170 1.00 0.00 O ATOM 894 CB PRO A 55 -7.018 -11.320 11.001 1.00 0.00 C ATOM 895 CG PRO A 55 -5.770 -11.536 10.172 1.00 0.00 C ATOM 896 CD PRO A 55 -5.841 -10.596 8.972 1.00 0.00 C ATOM 0 HA PRO A 55 -8.883 -10.518 10.230 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -6.756 -11.030 12.019 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -7.595 -12.242 11.071 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -4.878 -11.333 10.764 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -5.705 -12.573 9.842 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -5.077 -9.822 9.042 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -5.661 -11.139 8.044 1.00 0.00 H new ATOM 904 N GLU A 56 -8.848 -8.652 11.878 1.00 0.00 N ATOM 905 CA GLU A 56 -8.879 -7.426 12.734 1.00 0.00 C ATOM 906 C GLU A 56 -8.400 -6.205 11.939 1.00 0.00 C ATOM 907 O GLU A 56 -7.771 -5.314 12.476 1.00 0.00 O ATOM 908 CB GLU A 56 -7.968 -7.632 13.946 1.00 0.00 C ATOM 909 CG GLU A 56 -8.696 -8.477 14.993 1.00 0.00 C ATOM 910 CD GLU A 56 -8.250 -8.051 16.393 1.00 0.00 C ATOM 911 OE1 GLU A 56 -8.665 -6.990 16.829 1.00 0.00 O ATOM 912 OE2 GLU A 56 -7.501 -8.794 17.007 1.00 0.00 O ATOM 0 H GLU A 56 -9.697 -9.217 11.907 1.00 0.00 H new ATOM 0 HA GLU A 56 -9.903 -7.251 13.063 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -7.046 -8.126 13.641 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -7.688 -6.669 14.372 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -9.774 -8.353 14.890 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -8.480 -9.534 14.837 1.00 0.00 H new ATOM 919 N ARG A 57 -8.692 -6.157 10.667 1.00 0.00 N ATOM 920 CA ARG A 57 -8.251 -4.993 9.846 1.00 0.00 C ATOM 921 C ARG A 57 -9.322 -4.659 8.805 1.00 0.00 C ATOM 922 O ARG A 57 -9.832 -5.527 8.124 1.00 0.00 O ATOM 923 CB ARG A 57 -6.937 -5.336 9.138 1.00 0.00 C ATOM 924 CG ARG A 57 -5.753 -4.832 9.974 1.00 0.00 C ATOM 925 CD ARG A 57 -4.932 -6.019 10.485 1.00 0.00 C ATOM 926 NE ARG A 57 -4.877 -5.979 11.977 1.00 0.00 N ATOM 927 CZ ARG A 57 -4.587 -7.056 12.669 1.00 0.00 C ATOM 928 NH1 ARG A 57 -4.333 -8.192 12.069 1.00 0.00 N ATOM 929 NH2 ARG A 57 -4.544 -6.992 13.972 1.00 0.00 N ATOM 0 H ARG A 57 -9.216 -6.872 10.162 1.00 0.00 H new ATOM 0 HA ARG A 57 -8.100 -4.131 10.495 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -6.861 -6.414 8.994 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -6.916 -4.880 8.148 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -5.124 -4.176 9.371 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -6.116 -4.241 10.815 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -5.380 -6.955 10.152 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -3.924 -5.983 10.072 1.00 0.00 H new ATOM 0 HE ARG A 57 -5.067 -5.103 12.464 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -4.359 -8.248 11.051 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -4.109 -9.021 12.620 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -4.735 -6.109 14.446 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -4.319 -7.825 14.516 1.00 0.00 H new ATOM 943 N THR A 58 -9.666 -3.404 8.679 1.00 0.00 N ATOM 944 CA THR A 58 -10.704 -3.005 7.685 1.00 0.00 C ATOM 945 C THR A 58 -10.058 -2.859 6.306 1.00 0.00 C ATOM 946 O THR A 58 -9.108 -2.121 6.131 1.00 0.00 O ATOM 947 CB THR A 58 -11.323 -1.668 8.102 1.00 0.00 C ATOM 948 OG1 THR A 58 -11.654 -1.712 9.483 1.00 0.00 O ATOM 949 CG2 THR A 58 -12.587 -1.411 7.280 1.00 0.00 C ATOM 0 H THR A 58 -9.271 -2.637 9.223 1.00 0.00 H new ATOM 0 HA THR A 58 -11.481 -3.768 7.644 1.00 0.00 H new ATOM 0 HB THR A 58 -10.608 -0.865 7.925 1.00 0.00 H new ATOM 0 HG1 THR A 58 -12.617 -1.567 9.593 1.00 0.00 H new ATOM 0 HG21 THR A 58 -13.027 -0.459 7.577 1.00 0.00 H new ATOM 0 HG22 THR A 58 -12.332 -1.378 6.221 1.00 0.00 H new ATOM 0 HG23 THR A 58 -13.304 -2.213 7.455 1.00 0.00 H new ATOM 957 N ASN A 59 -10.564 -3.559 5.326 1.00 0.00 N ATOM 958 CA ASN A 59 -9.975 -3.463 3.958 1.00 0.00 C ATOM 959 C ASN A 59 -11.068 -3.085 2.954 1.00 0.00 C ATOM 960 O ASN A 59 -12.202 -3.507 3.070 1.00 0.00 O ATOM 961 CB ASN A 59 -9.370 -4.816 3.563 1.00 0.00 C ATOM 962 CG ASN A 59 -8.636 -5.429 4.760 1.00 0.00 C ATOM 963 OD1 ASN A 59 -8.675 -6.626 4.965 1.00 0.00 O ATOM 964 ND2 ASN A 59 -7.958 -4.655 5.562 1.00 0.00 N ATOM 0 H ASN A 59 -11.359 -4.192 5.413 1.00 0.00 H new ATOM 0 HA ASN A 59 -9.197 -2.700 3.954 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -10.156 -5.490 3.223 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -8.679 -4.686 2.730 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -7.462 -5.055 6.359 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -7.923 -3.650 5.392 1.00 0.00 H new ATOM 971 N VAL A 60 -10.734 -2.294 1.968 1.00 0.00 N ATOM 972 CA VAL A 60 -11.747 -1.888 0.950 1.00 0.00 C ATOM 973 C VAL A 60 -11.232 -2.262 -0.441 1.00 0.00 C ATOM 974 O VAL A 60 -10.074 -2.066 -0.755 1.00 0.00 O ATOM 975 CB VAL A 60 -11.967 -0.374 1.014 1.00 0.00 C ATOM 976 CG1 VAL A 60 -13.158 0.011 0.131 1.00 0.00 C ATOM 977 CG2 VAL A 60 -12.247 0.041 2.459 1.00 0.00 C ATOM 0 H VAL A 60 -9.800 -1.911 1.824 1.00 0.00 H new ATOM 0 HA VAL A 60 -12.689 -2.398 1.150 1.00 0.00 H new ATOM 0 HB VAL A 60 -11.073 0.136 0.656 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -13.313 1.089 0.178 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -12.957 -0.282 -0.899 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -14.054 -0.500 0.485 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -12.404 1.119 2.504 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -13.140 -0.471 2.818 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -11.397 -0.229 3.086 1.00 0.00 H new ATOM 987 N VAL A 61 -12.073 -2.818 -1.270 1.00 0.00 N ATOM 988 CA VAL A 61 -11.620 -3.222 -2.632 1.00 0.00 C ATOM 989 C VAL A 61 -12.064 -2.178 -3.661 1.00 0.00 C ATOM 990 O VAL A 61 -13.111 -1.573 -3.535 1.00 0.00 O ATOM 991 CB VAL A 61 -12.241 -4.575 -2.999 1.00 0.00 C ATOM 992 CG1 VAL A 61 -11.543 -5.135 -4.240 1.00 0.00 C ATOM 993 CG2 VAL A 61 -12.076 -5.562 -1.839 1.00 0.00 C ATOM 0 H VAL A 61 -13.053 -3.010 -1.064 1.00 0.00 H new ATOM 0 HA VAL A 61 -10.533 -3.298 -2.634 1.00 0.00 H new ATOM 0 HB VAL A 61 -13.303 -4.435 -3.202 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -11.983 -6.097 -4.502 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -11.666 -4.441 -5.071 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -10.481 -5.267 -4.032 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -12.520 -6.520 -2.110 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -11.016 -5.701 -1.627 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -12.574 -5.169 -0.953 1.00 0.00 H new ATOM 1003 N LEU A 62 -11.285 -1.986 -4.693 1.00 0.00 N ATOM 1004 CA LEU A 62 -11.668 -1.007 -5.750 1.00 0.00 C ATOM 1005 C LEU A 62 -11.891 -1.772 -7.057 1.00 0.00 C ATOM 1006 O LEU A 62 -11.005 -2.445 -7.546 1.00 0.00 O ATOM 1007 CB LEU A 62 -10.547 0.021 -5.937 1.00 0.00 C ATOM 1008 CG LEU A 62 -11.095 1.429 -5.696 1.00 0.00 C ATOM 1009 CD1 LEU A 62 -11.340 1.629 -4.198 1.00 0.00 C ATOM 1010 CD2 LEU A 62 -10.082 2.467 -6.194 1.00 0.00 C ATOM 0 H LEU A 62 -10.399 -2.466 -4.849 1.00 0.00 H new ATOM 0 HA LEU A 62 -12.579 -0.482 -5.462 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -9.731 -0.186 -5.244 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -10.137 -0.053 -6.944 1.00 0.00 H new ATOM 0 HG LEU A 62 -12.033 1.552 -6.238 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -11.730 2.632 -4.024 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -12.062 0.892 -3.846 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -10.402 1.506 -3.656 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -10.474 3.469 -6.022 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -9.143 2.347 -5.654 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -9.909 2.324 -7.261 1.00 0.00 H new ATOM 1022 N THR A 63 -13.067 -1.689 -7.619 1.00 0.00 N ATOM 1023 CA THR A 63 -13.331 -2.433 -8.886 1.00 0.00 C ATOM 1024 C THR A 63 -14.316 -1.654 -9.761 1.00 0.00 C ATOM 1025 O THR A 63 -15.062 -0.819 -9.285 1.00 0.00 O ATOM 1026 CB THR A 63 -13.921 -3.808 -8.549 1.00 0.00 C ATOM 1027 OG1 THR A 63 -14.081 -4.557 -9.744 1.00 0.00 O ATOM 1028 CG2 THR A 63 -15.281 -3.637 -7.868 1.00 0.00 C ATOM 0 H THR A 63 -13.851 -1.143 -7.260 1.00 0.00 H new ATOM 0 HA THR A 63 -12.395 -2.555 -9.432 1.00 0.00 H new ATOM 0 HB THR A 63 -13.246 -4.334 -7.874 1.00 0.00 H new ATOM 0 HG1 THR A 63 -13.426 -4.257 -10.408 1.00 0.00 H new ATOM 0 HG21 THR A 63 -15.695 -4.617 -7.631 1.00 0.00 H new ATOM 0 HG22 THR A 63 -15.158 -3.063 -6.949 1.00 0.00 H new ATOM 0 HG23 THR A 63 -15.959 -3.109 -8.538 1.00 0.00 H new ATOM 1036 N HIS A 64 -14.327 -1.929 -11.039 1.00 0.00 N ATOM 1037 CA HIS A 64 -15.266 -1.220 -11.954 1.00 0.00 C ATOM 1038 C HIS A 64 -16.504 -2.091 -12.198 1.00 0.00 C ATOM 1039 O HIS A 64 -17.364 -1.748 -12.986 1.00 0.00 O ATOM 1040 CB HIS A 64 -14.569 -0.948 -13.289 1.00 0.00 C ATOM 1041 CG HIS A 64 -13.994 0.442 -13.287 1.00 0.00 C ATOM 1042 ND1 HIS A 64 -12.713 0.906 -13.457 1.00 0.00 N flip ATOM 1043 CD2 HIS A 64 -14.782 1.566 -13.094 1.00 0.00 C flip ATOM 1044 CE1 HIS A 64 -12.703 2.295 -13.372 1.00 0.00 C flip ATOM 1045 NE2 HIS A 64 -13.975 2.641 -13.153 1.00 0.00 N flip ATOM 0 H HIS A 64 -13.723 -2.617 -11.489 1.00 0.00 H new ATOM 0 HA HIS A 64 -15.569 -0.277 -11.499 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -13.777 -1.679 -13.452 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -15.278 -1.057 -14.109 1.00 0.00 H new ATOM 0 HD1 HIS A 64 -11.893 0.321 -13.621 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -15.849 1.577 -12.927 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -11.851 2.952 -13.463 1.00 0.00 H new ATOM 1053 N GLN A 65 -16.602 -3.216 -11.535 1.00 0.00 N ATOM 1054 CA GLN A 65 -17.782 -4.103 -11.739 1.00 0.00 C ATOM 1055 C GLN A 65 -18.950 -3.598 -10.890 1.00 0.00 C ATOM 1056 O GLN A 65 -18.807 -2.683 -10.104 1.00 0.00 O ATOM 1057 CB GLN A 65 -17.421 -5.531 -11.322 1.00 0.00 C ATOM 1058 CG GLN A 65 -16.714 -6.241 -12.481 1.00 0.00 C ATOM 1059 CD GLN A 65 -15.409 -5.512 -12.812 1.00 0.00 C ATOM 1060 OE1 GLN A 65 -14.378 -5.653 -12.023 1.00 0.00 O flip ATOM 1061 NE2 GLN A 65 -15.326 -4.809 -13.799 1.00 0.00 N flip ATOM 0 H GLN A 65 -15.915 -3.556 -10.862 1.00 0.00 H new ATOM 0 HA GLN A 65 -18.070 -4.095 -12.790 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -16.774 -5.512 -10.445 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -18.322 -6.078 -11.042 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -16.506 -7.277 -12.213 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -17.362 -6.263 -13.357 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -16.131 -4.699 -14.416 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -14.451 -4.329 -14.011 1.00 0.00 H new ATOM 1070 N GLU A 66 -20.107 -4.184 -11.047 1.00 0.00 N ATOM 1071 CA GLU A 66 -21.287 -3.731 -10.255 1.00 0.00 C ATOM 1072 C GLU A 66 -21.793 -4.870 -9.361 1.00 0.00 C ATOM 1073 O GLU A 66 -22.506 -4.642 -8.404 1.00 0.00 O ATOM 1074 CB GLU A 66 -22.402 -3.303 -11.215 1.00 0.00 C ATOM 1075 CG GLU A 66 -22.966 -1.949 -10.778 1.00 0.00 C ATOM 1076 CD GLU A 66 -24.123 -1.558 -11.700 1.00 0.00 C ATOM 1077 OE1 GLU A 66 -23.857 -1.220 -12.841 1.00 0.00 O ATOM 1078 OE2 GLU A 66 -25.255 -1.603 -11.248 1.00 0.00 O ATOM 0 H GLU A 66 -20.286 -4.956 -11.689 1.00 0.00 H new ATOM 0 HA GLU A 66 -20.995 -2.891 -9.625 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -22.014 -3.236 -12.231 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -23.194 -4.052 -11.225 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -23.312 -2.003 -9.746 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -22.185 -1.189 -10.814 1.00 0.00 H new ATOM 1085 N ASP A 67 -21.445 -6.093 -9.668 1.00 0.00 N ATOM 1086 CA ASP A 67 -21.926 -7.233 -8.835 1.00 0.00 C ATOM 1087 C ASP A 67 -20.784 -7.779 -7.972 1.00 0.00 C ATOM 1088 O ASP A 67 -20.760 -8.946 -7.633 1.00 0.00 O ATOM 1089 CB ASP A 67 -22.448 -8.344 -9.748 1.00 0.00 C ATOM 1090 CG ASP A 67 -23.938 -8.127 -10.016 1.00 0.00 C ATOM 1091 OD1 ASP A 67 -24.256 -7.254 -10.806 1.00 0.00 O ATOM 1092 OD2 ASP A 67 -24.736 -8.837 -9.426 1.00 0.00 O ATOM 0 H ASP A 67 -20.851 -6.350 -10.456 1.00 0.00 H new ATOM 0 HA ASP A 67 -22.726 -6.882 -8.183 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -21.895 -8.347 -10.688 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -22.289 -9.317 -9.282 1.00 0.00 H new ATOM 1097 N TYR A 68 -19.844 -6.948 -7.604 1.00 0.00 N ATOM 1098 CA TYR A 68 -18.716 -7.431 -6.753 1.00 0.00 C ATOM 1099 C TYR A 68 -19.275 -7.955 -5.428 1.00 0.00 C ATOM 1100 O TYR A 68 -19.775 -7.201 -4.616 1.00 0.00 O ATOM 1101 CB TYR A 68 -17.747 -6.279 -6.478 1.00 0.00 C ATOM 1102 CG TYR A 68 -16.379 -6.837 -6.159 1.00 0.00 C ATOM 1103 CD1 TYR A 68 -15.611 -7.427 -7.169 1.00 0.00 C ATOM 1104 CD2 TYR A 68 -15.881 -6.765 -4.853 1.00 0.00 C ATOM 1105 CE1 TYR A 68 -14.344 -7.944 -6.874 1.00 0.00 C ATOM 1106 CE2 TYR A 68 -14.614 -7.282 -4.557 1.00 0.00 C ATOM 1107 CZ TYR A 68 -13.845 -7.871 -5.568 1.00 0.00 C ATOM 1108 OH TYR A 68 -12.596 -8.381 -5.277 1.00 0.00 O ATOM 0 H TYR A 68 -19.808 -5.960 -7.855 1.00 0.00 H new ATOM 0 HA TYR A 68 -18.185 -8.230 -7.271 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -17.690 -5.622 -7.346 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -18.109 -5.676 -5.645 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -15.996 -7.484 -8.177 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -16.474 -6.311 -4.073 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -13.751 -8.399 -7.654 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -14.230 -7.227 -3.549 1.00 0.00 H new ATOM 0 HH TYR A 68 -12.402 -8.248 -4.326 1.00 0.00 H new ATOM 1118 N GLN A 69 -19.197 -9.240 -5.202 1.00 0.00 N ATOM 1119 CA GLN A 69 -19.728 -9.808 -3.930 1.00 0.00 C ATOM 1120 C GLN A 69 -18.577 -10.024 -2.944 1.00 0.00 C ATOM 1121 O GLN A 69 -17.805 -10.954 -3.071 1.00 0.00 O ATOM 1122 CB GLN A 69 -20.413 -11.147 -4.216 1.00 0.00 C ATOM 1123 CG GLN A 69 -21.680 -10.909 -5.044 1.00 0.00 C ATOM 1124 CD GLN A 69 -22.914 -11.269 -4.213 1.00 0.00 C ATOM 1125 OE1 GLN A 69 -22.979 -12.334 -3.632 1.00 0.00 O ATOM 1126 NE2 GLN A 69 -23.901 -10.420 -4.132 1.00 0.00 N ATOM 0 H GLN A 69 -18.789 -9.920 -5.844 1.00 0.00 H new ATOM 0 HA GLN A 69 -20.449 -9.115 -3.498 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -19.733 -11.807 -4.754 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -20.666 -11.645 -3.280 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -21.731 -9.866 -5.356 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -21.652 -11.512 -5.951 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -23.846 -9.526 -4.620 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -24.728 -10.650 -3.581 1.00 0.00 H new ATOM 1135 N ALA A 70 -18.460 -9.173 -1.960 1.00 0.00 N ATOM 1136 CA ALA A 70 -17.364 -9.329 -0.962 1.00 0.00 C ATOM 1137 C ALA A 70 -17.927 -9.123 0.446 1.00 0.00 C ATOM 1138 O ALA A 70 -17.857 -8.043 1.000 1.00 0.00 O ATOM 1139 CB ALA A 70 -16.273 -8.292 -1.234 1.00 0.00 C ATOM 0 H ALA A 70 -19.077 -8.376 -1.805 1.00 0.00 H new ATOM 0 HA ALA A 70 -16.939 -10.329 -1.041 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -15.472 -8.407 -0.504 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -15.873 -8.439 -2.237 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -16.695 -7.290 -1.155 1.00 0.00 H new ATOM 1145 N GLN A 71 -18.486 -10.151 1.027 1.00 0.00 N ATOM 1146 CA GLN A 71 -19.055 -10.016 2.398 1.00 0.00 C ATOM 1147 C GLN A 71 -17.919 -9.956 3.419 1.00 0.00 C ATOM 1148 O GLN A 71 -17.028 -10.783 3.420 1.00 0.00 O ATOM 1149 CB GLN A 71 -19.947 -11.221 2.702 1.00 0.00 C ATOM 1150 CG GLN A 71 -21.268 -11.082 1.945 1.00 0.00 C ATOM 1151 CD GLN A 71 -22.277 -12.096 2.488 1.00 0.00 C ATOM 1152 OE1 GLN A 71 -22.852 -11.894 3.539 1.00 0.00 O ATOM 1153 NE2 GLN A 71 -22.517 -13.185 1.812 1.00 0.00 N ATOM 0 H GLN A 71 -18.573 -11.078 0.611 1.00 0.00 H new ATOM 0 HA GLN A 71 -19.645 -9.102 2.456 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -19.443 -12.142 2.410 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -20.135 -11.287 3.774 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -21.658 -10.070 2.056 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -21.108 -11.247 0.880 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -22.034 -13.354 0.930 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -23.188 -13.867 2.166 1.00 0.00 H new ATOM 1162 N GLY A 72 -17.943 -8.981 4.286 1.00 0.00 N ATOM 1163 CA GLY A 72 -16.865 -8.864 5.307 1.00 0.00 C ATOM 1164 C GLY A 72 -15.926 -7.721 4.923 1.00 0.00 C ATOM 1165 O GLY A 72 -15.402 -7.026 5.773 1.00 0.00 O ATOM 0 H GLY A 72 -18.663 -8.260 4.331 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -17.298 -8.679 6.290 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -16.309 -9.799 5.374 1.00 0.00 H new ATOM 1169 N ALA A 73 -15.705 -7.520 3.651 1.00 0.00 N ATOM 1170 CA ALA A 73 -14.796 -6.424 3.217 1.00 0.00 C ATOM 1171 C ALA A 73 -15.600 -5.333 2.505 1.00 0.00 C ATOM 1172 O ALA A 73 -16.529 -5.606 1.771 1.00 0.00 O ATOM 1173 CB ALA A 73 -13.741 -6.986 2.261 1.00 0.00 C ATOM 0 H ALA A 73 -16.115 -8.068 2.895 1.00 0.00 H new ATOM 0 HA ALA A 73 -14.307 -5.996 4.092 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -13.075 -6.184 1.942 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -13.163 -7.758 2.770 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -14.233 -7.417 1.389 1.00 0.00 H new ATOM 1179 N VAL A 74 -15.230 -4.100 2.713 1.00 0.00 N ATOM 1180 CA VAL A 74 -15.949 -2.973 2.049 1.00 0.00 C ATOM 1181 C VAL A 74 -15.846 -3.138 0.531 1.00 0.00 C ATOM 1182 O VAL A 74 -14.980 -3.834 0.037 1.00 0.00 O ATOM 1183 CB VAL A 74 -15.307 -1.646 2.457 1.00 0.00 C ATOM 1184 CG1 VAL A 74 -16.168 -0.484 1.955 1.00 0.00 C ATOM 1185 CG2 VAL A 74 -15.191 -1.576 3.984 1.00 0.00 C ATOM 0 H VAL A 74 -14.457 -3.822 3.317 1.00 0.00 H new ATOM 0 HA VAL A 74 -16.996 -2.978 2.352 1.00 0.00 H new ATOM 0 HB VAL A 74 -14.312 -1.577 2.017 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -15.709 0.461 2.246 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -16.244 -0.531 0.869 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -17.164 -0.554 2.392 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -14.733 -0.629 4.271 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -16.184 -1.648 4.428 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -14.573 -2.400 4.340 1.00 0.00 H new ATOM 1195 N VAL A 75 -16.707 -2.497 -0.216 1.00 0.00 N ATOM 1196 CA VAL A 75 -16.644 -2.612 -1.701 1.00 0.00 C ATOM 1197 C VAL A 75 -17.086 -1.280 -2.313 1.00 0.00 C ATOM 1198 O VAL A 75 -18.122 -0.746 -1.966 1.00 0.00 O ATOM 1199 CB VAL A 75 -17.585 -3.725 -2.173 1.00 0.00 C ATOM 1200 CG1 VAL A 75 -17.480 -3.876 -3.692 1.00 0.00 C ATOM 1201 CG2 VAL A 75 -17.194 -5.045 -1.505 1.00 0.00 C ATOM 0 H VAL A 75 -17.452 -1.898 0.140 1.00 0.00 H new ATOM 0 HA VAL A 75 -15.626 -2.850 -2.011 1.00 0.00 H new ATOM 0 HB VAL A 75 -18.609 -3.469 -1.902 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -18.150 -4.668 -4.026 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -17.760 -2.938 -4.171 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -16.455 -4.130 -3.962 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -17.864 -5.836 -1.842 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -16.169 -5.299 -1.774 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -17.270 -4.942 -0.423 1.00 0.00 H new ATOM 1211 N VAL A 76 -16.315 -0.733 -3.216 1.00 0.00 N ATOM 1212 CA VAL A 76 -16.706 0.568 -3.833 1.00 0.00 C ATOM 1213 C VAL A 76 -16.196 0.634 -5.276 1.00 0.00 C ATOM 1214 O VAL A 76 -15.377 -0.163 -5.695 1.00 0.00 O ATOM 1215 CB VAL A 76 -16.099 1.719 -3.025 1.00 0.00 C ATOM 1216 CG1 VAL A 76 -16.760 1.782 -1.646 1.00 0.00 C ATOM 1217 CG2 VAL A 76 -14.593 1.492 -2.860 1.00 0.00 C ATOM 0 H VAL A 76 -15.437 -1.128 -3.551 1.00 0.00 H new ATOM 0 HA VAL A 76 -17.793 0.653 -3.832 1.00 0.00 H new ATOM 0 HB VAL A 76 -16.268 2.658 -3.551 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -16.327 2.601 -1.072 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -17.831 1.947 -1.763 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -16.593 0.842 -1.119 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -14.162 2.312 -2.285 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -14.422 0.552 -2.336 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -14.122 1.451 -3.842 1.00 0.00 H new ATOM 1227 N HIS A 77 -16.686 1.575 -6.040 1.00 0.00 N ATOM 1228 CA HIS A 77 -16.244 1.696 -7.460 1.00 0.00 C ATOM 1229 C HIS A 77 -16.078 3.176 -7.814 1.00 0.00 C ATOM 1230 O HIS A 77 -16.341 3.587 -8.928 1.00 0.00 O ATOM 1231 CB HIS A 77 -17.298 1.078 -8.387 1.00 0.00 C ATOM 1232 CG HIS A 77 -17.850 -0.179 -7.771 1.00 0.00 C ATOM 1233 ND1 HIS A 77 -17.245 -1.411 -7.946 1.00 0.00 N ATOM 1234 CD2 HIS A 77 -18.950 -0.408 -6.982 1.00 0.00 C ATOM 1235 CE1 HIS A 77 -17.976 -2.320 -7.275 1.00 0.00 C ATOM 1236 NE2 HIS A 77 -19.027 -1.762 -6.670 1.00 0.00 N ATOM 0 H HIS A 77 -17.374 2.266 -5.741 1.00 0.00 H new ATOM 0 HA HIS A 77 -15.296 1.173 -7.586 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -18.103 1.791 -8.562 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -16.855 0.853 -9.357 1.00 0.00 H new ATOM 0 HD1 HIS A 77 -16.399 -1.596 -8.485 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -19.649 0.347 -6.654 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -17.741 -3.373 -7.231 1.00 0.00 H new ATOM 1244 N ASP A 78 -15.641 3.979 -6.881 1.00 0.00 N ATOM 1245 CA ASP A 78 -15.457 5.429 -7.176 1.00 0.00 C ATOM 1246 C ASP A 78 -14.670 6.090 -6.042 1.00 0.00 C ATOM 1247 O ASP A 78 -15.172 6.258 -4.949 1.00 0.00 O ATOM 1248 CB ASP A 78 -16.824 6.102 -7.308 1.00 0.00 C ATOM 1249 CG ASP A 78 -16.739 7.229 -8.339 1.00 0.00 C ATOM 1250 OD1 ASP A 78 -16.380 8.330 -7.955 1.00 0.00 O ATOM 1251 OD2 ASP A 78 -17.033 6.972 -9.494 1.00 0.00 O ATOM 0 H ASP A 78 -15.404 3.695 -5.930 1.00 0.00 H new ATOM 0 HA ASP A 78 -14.906 5.539 -8.110 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -17.573 5.371 -7.613 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -17.140 6.500 -6.344 1.00 0.00 H new ATOM 1256 N VAL A 79 -13.437 6.454 -6.292 1.00 0.00 N ATOM 1257 CA VAL A 79 -12.599 7.103 -5.233 1.00 0.00 C ATOM 1258 C VAL A 79 -13.424 8.142 -4.458 1.00 0.00 C ATOM 1259 O VAL A 79 -13.193 8.380 -3.289 1.00 0.00 O ATOM 1260 CB VAL A 79 -11.403 7.797 -5.895 1.00 0.00 C ATOM 1261 CG1 VAL A 79 -10.610 8.578 -4.843 1.00 0.00 C ATOM 1262 CG2 VAL A 79 -10.495 6.746 -6.542 1.00 0.00 C ATOM 0 H VAL A 79 -12.970 6.329 -7.190 1.00 0.00 H new ATOM 0 HA VAL A 79 -12.252 6.339 -4.537 1.00 0.00 H new ATOM 0 HB VAL A 79 -11.765 8.486 -6.658 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -9.761 9.069 -5.318 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -11.254 9.329 -4.385 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -10.250 7.892 -4.076 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -9.645 7.240 -7.013 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -10.137 6.055 -5.779 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -11.057 6.194 -7.296 1.00 0.00 H new ATOM 1272 N ALA A 80 -14.383 8.754 -5.099 1.00 0.00 N ATOM 1273 CA ALA A 80 -15.222 9.768 -4.398 1.00 0.00 C ATOM 1274 C ALA A 80 -15.915 9.117 -3.197 1.00 0.00 C ATOM 1275 O ALA A 80 -15.962 9.675 -2.116 1.00 0.00 O ATOM 1276 CB ALA A 80 -16.277 10.312 -5.363 1.00 0.00 C ATOM 0 H ALA A 80 -14.622 8.596 -6.078 1.00 0.00 H new ATOM 0 HA ALA A 80 -14.590 10.586 -4.052 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -16.891 11.053 -4.851 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -15.784 10.776 -6.217 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -16.909 9.494 -5.709 1.00 0.00 H new ATOM 1282 N ALA A 81 -16.454 7.941 -3.380 1.00 0.00 N ATOM 1283 CA ALA A 81 -17.147 7.249 -2.256 1.00 0.00 C ATOM 1284 C ALA A 81 -16.133 6.884 -1.169 1.00 0.00 C ATOM 1285 O ALA A 81 -16.364 7.105 0.004 1.00 0.00 O ATOM 1286 CB ALA A 81 -17.816 5.976 -2.776 1.00 0.00 C ATOM 0 H ALA A 81 -16.444 7.429 -4.262 1.00 0.00 H new ATOM 0 HA ALA A 81 -17.902 7.913 -1.836 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -18.323 5.470 -1.954 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -18.543 6.235 -3.546 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -17.060 5.314 -3.199 1.00 0.00 H new ATOM 1292 N VAL A 82 -15.015 6.319 -1.545 1.00 0.00 N ATOM 1293 CA VAL A 82 -13.990 5.932 -0.530 1.00 0.00 C ATOM 1294 C VAL A 82 -13.620 7.150 0.321 1.00 0.00 C ATOM 1295 O VAL A 82 -13.442 7.049 1.519 1.00 0.00 O ATOM 1296 CB VAL A 82 -12.734 5.407 -1.235 1.00 0.00 C ATOM 1297 CG1 VAL A 82 -11.796 4.770 -0.203 1.00 0.00 C ATOM 1298 CG2 VAL A 82 -13.125 4.360 -2.284 1.00 0.00 C ATOM 0 H VAL A 82 -14.767 6.109 -2.512 1.00 0.00 H new ATOM 0 HA VAL A 82 -14.401 5.151 0.110 1.00 0.00 H new ATOM 0 HB VAL A 82 -12.226 6.237 -1.727 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -10.903 4.397 -0.704 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -11.511 5.516 0.539 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -12.307 3.944 0.292 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -12.228 3.991 -2.781 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -13.637 3.530 -1.797 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -13.788 4.813 -3.021 1.00 0.00 H new ATOM 1308 N PHE A 83 -13.499 8.299 -0.290 1.00 0.00 N ATOM 1309 CA PHE A 83 -13.139 9.523 0.484 1.00 0.00 C ATOM 1310 C PHE A 83 -14.214 9.801 1.537 1.00 0.00 C ATOM 1311 O PHE A 83 -13.923 10.245 2.631 1.00 0.00 O ATOM 1312 CB PHE A 83 -13.036 10.719 -0.466 1.00 0.00 C ATOM 1313 CG PHE A 83 -11.613 10.858 -0.957 1.00 0.00 C ATOM 1314 CD1 PHE A 83 -10.582 11.096 -0.043 1.00 0.00 C ATOM 1315 CD2 PHE A 83 -11.326 10.753 -2.323 1.00 0.00 C ATOM 1316 CE1 PHE A 83 -9.265 11.229 -0.492 1.00 0.00 C ATOM 1317 CE2 PHE A 83 -10.007 10.886 -2.772 1.00 0.00 C ATOM 1318 CZ PHE A 83 -8.977 11.124 -1.856 1.00 0.00 C ATOM 0 H PHE A 83 -13.634 8.443 -1.291 1.00 0.00 H new ATOM 0 HA PHE A 83 -12.180 9.367 0.978 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -13.711 10.584 -1.311 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -13.345 11.630 0.046 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -10.803 11.177 1.011 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -12.122 10.570 -3.030 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -8.470 11.413 0.215 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -9.784 10.805 -3.826 1.00 0.00 H new ATOM 0 HZ PHE A 83 -7.959 11.227 -2.202 1.00 0.00 H new ATOM 1328 N ALA A 84 -15.454 9.546 1.216 1.00 0.00 N ATOM 1329 CA ALA A 84 -16.550 9.800 2.198 1.00 0.00 C ATOM 1330 C ALA A 84 -16.306 8.991 3.477 1.00 0.00 C ATOM 1331 O ALA A 84 -16.231 9.537 4.560 1.00 0.00 O ATOM 1332 CB ALA A 84 -17.891 9.389 1.582 1.00 0.00 C ATOM 0 H ALA A 84 -15.756 9.173 0.316 1.00 0.00 H new ATOM 0 HA ALA A 84 -16.569 10.861 2.446 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -18.692 9.574 2.298 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -18.070 9.972 0.678 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -17.866 8.329 1.331 1.00 0.00 H new ATOM 1338 N TYR A 85 -16.207 7.691 3.362 1.00 0.00 N ATOM 1339 CA TYR A 85 -15.992 6.830 4.567 1.00 0.00 C ATOM 1340 C TYR A 85 -14.866 7.390 5.445 1.00 0.00 C ATOM 1341 O TYR A 85 -15.044 7.605 6.628 1.00 0.00 O ATOM 1342 CB TYR A 85 -15.621 5.416 4.116 1.00 0.00 C ATOM 1343 CG TYR A 85 -16.046 4.421 5.171 1.00 0.00 C ATOM 1344 CD1 TYR A 85 -17.405 4.165 5.386 1.00 0.00 C ATOM 1345 CD2 TYR A 85 -15.079 3.754 5.932 1.00 0.00 C ATOM 1346 CE1 TYR A 85 -17.797 3.242 6.363 1.00 0.00 C ATOM 1347 CE2 TYR A 85 -15.471 2.831 6.909 1.00 0.00 C ATOM 1348 CZ TYR A 85 -16.830 2.574 7.125 1.00 0.00 C ATOM 1349 OH TYR A 85 -17.217 1.664 8.088 1.00 0.00 O ATOM 0 H TYR A 85 -16.266 7.184 2.479 1.00 0.00 H new ATOM 0 HA TYR A 85 -16.913 6.812 5.150 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -16.107 5.186 3.168 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -14.546 5.347 3.948 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -18.151 4.679 4.798 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -14.030 3.951 5.766 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -18.846 3.045 6.529 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -14.725 2.317 7.496 1.00 0.00 H new ATOM 0 HH TYR A 85 -17.588 2.142 8.859 1.00 0.00 H new ATOM 1359 N ALA A 86 -13.710 7.626 4.881 1.00 0.00 N ATOM 1360 CA ALA A 86 -12.576 8.167 5.690 1.00 0.00 C ATOM 1361 C ALA A 86 -13.012 9.448 6.407 1.00 0.00 C ATOM 1362 O ALA A 86 -12.793 9.613 7.591 1.00 0.00 O ATOM 1363 CB ALA A 86 -11.397 8.476 4.766 1.00 0.00 C ATOM 0 H ALA A 86 -13.502 7.468 3.895 1.00 0.00 H new ATOM 0 HA ALA A 86 -12.277 7.426 6.432 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -10.568 8.871 5.353 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -11.081 7.563 4.261 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -11.700 9.215 4.024 1.00 0.00 H new ATOM 1369 N LYS A 87 -13.637 10.349 5.699 1.00 0.00 N ATOM 1370 CA LYS A 87 -14.097 11.616 6.335 1.00 0.00 C ATOM 1371 C LYS A 87 -15.160 11.302 7.393 1.00 0.00 C ATOM 1372 O LYS A 87 -15.380 12.068 8.311 1.00 0.00 O ATOM 1373 CB LYS A 87 -14.700 12.529 5.264 1.00 0.00 C ATOM 1374 CG LYS A 87 -14.361 13.989 5.579 1.00 0.00 C ATOM 1375 CD LYS A 87 -13.398 14.533 4.520 1.00 0.00 C ATOM 1376 CE LYS A 87 -13.492 16.060 4.480 1.00 0.00 C ATOM 1377 NZ LYS A 87 -12.627 16.646 5.545 1.00 0.00 N ATOM 0 H LYS A 87 -13.849 10.262 4.705 1.00 0.00 H new ATOM 0 HA LYS A 87 -13.251 12.114 6.808 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -14.312 12.259 4.282 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -15.781 12.397 5.227 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -15.271 14.588 5.599 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -13.909 14.063 6.568 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -12.377 14.227 4.750 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -13.643 14.117 3.543 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -13.181 16.427 3.502 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -14.526 16.374 4.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -12.694 17.683 5.515 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -12.943 16.306 6.475 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -11.640 16.358 5.388 1.00 0.00 H new ATOM 1391 N GLN A 88 -15.835 10.192 7.256 1.00 0.00 N ATOM 1392 CA GLN A 88 -16.900 9.835 8.237 1.00 0.00 C ATOM 1393 C GLN A 88 -16.303 9.081 9.431 1.00 0.00 C ATOM 1394 O GLN A 88 -16.736 9.253 10.554 1.00 0.00 O ATOM 1395 CB GLN A 88 -17.946 8.953 7.550 1.00 0.00 C ATOM 1396 CG GLN A 88 -19.196 9.783 7.246 1.00 0.00 C ATOM 1397 CD GLN A 88 -19.000 10.540 5.932 1.00 0.00 C ATOM 1398 OE1 GLN A 88 -18.371 11.580 5.904 1.00 0.00 O ATOM 1399 NE2 GLN A 88 -19.515 10.060 4.833 1.00 0.00 N ATOM 0 H GLN A 88 -15.694 9.516 6.505 1.00 0.00 H new ATOM 0 HA GLN A 88 -17.365 10.752 8.600 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -17.539 8.539 6.628 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -18.204 8.110 8.191 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -20.069 9.133 7.177 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -19.385 10.485 8.058 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -20.043 9.187 4.856 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -19.390 10.557 3.951 1.00 0.00 H new ATOM 1408 N HIS A 89 -15.330 8.237 9.207 1.00 0.00 N ATOM 1409 CA HIS A 89 -14.736 7.468 10.340 1.00 0.00 C ATOM 1410 C HIS A 89 -13.573 8.252 10.965 1.00 0.00 C ATOM 1411 O HIS A 89 -12.571 8.481 10.317 1.00 0.00 O ATOM 1412 CB HIS A 89 -14.212 6.128 9.817 1.00 0.00 C ATOM 1413 CG HIS A 89 -15.286 5.083 9.941 1.00 0.00 C ATOM 1414 ND1 HIS A 89 -15.202 4.043 10.853 1.00 0.00 N ATOM 1415 CD2 HIS A 89 -16.473 4.904 9.277 1.00 0.00 C ATOM 1416 CE1 HIS A 89 -16.310 3.292 10.714 1.00 0.00 C ATOM 1417 NE2 HIS A 89 -17.119 3.773 9.767 1.00 0.00 N ATOM 0 H HIS A 89 -14.922 8.047 8.292 1.00 0.00 H new ATOM 0 HA HIS A 89 -15.502 7.304 11.098 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -13.906 6.227 8.776 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -13.330 5.826 10.381 1.00 0.00 H new ATOM 0 HD1 HIS A 89 -14.439 3.877 11.510 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -16.849 5.544 8.493 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -16.519 2.408 11.298 1.00 0.00 H new ATOM 1425 N PRO A 90 -13.733 8.629 12.215 1.00 0.00 N ATOM 1426 CA PRO A 90 -12.729 9.389 13.036 1.00 0.00 C ATOM 1427 C PRO A 90 -11.712 8.423 13.662 1.00 0.00 C ATOM 1428 O PRO A 90 -10.910 8.807 14.491 1.00 0.00 O ATOM 1429 CB PRO A 90 -13.523 10.093 14.130 1.00 0.00 C ATOM 1430 CG PRO A 90 -14.884 9.429 14.196 1.00 0.00 C ATOM 1431 CD PRO A 90 -14.941 8.390 13.078 1.00 0.00 C ATOM 0 HA PRO A 90 -12.173 10.099 12.424 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -13.010 10.014 15.089 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -13.624 11.156 13.909 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -15.034 8.957 15.167 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -15.677 10.167 14.075 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -14.933 7.379 13.486 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -15.859 8.493 12.499 1.00 0.00 H new ATOM 1439 N ASP A 91 -11.732 7.176 13.266 1.00 0.00 N ATOM 1440 CA ASP A 91 -10.763 6.188 13.825 1.00 0.00 C ATOM 1441 C ASP A 91 -10.262 5.272 12.700 1.00 0.00 C ATOM 1442 O ASP A 91 -9.537 4.324 12.931 1.00 0.00 O ATOM 1443 CB ASP A 91 -11.454 5.346 14.900 1.00 0.00 C ATOM 1444 CG ASP A 91 -11.374 6.070 16.245 1.00 0.00 C ATOM 1445 OD1 ASP A 91 -12.096 7.038 16.418 1.00 0.00 O ATOM 1446 OD2 ASP A 91 -10.592 5.644 17.079 1.00 0.00 O ATOM 0 H ASP A 91 -12.382 6.799 12.576 1.00 0.00 H new ATOM 0 HA ASP A 91 -9.919 6.717 14.267 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -12.496 5.174 14.629 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -10.978 4.368 14.973 1.00 0.00 H new ATOM 1451 N GLN A 92 -10.642 5.558 11.483 1.00 0.00 N ATOM 1452 CA GLN A 92 -10.201 4.731 10.327 1.00 0.00 C ATOM 1453 C GLN A 92 -10.013 5.666 9.133 1.00 0.00 C ATOM 1454 O GLN A 92 -10.970 6.042 8.485 1.00 0.00 O ATOM 1455 CB GLN A 92 -11.285 3.696 10.005 1.00 0.00 C ATOM 1456 CG GLN A 92 -10.639 2.358 9.635 1.00 0.00 C ATOM 1457 CD GLN A 92 -11.381 1.218 10.336 1.00 0.00 C ATOM 1458 OE1 GLN A 92 -10.825 0.544 11.180 1.00 0.00 O ATOM 1459 NE2 GLN A 92 -12.623 0.974 10.020 1.00 0.00 N ATOM 0 H GLN A 92 -11.248 6.342 11.240 1.00 0.00 H new ATOM 0 HA GLN A 92 -9.270 4.211 10.554 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -11.942 3.566 10.865 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -11.904 4.050 9.181 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -10.669 2.215 8.555 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -9.589 2.356 9.928 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -13.090 1.540 9.311 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -13.127 0.217 10.482 1.00 0.00 H new ATOM 1468 N GLU A 93 -8.803 6.060 8.834 1.00 0.00 N ATOM 1469 CA GLU A 93 -8.589 6.988 7.689 1.00 0.00 C ATOM 1470 C GLU A 93 -8.483 6.199 6.383 1.00 0.00 C ATOM 1471 O GLU A 93 -8.874 5.051 6.305 1.00 0.00 O ATOM 1472 CB GLU A 93 -7.301 7.782 7.926 1.00 0.00 C ATOM 1473 CG GLU A 93 -7.532 8.811 9.038 1.00 0.00 C ATOM 1474 CD GLU A 93 -6.642 8.482 10.239 1.00 0.00 C ATOM 1475 OE1 GLU A 93 -5.435 8.590 10.103 1.00 0.00 O ATOM 1476 OE2 GLU A 93 -7.184 8.128 11.273 1.00 0.00 O ATOM 0 H GLU A 93 -7.958 5.780 9.332 1.00 0.00 H new ATOM 0 HA GLU A 93 -9.434 7.672 7.612 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -6.491 7.107 8.203 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -6.997 8.285 7.008 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -7.309 9.813 8.671 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -8.580 8.807 9.338 1.00 0.00 H new ATOM 1483 N LEU A 94 -7.953 6.812 5.358 1.00 0.00 N ATOM 1484 CA LEU A 94 -7.812 6.114 4.051 1.00 0.00 C ATOM 1485 C LEU A 94 -6.362 5.663 3.862 1.00 0.00 C ATOM 1486 O LEU A 94 -5.466 6.472 3.724 1.00 0.00 O ATOM 1487 CB LEU A 94 -8.201 7.072 2.922 1.00 0.00 C ATOM 1488 CG LEU A 94 -9.004 6.320 1.861 1.00 0.00 C ATOM 1489 CD1 LEU A 94 -10.410 6.031 2.393 1.00 0.00 C ATOM 1490 CD2 LEU A 94 -9.101 7.181 0.598 1.00 0.00 C ATOM 0 H LEU A 94 -7.610 7.773 5.372 1.00 0.00 H new ATOM 0 HA LEU A 94 -8.465 5.241 4.032 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -8.790 7.898 3.320 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -7.306 7.505 2.475 1.00 0.00 H new ATOM 0 HG LEU A 94 -8.508 5.379 1.625 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -10.982 5.495 1.636 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -10.340 5.422 3.294 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -10.910 6.970 2.628 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -9.673 6.649 -0.162 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -9.600 8.121 0.836 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -8.100 7.387 0.220 1.00 0.00 H new ATOM 1502 N VAL A 95 -6.126 4.380 3.842 1.00 0.00 N ATOM 1503 CA VAL A 95 -4.734 3.882 3.642 1.00 0.00 C ATOM 1504 C VAL A 95 -4.678 3.121 2.319 1.00 0.00 C ATOM 1505 O VAL A 95 -5.444 2.207 2.086 1.00 0.00 O ATOM 1506 CB VAL A 95 -4.334 2.953 4.792 1.00 0.00 C ATOM 1507 CG1 VAL A 95 -2.885 2.499 4.602 1.00 0.00 C ATOM 1508 CG2 VAL A 95 -4.456 3.704 6.119 1.00 0.00 C ATOM 0 H VAL A 95 -6.835 3.655 3.955 1.00 0.00 H new ATOM 0 HA VAL A 95 -4.041 4.723 3.622 1.00 0.00 H new ATOM 0 HB VAL A 95 -4.992 2.084 4.800 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -2.601 1.838 5.421 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -2.792 1.966 3.656 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -2.229 3.369 4.594 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -4.172 3.044 6.938 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -3.797 4.572 6.107 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -5.486 4.032 6.258 1.00 0.00 H new ATOM 1518 N ILE A 96 -3.792 3.504 1.442 1.00 0.00 N ATOM 1519 CA ILE A 96 -3.701 2.813 0.126 1.00 0.00 C ATOM 1520 C ILE A 96 -2.888 1.529 0.274 1.00 0.00 C ATOM 1521 O ILE A 96 -1.906 1.482 0.993 1.00 0.00 O ATOM 1522 CB ILE A 96 -3.022 3.726 -0.894 1.00 0.00 C ATOM 1523 CG1 ILE A 96 -3.645 5.127 -0.835 1.00 0.00 C ATOM 1524 CG2 ILE A 96 -3.211 3.140 -2.293 1.00 0.00 C ATOM 1525 CD1 ILE A 96 -5.092 5.075 -1.326 1.00 0.00 C ATOM 0 H ILE A 96 -3.127 4.265 1.580 1.00 0.00 H new ATOM 0 HA ILE A 96 -4.707 2.571 -0.218 1.00 0.00 H new ATOM 0 HB ILE A 96 -1.959 3.800 -0.666 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -3.612 5.506 0.186 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -3.068 5.817 -1.450 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -2.729 3.786 -3.026 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -2.764 2.147 -2.335 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.275 3.068 -2.517 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -5.528 6.073 -1.281 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -5.114 4.715 -2.355 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -5.667 4.399 -0.693 1.00 0.00 H new ATOM 1537 N ALA A 97 -3.277 0.493 -0.422 1.00 0.00 N ATOM 1538 CA ALA A 97 -2.525 -0.790 -0.346 1.00 0.00 C ATOM 1539 C ALA A 97 -2.057 -1.195 -1.750 1.00 0.00 C ATOM 1540 O ALA A 97 -1.309 -2.139 -1.912 1.00 0.00 O ATOM 1541 CB ALA A 97 -3.425 -1.881 0.231 1.00 0.00 C ATOM 0 H ALA A 97 -4.087 0.482 -1.042 1.00 0.00 H new ATOM 0 HA ALA A 97 -1.657 -0.662 0.301 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -2.871 -2.818 0.285 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -3.750 -1.593 1.231 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -4.297 -2.011 -0.411 1.00 0.00 H new ATOM 1547 N GLY A 98 -2.451 -0.460 -2.763 1.00 0.00 N ATOM 1548 CA GLY A 98 -1.982 -0.784 -4.142 1.00 0.00 C ATOM 1549 C GLY A 98 -3.089 -1.451 -4.979 1.00 0.00 C ATOM 1550 O GLY A 98 -4.240 -1.498 -4.592 1.00 0.00 O ATOM 0 H GLY A 98 -3.073 0.345 -2.693 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -1.651 0.129 -4.638 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -1.119 -1.447 -4.086 1.00 0.00 H new ATOM 1554 N GLY A 99 -2.739 -1.958 -6.143 1.00 0.00 N ATOM 1555 CA GLY A 99 -1.319 -1.897 -6.605 1.00 0.00 C ATOM 1556 C GLY A 99 -0.958 -0.495 -7.113 1.00 0.00 C ATOM 1557 O GLY A 99 -1.364 0.510 -6.563 1.00 0.00 O ATOM 0 H GLY A 99 -3.382 -2.412 -6.792 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -0.655 -2.171 -5.785 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -1.161 -2.626 -7.400 1.00 0.00 H new ATOM 1561 N ALA A 100 -0.193 -0.431 -8.171 1.00 0.00 N ATOM 1562 CA ALA A 100 0.222 0.888 -8.731 1.00 0.00 C ATOM 1563 C ALA A 100 -0.998 1.655 -9.237 1.00 0.00 C ATOM 1564 O ALA A 100 -1.066 2.864 -9.132 1.00 0.00 O ATOM 1565 CB ALA A 100 1.194 0.663 -9.890 1.00 0.00 C ATOM 0 H ALA A 100 0.165 -1.243 -8.675 1.00 0.00 H new ATOM 0 HA ALA A 100 0.707 1.469 -7.947 1.00 0.00 H new ATOM 0 HB1 ALA A 100 1.499 1.625 -10.301 1.00 0.00 H new ATOM 0 HB2 ALA A 100 2.072 0.128 -9.529 1.00 0.00 H new ATOM 0 HB3 ALA A 100 0.704 0.075 -10.667 1.00 0.00 H new ATOM 1571 N GLN A 101 -1.951 0.969 -9.805 1.00 0.00 N ATOM 1572 CA GLN A 101 -3.153 1.671 -10.335 1.00 0.00 C ATOM 1573 C GLN A 101 -3.828 2.456 -9.209 1.00 0.00 C ATOM 1574 O GLN A 101 -4.341 3.539 -9.424 1.00 0.00 O ATOM 1575 CB GLN A 101 -4.137 0.644 -10.907 1.00 0.00 C ATOM 1576 CG GLN A 101 -4.337 0.901 -12.403 1.00 0.00 C ATOM 1577 CD GLN A 101 -5.197 2.151 -12.599 1.00 0.00 C ATOM 1578 OE1 GLN A 101 -4.684 3.219 -12.866 1.00 0.00 O ATOM 1579 NE2 GLN A 101 -6.493 2.063 -12.474 1.00 0.00 N ATOM 0 H GLN A 101 -1.950 -0.044 -9.925 1.00 0.00 H new ATOM 0 HA GLN A 101 -2.850 2.360 -11.124 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -3.757 -0.365 -10.749 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -5.092 0.711 -10.386 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -3.372 1.031 -12.892 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -4.817 0.040 -12.869 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -6.924 1.166 -12.250 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -7.075 2.891 -12.601 1.00 0.00 H new ATOM 1588 N ILE A 102 -3.860 1.920 -8.017 1.00 0.00 N ATOM 1589 CA ILE A 102 -4.535 2.635 -6.898 1.00 0.00 C ATOM 1590 C ILE A 102 -3.634 3.753 -6.355 1.00 0.00 C ATOM 1591 O ILE A 102 -4.114 4.731 -5.813 1.00 0.00 O ATOM 1592 CB ILE A 102 -4.845 1.623 -5.788 1.00 0.00 C ATOM 1593 CG1 ILE A 102 -5.549 0.397 -6.387 1.00 0.00 C ATOM 1594 CG2 ILE A 102 -5.759 2.257 -4.741 1.00 0.00 C ATOM 1595 CD1 ILE A 102 -6.833 0.832 -7.103 1.00 0.00 C ATOM 0 H ILE A 102 -3.448 1.020 -7.772 1.00 0.00 H new ATOM 0 HA ILE A 102 -5.459 3.089 -7.258 1.00 0.00 H new ATOM 0 HB ILE A 102 -3.909 1.320 -5.319 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -4.885 -0.109 -7.088 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -5.786 -0.318 -5.599 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -5.973 1.530 -3.957 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -5.265 3.126 -4.305 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -6.691 2.568 -5.212 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -7.328 -0.042 -7.526 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -7.500 1.318 -6.391 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -6.585 1.531 -7.902 1.00 0.00 H new ATOM 1607 N PHE A 103 -2.337 3.634 -6.493 1.00 0.00 N ATOM 1608 CA PHE A 103 -1.437 4.710 -5.978 1.00 0.00 C ATOM 1609 C PHE A 103 -1.518 5.929 -6.903 1.00 0.00 C ATOM 1610 O PHE A 103 -1.250 7.045 -6.501 1.00 0.00 O ATOM 1611 CB PHE A 103 0.017 4.217 -5.955 1.00 0.00 C ATOM 1612 CG PHE A 103 0.215 3.155 -4.893 1.00 0.00 C ATOM 1613 CD1 PHE A 103 -0.433 3.255 -3.655 1.00 0.00 C ATOM 1614 CD2 PHE A 103 1.064 2.070 -5.150 1.00 0.00 C ATOM 1615 CE1 PHE A 103 -0.236 2.270 -2.679 1.00 0.00 C ATOM 1616 CE2 PHE A 103 1.261 1.086 -4.173 1.00 0.00 C ATOM 1617 CZ PHE A 103 0.610 1.186 -2.938 1.00 0.00 C ATOM 0 H PHE A 103 -1.866 2.845 -6.936 1.00 0.00 H new ATOM 0 HA PHE A 103 -1.752 4.976 -4.969 1.00 0.00 H new ATOM 0 HB2 PHE A 103 0.283 3.813 -6.932 1.00 0.00 H new ATOM 0 HB3 PHE A 103 0.686 5.056 -5.764 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -1.085 4.092 -3.453 1.00 0.00 H new ATOM 0 HD2 PHE A 103 1.567 1.993 -6.103 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -0.738 2.347 -1.726 1.00 0.00 H new ATOM 0 HE2 PHE A 103 1.915 0.250 -4.373 1.00 0.00 H new ATOM 0 HZ PHE A 103 0.761 0.427 -2.185 1.00 0.00 H new ATOM 1627 N THR A 104 -1.872 5.720 -8.143 1.00 0.00 N ATOM 1628 CA THR A 104 -1.952 6.861 -9.101 1.00 0.00 C ATOM 1629 C THR A 104 -3.249 7.642 -8.880 1.00 0.00 C ATOM 1630 O THR A 104 -3.244 8.855 -8.801 1.00 0.00 O ATOM 1631 CB THR A 104 -1.919 6.325 -10.534 1.00 0.00 C ATOM 1632 OG1 THR A 104 -1.069 5.188 -10.594 1.00 0.00 O ATOM 1633 CG2 THR A 104 -1.390 7.410 -11.474 1.00 0.00 C ATOM 0 H THR A 104 -2.109 4.808 -8.534 1.00 0.00 H new ATOM 0 HA THR A 104 -1.103 7.525 -8.936 1.00 0.00 H new ATOM 0 HB THR A 104 -2.926 6.042 -10.840 1.00 0.00 H new ATOM 0 HG1 THR A 104 -1.049 4.843 -11.511 1.00 0.00 H new ATOM 0 HG21 THR A 104 -1.367 7.028 -12.494 1.00 0.00 H new ATOM 0 HG22 THR A 104 -2.043 8.281 -11.428 1.00 0.00 H new ATOM 0 HG23 THR A 104 -0.383 7.695 -11.170 1.00 0.00 H new ATOM 1641 N ALA A 105 -4.361 6.963 -8.792 1.00 0.00 N ATOM 1642 CA ALA A 105 -5.657 7.676 -8.592 1.00 0.00 C ATOM 1643 C ALA A 105 -5.629 8.469 -7.282 1.00 0.00 C ATOM 1644 O ALA A 105 -6.262 9.500 -7.164 1.00 0.00 O ATOM 1645 CB ALA A 105 -6.797 6.657 -8.540 1.00 0.00 C ATOM 0 H ALA A 105 -4.429 5.947 -8.850 1.00 0.00 H new ATOM 0 HA ALA A 105 -5.813 8.364 -9.423 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -7.744 7.177 -8.394 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -6.830 6.100 -9.476 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -6.631 5.967 -7.713 1.00 0.00 H new ATOM 1651 N PHE A 106 -4.916 7.997 -6.295 1.00 0.00 N ATOM 1652 CA PHE A 106 -4.868 8.732 -4.995 1.00 0.00 C ATOM 1653 C PHE A 106 -3.582 9.564 -4.899 1.00 0.00 C ATOM 1654 O PHE A 106 -3.351 10.248 -3.919 1.00 0.00 O ATOM 1655 CB PHE A 106 -4.901 7.726 -3.844 1.00 0.00 C ATOM 1656 CG PHE A 106 -6.278 7.115 -3.742 1.00 0.00 C ATOM 1657 CD1 PHE A 106 -6.659 6.100 -4.625 1.00 0.00 C ATOM 1658 CD2 PHE A 106 -7.169 7.561 -2.762 1.00 0.00 C ATOM 1659 CE1 PHE A 106 -7.933 5.530 -4.528 1.00 0.00 C ATOM 1660 CE2 PHE A 106 -8.442 6.991 -2.664 1.00 0.00 C ATOM 1661 CZ PHE A 106 -8.824 5.976 -3.547 1.00 0.00 C ATOM 0 H PHE A 106 -4.367 7.138 -6.331 1.00 0.00 H new ATOM 0 HA PHE A 106 -5.728 9.399 -4.935 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -4.158 6.946 -4.009 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -4.642 8.221 -2.908 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -5.970 5.756 -5.382 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -6.874 8.346 -2.081 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -8.228 4.746 -5.210 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -9.130 7.335 -1.906 1.00 0.00 H new ATOM 0 HZ PHE A 106 -9.808 5.536 -3.471 1.00 0.00 H new ATOM 1671 N LYS A 107 -2.729 9.496 -5.888 1.00 0.00 N ATOM 1672 CA LYS A 107 -1.454 10.269 -5.826 1.00 0.00 C ATOM 1673 C LYS A 107 -1.735 11.766 -5.603 1.00 0.00 C ATOM 1674 O LYS A 107 -1.011 12.431 -4.892 1.00 0.00 O ATOM 1675 CB LYS A 107 -0.656 10.064 -7.123 1.00 0.00 C ATOM 1676 CG LYS A 107 -1.344 10.767 -8.298 1.00 0.00 C ATOM 1677 CD LYS A 107 -0.636 12.095 -8.583 1.00 0.00 C ATOM 1678 CE LYS A 107 -1.642 13.113 -9.127 1.00 0.00 C ATOM 1679 NZ LYS A 107 -1.177 13.617 -10.452 1.00 0.00 N ATOM 0 H LYS A 107 -2.860 8.940 -6.733 1.00 0.00 H new ATOM 0 HA LYS A 107 -0.866 9.904 -4.984 1.00 0.00 H new ATOM 0 HB2 LYS A 107 0.354 10.454 -7.000 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -0.563 8.999 -7.334 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -1.317 10.131 -9.183 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -2.394 10.945 -8.065 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -0.177 12.476 -7.671 1.00 0.00 H new ATOM 0 HD3 LYS A 107 0.167 11.942 -9.304 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -2.624 12.651 -9.227 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -1.749 13.943 -8.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -1.861 14.308 -10.820 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -0.249 14.073 -10.344 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -1.097 12.822 -11.117 1.00 0.00 H new ATOM 1693 N ASP A 108 -2.768 12.307 -6.197 1.00 0.00 N ATOM 1694 CA ASP A 108 -3.062 13.762 -6.010 1.00 0.00 C ATOM 1695 C ASP A 108 -3.520 14.044 -4.573 1.00 0.00 C ATOM 1696 O ASP A 108 -3.211 15.077 -4.010 1.00 0.00 O ATOM 1697 CB ASP A 108 -4.167 14.179 -6.981 1.00 0.00 C ATOM 1698 CG ASP A 108 -4.073 15.682 -7.250 1.00 0.00 C ATOM 1699 OD1 ASP A 108 -3.060 16.106 -7.781 1.00 0.00 O ATOM 1700 OD2 ASP A 108 -5.015 16.383 -6.921 1.00 0.00 O ATOM 0 H ASP A 108 -3.419 11.807 -6.802 1.00 0.00 H new ATOM 0 HA ASP A 108 -2.153 14.331 -6.205 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -4.072 13.625 -7.915 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -5.144 13.934 -6.563 1.00 0.00 H new ATOM 1705 N ASP A 109 -4.267 13.151 -3.982 1.00 0.00 N ATOM 1706 CA ASP A 109 -4.756 13.382 -2.588 1.00 0.00 C ATOM 1707 C ASP A 109 -3.976 12.496 -1.615 1.00 0.00 C ATOM 1708 O ASP A 109 -4.402 11.406 -1.285 1.00 0.00 O ATOM 1709 CB ASP A 109 -6.248 13.038 -2.503 1.00 0.00 C ATOM 1710 CG ASP A 109 -7.044 14.289 -2.124 1.00 0.00 C ATOM 1711 OD1 ASP A 109 -6.918 15.281 -2.823 1.00 0.00 O ATOM 1712 OD2 ASP A 109 -7.766 14.233 -1.142 1.00 0.00 O ATOM 0 H ASP A 109 -4.561 12.270 -4.403 1.00 0.00 H new ATOM 0 HA ASP A 109 -4.607 14.429 -2.325 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -6.597 12.649 -3.460 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -6.409 12.254 -1.763 1.00 0.00 H new ATOM 1717 N VAL A 110 -2.840 12.949 -1.146 1.00 0.00 N ATOM 1718 CA VAL A 110 -2.050 12.120 -0.189 1.00 0.00 C ATOM 1719 C VAL A 110 -1.897 12.867 1.138 1.00 0.00 C ATOM 1720 O VAL A 110 -1.871 14.082 1.182 1.00 0.00 O ATOM 1721 CB VAL A 110 -0.657 11.847 -0.759 1.00 0.00 C ATOM 1722 CG1 VAL A 110 0.000 10.719 0.037 1.00 0.00 C ATOM 1723 CG2 VAL A 110 -0.766 11.440 -2.229 1.00 0.00 C ATOM 0 H VAL A 110 -2.429 13.852 -1.384 1.00 0.00 H new ATOM 0 HA VAL A 110 -2.574 11.178 -0.029 1.00 0.00 H new ATOM 0 HB VAL A 110 -0.052 12.751 -0.685 1.00 0.00 H new ATOM 0 HG11 VAL A 110 0.993 10.520 -0.365 1.00 0.00 H new ATOM 0 HG12 VAL A 110 0.084 11.013 1.083 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -0.609 9.818 -0.038 1.00 0.00 H new ATOM 0 HG21 VAL A 110 0.230 11.247 -2.628 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.371 10.537 -2.313 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -1.234 12.245 -2.796 1.00 0.00 H new ATOM 1733 N ASP A 111 -1.789 12.143 2.218 1.00 0.00 N ATOM 1734 CA ASP A 111 -1.624 12.790 3.551 1.00 0.00 C ATOM 1735 C ASP A 111 -0.411 12.172 4.254 1.00 0.00 C ATOM 1736 O ASP A 111 0.320 12.840 4.959 1.00 0.00 O ATOM 1737 CB ASP A 111 -2.882 12.556 4.394 1.00 0.00 C ATOM 1738 CG ASP A 111 -3.689 13.853 4.482 1.00 0.00 C ATOM 1739 OD1 ASP A 111 -3.372 14.669 5.332 1.00 0.00 O ATOM 1740 OD2 ASP A 111 -4.611 14.009 3.698 1.00 0.00 O ATOM 0 H ASP A 111 -1.808 11.123 2.234 1.00 0.00 H new ATOM 0 HA ASP A 111 -1.472 13.862 3.427 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -3.489 11.768 3.949 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -2.605 12.219 5.393 1.00 0.00 H new ATOM 1745 N THR A 112 -0.196 10.897 4.060 1.00 0.00 N ATOM 1746 CA THR A 112 0.965 10.218 4.703 1.00 0.00 C ATOM 1747 C THR A 112 1.572 9.227 3.706 1.00 0.00 C ATOM 1748 O THR A 112 0.885 8.690 2.860 1.00 0.00 O ATOM 1749 CB THR A 112 0.490 9.467 5.950 1.00 0.00 C ATOM 1750 OG1 THR A 112 -0.319 10.328 6.740 1.00 0.00 O ATOM 1751 CG2 THR A 112 1.698 9.005 6.768 1.00 0.00 C ATOM 0 H THR A 112 -0.779 10.294 3.480 1.00 0.00 H new ATOM 0 HA THR A 112 1.714 10.955 4.993 1.00 0.00 H new ATOM 0 HB THR A 112 -0.091 8.596 5.647 1.00 0.00 H new ATOM 0 HG1 THR A 112 -0.625 9.848 7.538 1.00 0.00 H new ATOM 0 HG21 THR A 112 1.355 8.471 7.654 1.00 0.00 H new ATOM 0 HG22 THR A 112 2.316 8.342 6.162 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.285 9.872 7.071 1.00 0.00 H new ATOM 1759 N LEU A 113 2.851 8.977 3.797 1.00 0.00 N ATOM 1760 CA LEU A 113 3.491 8.017 2.849 1.00 0.00 C ATOM 1761 C LEU A 113 4.337 7.011 3.631 1.00 0.00 C ATOM 1762 O LEU A 113 5.174 7.380 4.430 1.00 0.00 O ATOM 1763 CB LEU A 113 4.387 8.778 1.868 1.00 0.00 C ATOM 1764 CG LEU A 113 3.529 9.679 0.978 1.00 0.00 C ATOM 1765 CD1 LEU A 113 4.388 10.817 0.422 1.00 0.00 C ATOM 1766 CD2 LEU A 113 2.960 8.856 -0.183 1.00 0.00 C ATOM 0 H LEU A 113 3.479 9.394 4.484 1.00 0.00 H new ATOM 0 HA LEU A 113 2.714 7.489 2.296 1.00 0.00 H new ATOM 0 HB2 LEU A 113 5.114 9.378 2.415 1.00 0.00 H new ATOM 0 HB3 LEU A 113 4.950 8.075 1.255 1.00 0.00 H new ATOM 0 HG LEU A 113 2.711 10.096 1.565 1.00 0.00 H new ATOM 0 HD11 LEU A 113 3.776 11.458 -0.212 1.00 0.00 H new ATOM 0 HD12 LEU A 113 4.794 11.403 1.247 1.00 0.00 H new ATOM 0 HD13 LEU A 113 5.207 10.401 -0.165 1.00 0.00 H new ATOM 0 HD21 LEU A 113 2.348 9.497 -0.818 1.00 0.00 H new ATOM 0 HD22 LEU A 113 3.779 8.439 -0.769 1.00 0.00 H new ATOM 0 HD23 LEU A 113 2.347 8.045 0.212 1.00 0.00 H new ATOM 1778 N LEU A 114 4.131 5.741 3.399 1.00 0.00 N ATOM 1779 CA LEU A 114 4.926 4.706 4.120 1.00 0.00 C ATOM 1780 C LEU A 114 5.614 3.806 3.090 1.00 0.00 C ATOM 1781 O LEU A 114 5.010 2.921 2.516 1.00 0.00 O ATOM 1782 CB LEU A 114 3.994 3.876 5.005 1.00 0.00 C ATOM 1783 CG LEU A 114 3.187 4.812 5.910 1.00 0.00 C ATOM 1784 CD1 LEU A 114 1.859 4.150 6.287 1.00 0.00 C ATOM 1785 CD2 LEU A 114 3.988 5.108 7.180 1.00 0.00 C ATOM 0 H LEU A 114 3.444 5.376 2.739 1.00 0.00 H new ATOM 0 HA LEU A 114 5.680 5.180 4.748 1.00 0.00 H new ATOM 0 HB2 LEU A 114 3.322 3.281 4.387 1.00 0.00 H new ATOM 0 HB3 LEU A 114 4.574 3.178 5.609 1.00 0.00 H new ATOM 0 HG LEU A 114 2.987 5.743 5.379 1.00 0.00 H new ATOM 0 HD11 LEU A 114 1.289 4.820 6.931 1.00 0.00 H new ATOM 0 HD12 LEU A 114 1.287 3.941 5.383 1.00 0.00 H new ATOM 0 HD13 LEU A 114 2.055 3.217 6.816 1.00 0.00 H new ATOM 0 HD21 LEU A 114 3.415 5.774 7.825 1.00 0.00 H new ATOM 0 HD22 LEU A 114 4.190 4.176 7.708 1.00 0.00 H new ATOM 0 HD23 LEU A 114 4.931 5.585 6.913 1.00 0.00 H new ATOM 1797 N VAL A 115 6.870 4.053 2.836 1.00 0.00 N ATOM 1798 CA VAL A 115 7.599 3.238 1.820 1.00 0.00 C ATOM 1799 C VAL A 115 8.740 2.440 2.461 1.00 0.00 C ATOM 1800 O VAL A 115 9.467 2.931 3.303 1.00 0.00 O ATOM 1801 CB VAL A 115 8.164 4.167 0.740 1.00 0.00 C ATOM 1802 CG1 VAL A 115 9.197 5.118 1.355 1.00 0.00 C ATOM 1803 CG2 VAL A 115 8.827 3.326 -0.353 1.00 0.00 C ATOM 0 H VAL A 115 7.423 4.782 3.286 1.00 0.00 H new ATOM 0 HA VAL A 115 6.898 2.530 1.378 1.00 0.00 H new ATOM 0 HB VAL A 115 7.353 4.755 0.310 1.00 0.00 H new ATOM 0 HG11 VAL A 115 9.593 5.775 0.581 1.00 0.00 H new ATOM 0 HG12 VAL A 115 8.722 5.718 2.131 1.00 0.00 H new ATOM 0 HG13 VAL A 115 10.011 4.539 1.791 1.00 0.00 H new ATOM 0 HG21 VAL A 115 9.230 3.983 -1.123 1.00 0.00 H new ATOM 0 HG22 VAL A 115 9.635 2.737 0.081 1.00 0.00 H new ATOM 0 HG23 VAL A 115 8.089 2.658 -0.796 1.00 0.00 H new ATOM 1813 N THR A 116 8.906 1.211 2.042 1.00 0.00 N ATOM 1814 CA THR A 116 10.003 0.362 2.590 1.00 0.00 C ATOM 1815 C THR A 116 11.096 0.222 1.526 1.00 0.00 C ATOM 1816 O THR A 116 10.851 -0.265 0.439 1.00 0.00 O ATOM 1817 CB THR A 116 9.465 -1.032 2.936 1.00 0.00 C ATOM 1818 OG1 THR A 116 8.148 -0.928 3.459 1.00 0.00 O ATOM 1819 CG2 THR A 116 10.378 -1.688 3.973 1.00 0.00 C ATOM 0 H THR A 116 8.323 0.758 1.338 1.00 0.00 H new ATOM 0 HA THR A 116 10.404 0.826 3.491 1.00 0.00 H new ATOM 0 HB THR A 116 9.442 -1.641 2.032 1.00 0.00 H new ATOM 0 HG1 THR A 116 7.811 -1.822 3.676 1.00 0.00 H new ATOM 0 HG21 THR A 116 9.996 -2.679 4.219 1.00 0.00 H new ATOM 0 HG22 THR A 116 11.385 -1.778 3.566 1.00 0.00 H new ATOM 0 HG23 THR A 116 10.404 -1.075 4.874 1.00 0.00 H new ATOM 1827 N ARG A 117 12.295 0.645 1.824 1.00 0.00 N ATOM 1828 CA ARG A 117 13.393 0.534 0.819 1.00 0.00 C ATOM 1829 C ARG A 117 14.278 -0.670 1.152 1.00 0.00 C ATOM 1830 O ARG A 117 14.978 -0.683 2.146 1.00 0.00 O ATOM 1831 CB ARG A 117 14.237 1.811 0.840 1.00 0.00 C ATOM 1832 CG ARG A 117 13.700 2.795 -0.203 1.00 0.00 C ATOM 1833 CD ARG A 117 14.781 3.825 -0.543 1.00 0.00 C ATOM 1834 NE ARG A 117 14.195 5.198 -0.492 1.00 0.00 N ATOM 1835 CZ ARG A 117 13.601 5.718 -1.541 1.00 0.00 C ATOM 1836 NH1 ARG A 117 13.491 5.043 -2.658 1.00 0.00 N ATOM 1837 NH2 ARG A 117 13.103 6.922 -1.467 1.00 0.00 N ATOM 0 H ARG A 117 12.562 1.061 2.716 1.00 0.00 H new ATOM 0 HA ARG A 117 12.961 0.400 -0.173 1.00 0.00 H new ATOM 0 HB2 ARG A 117 14.207 2.263 1.831 1.00 0.00 H new ATOM 0 HB3 ARG A 117 15.280 1.574 0.629 1.00 0.00 H new ATOM 0 HG2 ARG A 117 13.399 2.258 -1.103 1.00 0.00 H new ATOM 0 HG3 ARG A 117 12.812 3.298 0.180 1.00 0.00 H new ATOM 0 HD2 ARG A 117 15.609 3.745 0.162 1.00 0.00 H new ATOM 0 HD3 ARG A 117 15.187 3.628 -1.535 1.00 0.00 H new ATOM 0 HE ARG A 117 14.257 5.739 0.370 1.00 0.00 H new ATOM 0 HH11 ARG A 117 13.870 4.098 -2.722 1.00 0.00 H new ATOM 0 HH12 ARG A 117 13.026 5.462 -3.464 1.00 0.00 H new ATOM 0 HH21 ARG A 117 13.177 7.452 -0.599 1.00 0.00 H new ATOM 0 HH22 ARG A 117 12.640 7.333 -2.278 1.00 0.00 H new ATOM 1851 N LEU A 118 14.251 -1.683 0.325 1.00 0.00 N ATOM 1852 CA LEU A 118 15.088 -2.890 0.589 1.00 0.00 C ATOM 1853 C LEU A 118 16.515 -2.633 0.103 1.00 0.00 C ATOM 1854 O LEU A 118 16.746 -1.824 -0.774 1.00 0.00 O ATOM 1855 CB LEU A 118 14.507 -4.092 -0.162 1.00 0.00 C ATOM 1856 CG LEU A 118 13.229 -4.567 0.531 1.00 0.00 C ATOM 1857 CD1 LEU A 118 12.090 -3.590 0.234 1.00 0.00 C ATOM 1858 CD2 LEU A 118 12.855 -5.958 0.011 1.00 0.00 C ATOM 0 H LEU A 118 13.685 -1.726 -0.522 1.00 0.00 H new ATOM 0 HA LEU A 118 15.096 -3.099 1.659 1.00 0.00 H new ATOM 0 HB2 LEU A 118 14.291 -3.818 -1.195 1.00 0.00 H new ATOM 0 HB3 LEU A 118 15.237 -4.901 -0.193 1.00 0.00 H new ATOM 0 HG LEU A 118 13.396 -4.612 1.607 1.00 0.00 H new ATOM 0 HD11 LEU A 118 11.180 -3.930 0.729 1.00 0.00 H new ATOM 0 HD12 LEU A 118 12.355 -2.599 0.603 1.00 0.00 H new ATOM 0 HD13 LEU A 118 11.922 -3.543 -0.842 1.00 0.00 H new ATOM 0 HD21 LEU A 118 11.944 -6.298 0.504 1.00 0.00 H new ATOM 0 HD22 LEU A 118 12.689 -5.912 -1.065 1.00 0.00 H new ATOM 0 HD23 LEU A 118 13.665 -6.656 0.224 1.00 0.00 H new ATOM 1870 N ALA A 119 17.476 -3.315 0.668 1.00 0.00 N ATOM 1871 CA ALA A 119 18.889 -3.110 0.242 1.00 0.00 C ATOM 1872 C ALA A 119 19.157 -3.890 -1.046 1.00 0.00 C ATOM 1873 O ALA A 119 19.967 -3.495 -1.862 1.00 0.00 O ATOM 1874 CB ALA A 119 19.832 -3.603 1.342 1.00 0.00 C ATOM 0 H ALA A 119 17.342 -4.006 1.407 1.00 0.00 H new ATOM 0 HA ALA A 119 19.061 -2.048 0.064 1.00 0.00 H new ATOM 0 HB1 ALA A 119 20.865 -3.453 1.030 1.00 0.00 H new ATOM 0 HB2 ALA A 119 19.645 -3.044 2.259 1.00 0.00 H new ATOM 0 HB3 ALA A 119 19.658 -4.664 1.522 1.00 0.00 H new ATOM 1880 N GLY A 120 18.486 -4.996 -1.236 1.00 0.00 N ATOM 1881 CA GLY A 120 18.708 -5.798 -2.474 1.00 0.00 C ATOM 1882 C GLY A 120 18.075 -5.083 -3.670 1.00 0.00 C ATOM 1883 O GLY A 120 17.300 -4.160 -3.513 1.00 0.00 O ATOM 0 H GLY A 120 17.796 -5.377 -0.589 1.00 0.00 H new ATOM 0 HA2 GLY A 120 19.776 -5.936 -2.643 1.00 0.00 H new ATOM 0 HA3 GLY A 120 18.273 -6.791 -2.359 1.00 0.00 H new ATOM 1887 N SER A 121 18.397 -5.506 -4.863 1.00 0.00 N ATOM 1888 CA SER A 121 17.815 -4.857 -6.073 1.00 0.00 C ATOM 1889 C SER A 121 17.087 -5.909 -6.911 1.00 0.00 C ATOM 1890 O SER A 121 17.685 -6.848 -7.399 1.00 0.00 O ATOM 1891 CB SER A 121 18.935 -4.229 -6.903 1.00 0.00 C ATOM 1892 OG SER A 121 19.724 -5.260 -7.481 1.00 0.00 O ATOM 0 H SER A 121 19.040 -6.275 -5.052 1.00 0.00 H new ATOM 0 HA SER A 121 17.111 -4.082 -5.769 1.00 0.00 H new ATOM 0 HB2 SER A 121 18.514 -3.596 -7.684 1.00 0.00 H new ATOM 0 HB3 SER A 121 19.555 -3.590 -6.274 1.00 0.00 H new ATOM 0 HG SER A 121 19.142 -5.991 -7.776 1.00 0.00 H new ATOM 1898 N PHE A 122 15.799 -5.766 -7.074 1.00 0.00 N ATOM 1899 CA PHE A 122 15.028 -6.762 -7.870 1.00 0.00 C ATOM 1900 C PHE A 122 14.530 -6.116 -9.166 1.00 0.00 C ATOM 1901 O PHE A 122 14.481 -4.907 -9.289 1.00 0.00 O ATOM 1902 CB PHE A 122 13.836 -7.256 -7.047 1.00 0.00 C ATOM 1903 CG PHE A 122 14.321 -7.725 -5.695 1.00 0.00 C ATOM 1904 CD1 PHE A 122 14.554 -6.795 -4.675 1.00 0.00 C ATOM 1905 CD2 PHE A 122 14.541 -9.088 -5.462 1.00 0.00 C ATOM 1906 CE1 PHE A 122 15.006 -7.227 -3.421 1.00 0.00 C ATOM 1907 CE2 PHE A 122 14.993 -9.521 -4.208 1.00 0.00 C ATOM 1908 CZ PHE A 122 15.225 -8.589 -3.187 1.00 0.00 C ATOM 0 H PHE A 122 15.247 -5.000 -6.689 1.00 0.00 H new ATOM 0 HA PHE A 122 15.673 -7.605 -8.118 1.00 0.00 H new ATOM 0 HB2 PHE A 122 13.106 -6.455 -6.926 1.00 0.00 H new ATOM 0 HB3 PHE A 122 13.333 -8.070 -7.568 1.00 0.00 H new ATOM 0 HD1 PHE A 122 14.385 -5.744 -4.855 1.00 0.00 H new ATOM 0 HD2 PHE A 122 14.362 -9.806 -6.249 1.00 0.00 H new ATOM 0 HE1 PHE A 122 15.185 -6.508 -2.635 1.00 0.00 H new ATOM 0 HE2 PHE A 122 15.162 -10.572 -4.028 1.00 0.00 H new ATOM 0 HZ PHE A 122 15.573 -8.922 -2.220 1.00 0.00 H new ATOM 1918 N GLU A 123 14.153 -6.915 -10.129 1.00 0.00 N ATOM 1919 CA GLU A 123 13.650 -6.353 -11.418 1.00 0.00 C ATOM 1920 C GLU A 123 12.191 -6.769 -11.627 1.00 0.00 C ATOM 1921 O GLU A 123 11.687 -7.657 -10.966 1.00 0.00 O ATOM 1922 CB GLU A 123 14.507 -6.871 -12.577 1.00 0.00 C ATOM 1923 CG GLU A 123 14.475 -8.403 -12.605 1.00 0.00 C ATOM 1924 CD GLU A 123 13.657 -8.876 -13.808 1.00 0.00 C ATOM 1925 OE1 GLU A 123 12.444 -8.930 -13.691 1.00 0.00 O ATOM 1926 OE2 GLU A 123 14.258 -9.176 -14.827 1.00 0.00 O ATOM 0 H GLU A 123 14.172 -7.934 -10.079 1.00 0.00 H new ATOM 0 HA GLU A 123 13.712 -5.265 -11.385 1.00 0.00 H new ATOM 0 HB2 GLU A 123 14.135 -6.473 -13.521 1.00 0.00 H new ATOM 0 HB3 GLU A 123 15.534 -6.522 -12.466 1.00 0.00 H new ATOM 0 HG2 GLU A 123 15.489 -8.797 -12.664 1.00 0.00 H new ATOM 0 HG3 GLU A 123 14.038 -8.785 -11.682 1.00 0.00 H new ATOM 1933 N GLY A 124 11.510 -6.133 -12.545 1.00 0.00 N ATOM 1934 CA GLY A 124 10.081 -6.482 -12.807 1.00 0.00 C ATOM 1935 C GLY A 124 9.535 -5.554 -13.895 1.00 0.00 C ATOM 1936 O GLY A 124 10.268 -5.100 -14.753 1.00 0.00 O ATOM 0 H GLY A 124 11.884 -5.383 -13.127 1.00 0.00 H new ATOM 0 HA2 GLY A 124 9.999 -7.522 -13.123 1.00 0.00 H new ATOM 0 HA3 GLY A 124 9.494 -6.379 -11.894 1.00 0.00 H new ATOM 1940 N ASP A 125 8.260 -5.259 -13.873 1.00 0.00 N ATOM 1941 CA ASP A 125 7.679 -4.348 -14.904 1.00 0.00 C ATOM 1942 C ASP A 125 6.693 -3.379 -14.229 1.00 0.00 C ATOM 1943 O ASP A 125 6.263 -2.406 -14.819 1.00 0.00 O ATOM 1944 CB ASP A 125 6.941 -5.172 -15.960 1.00 0.00 C ATOM 1945 CG ASP A 125 7.862 -5.414 -17.157 1.00 0.00 C ATOM 1946 OD1 ASP A 125 8.034 -4.496 -17.942 1.00 0.00 O ATOM 1947 OD2 ASP A 125 8.381 -6.512 -17.268 1.00 0.00 O ATOM 0 H ASP A 125 7.595 -5.611 -13.184 1.00 0.00 H new ATOM 0 HA ASP A 125 8.479 -3.783 -15.382 1.00 0.00 H new ATOM 0 HB2 ASP A 125 6.622 -6.124 -15.536 1.00 0.00 H new ATOM 0 HB3 ASP A 125 6.041 -4.648 -16.281 1.00 0.00 H new ATOM 1952 N THR A 126 6.336 -3.640 -12.995 1.00 0.00 N ATOM 1953 CA THR A 126 5.389 -2.743 -12.276 1.00 0.00 C ATOM 1954 C THR A 126 6.156 -1.990 -11.193 1.00 0.00 C ATOM 1955 O THR A 126 6.735 -2.586 -10.300 1.00 0.00 O ATOM 1956 CB THR A 126 4.279 -3.570 -11.624 1.00 0.00 C ATOM 1957 OG1 THR A 126 4.060 -4.751 -12.383 1.00 0.00 O ATOM 1958 CG2 THR A 126 2.986 -2.752 -11.570 1.00 0.00 C ATOM 0 H THR A 126 6.664 -4.441 -12.455 1.00 0.00 H new ATOM 0 HA THR A 126 4.943 -2.042 -12.981 1.00 0.00 H new ATOM 0 HB THR A 126 4.578 -3.837 -10.610 1.00 0.00 H new ATOM 0 HG1 THR A 126 3.350 -5.282 -11.965 1.00 0.00 H new ATOM 0 HG21 THR A 126 2.199 -3.346 -11.105 1.00 0.00 H new ATOM 0 HG22 THR A 126 3.152 -1.847 -10.985 1.00 0.00 H new ATOM 0 HG23 THR A 126 2.685 -2.480 -12.582 1.00 0.00 H new ATOM 1966 N LYS A 127 6.175 -0.688 -11.269 1.00 0.00 N ATOM 1967 CA LYS A 127 6.913 0.105 -10.250 1.00 0.00 C ATOM 1968 C LYS A 127 5.970 1.118 -9.607 1.00 0.00 C ATOM 1969 O LYS A 127 4.926 1.440 -10.141 1.00 0.00 O ATOM 1970 CB LYS A 127 8.077 0.838 -10.919 1.00 0.00 C ATOM 1971 CG LYS A 127 9.187 -0.164 -11.237 1.00 0.00 C ATOM 1972 CD LYS A 127 10.547 0.527 -11.132 1.00 0.00 C ATOM 1973 CE LYS A 127 11.523 -0.118 -12.118 1.00 0.00 C ATOM 1974 NZ LYS A 127 12.889 0.445 -11.916 1.00 0.00 N ATOM 0 H LYS A 127 5.711 -0.140 -11.993 1.00 0.00 H new ATOM 0 HA LYS A 127 7.300 -0.564 -9.481 1.00 0.00 H new ATOM 0 HB2 LYS A 127 7.738 1.325 -11.833 1.00 0.00 H new ATOM 0 HB3 LYS A 127 8.455 1.621 -10.262 1.00 0.00 H new ATOM 0 HG2 LYS A 127 9.141 -1.005 -10.545 1.00 0.00 H new ATOM 0 HG3 LYS A 127 9.050 -0.568 -12.240 1.00 0.00 H new ATOM 0 HD2 LYS A 127 10.444 1.590 -11.348 1.00 0.00 H new ATOM 0 HD3 LYS A 127 10.932 0.444 -10.116 1.00 0.00 H new ATOM 0 HE2 LYS A 127 11.540 -1.198 -11.974 1.00 0.00 H new ATOM 0 HE3 LYS A 127 11.193 0.062 -13.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 13.278 0.748 -12.831 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 12.836 1.262 -11.274 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 13.506 -0.282 -11.501 1.00 0.00 H new ATOM 1988 N MET A 128 6.336 1.623 -8.463 1.00 0.00 N ATOM 1989 CA MET A 128 5.471 2.613 -7.770 1.00 0.00 C ATOM 1990 C MET A 128 5.324 3.865 -8.636 1.00 0.00 C ATOM 1991 O MET A 128 6.160 4.160 -9.466 1.00 0.00 O ATOM 1992 CB MET A 128 6.111 2.987 -6.434 1.00 0.00 C ATOM 1993 CG MET A 128 5.018 3.372 -5.438 1.00 0.00 C ATOM 1994 SD MET A 128 4.928 5.173 -5.307 1.00 0.00 S ATOM 1995 CE MET A 128 3.552 5.230 -4.139 1.00 0.00 C ATOM 0 H MET A 128 7.202 1.390 -7.977 1.00 0.00 H new ATOM 0 HA MET A 128 4.485 2.180 -7.598 1.00 0.00 H new ATOM 0 HB2 MET A 128 6.691 2.148 -6.048 1.00 0.00 H new ATOM 0 HB3 MET A 128 6.804 3.818 -6.570 1.00 0.00 H new ATOM 0 HG2 MET A 128 4.058 2.972 -5.763 1.00 0.00 H new ATOM 0 HG3 MET A 128 5.231 2.936 -4.462 1.00 0.00 H new ATOM 0 HE1 MET A 128 2.816 5.959 -4.479 1.00 0.00 H new ATOM 0 HE2 MET A 128 3.086 4.246 -4.077 1.00 0.00 H new ATOM 0 HE3 MET A 128 3.922 5.519 -3.155 1.00 0.00 H new ATOM 2005 N ILE A 129 4.259 4.598 -8.451 1.00 0.00 N ATOM 2006 CA ILE A 129 4.038 5.829 -9.262 1.00 0.00 C ATOM 2007 C ILE A 129 5.002 6.929 -8.800 1.00 0.00 C ATOM 2008 O ILE A 129 5.637 6.799 -7.773 1.00 0.00 O ATOM 2009 CB ILE A 129 2.592 6.296 -9.065 1.00 0.00 C ATOM 2010 CG1 ILE A 129 2.334 6.548 -7.574 1.00 0.00 C ATOM 2011 CG2 ILE A 129 1.637 5.213 -9.569 1.00 0.00 C ATOM 2012 CD1 ILE A 129 1.633 7.897 -7.391 1.00 0.00 C ATOM 0 H ILE A 129 3.529 4.395 -7.769 1.00 0.00 H new ATOM 0 HA ILE A 129 4.219 5.617 -10.316 1.00 0.00 H new ATOM 0 HB ILE A 129 2.428 7.218 -9.623 1.00 0.00 H new ATOM 0 HG12 ILE A 129 1.718 5.749 -7.162 1.00 0.00 H new ATOM 0 HG13 ILE A 129 3.276 6.540 -7.026 1.00 0.00 H new ATOM 0 HG21 ILE A 129 0.607 5.543 -9.430 1.00 0.00 H new ATOM 0 HG22 ILE A 129 1.820 5.031 -10.628 1.00 0.00 H new ATOM 0 HG23 ILE A 129 1.802 4.293 -9.009 1.00 0.00 H new ATOM 0 HD11 ILE A 129 1.452 8.072 -6.331 1.00 0.00 H new ATOM 0 HD12 ILE A 129 2.265 8.692 -7.787 1.00 0.00 H new ATOM 0 HD13 ILE A 129 0.683 7.889 -7.925 1.00 0.00 H new ATOM 2024 N PRO A 130 5.080 7.984 -9.575 1.00 0.00 N ATOM 2025 CA PRO A 130 5.954 9.181 -9.324 1.00 0.00 C ATOM 2026 C PRO A 130 5.371 10.015 -8.181 1.00 0.00 C ATOM 2027 O PRO A 130 4.465 10.802 -8.375 1.00 0.00 O ATOM 2028 CB PRO A 130 5.977 9.997 -10.614 1.00 0.00 C ATOM 2029 CG PRO A 130 5.001 9.358 -11.581 1.00 0.00 C ATOM 2030 CD PRO A 130 4.319 8.205 -10.855 1.00 0.00 C ATOM 0 HA PRO A 130 6.963 8.879 -9.042 1.00 0.00 H new ATOM 0 HB2 PRO A 130 5.698 11.032 -10.417 1.00 0.00 H new ATOM 0 HB3 PRO A 130 6.981 10.013 -11.039 1.00 0.00 H new ATOM 0 HG2 PRO A 130 4.264 10.087 -11.919 1.00 0.00 H new ATOM 0 HG3 PRO A 130 5.522 8.997 -12.468 1.00 0.00 H new ATOM 0 HD2 PRO A 130 3.275 8.442 -10.648 1.00 0.00 H new ATOM 0 HD3 PRO A 130 4.325 7.304 -11.469 1.00 0.00 H new ATOM 2038 N LEU A 131 5.881 9.845 -6.990 1.00 0.00 N ATOM 2039 CA LEU A 131 5.354 10.627 -5.836 1.00 0.00 C ATOM 2040 C LEU A 131 6.159 11.919 -5.689 1.00 0.00 C ATOM 2041 O LEU A 131 7.277 12.020 -6.156 1.00 0.00 O ATOM 2042 CB LEU A 131 5.469 9.795 -4.557 1.00 0.00 C ATOM 2043 CG LEU A 131 4.159 9.041 -4.321 1.00 0.00 C ATOM 2044 CD1 LEU A 131 4.312 8.112 -3.114 1.00 0.00 C ATOM 2045 CD2 LEU A 131 3.031 10.045 -4.058 1.00 0.00 C ATOM 0 H LEU A 131 6.639 9.199 -6.768 1.00 0.00 H new ATOM 0 HA LEU A 131 4.306 10.872 -6.009 1.00 0.00 H new ATOM 0 HB2 LEU A 131 6.297 9.091 -4.642 1.00 0.00 H new ATOM 0 HB3 LEU A 131 5.687 10.442 -3.707 1.00 0.00 H new ATOM 0 HG LEU A 131 3.918 8.449 -5.204 1.00 0.00 H new ATOM 0 HD11 LEU A 131 3.378 7.576 -2.947 1.00 0.00 H new ATOM 0 HD12 LEU A 131 5.112 7.397 -3.304 1.00 0.00 H new ATOM 0 HD13 LEU A 131 4.555 8.701 -2.230 1.00 0.00 H new ATOM 0 HD21 LEU A 131 2.098 9.508 -3.890 1.00 0.00 H new ATOM 0 HD22 LEU A 131 3.271 10.640 -3.177 1.00 0.00 H new ATOM 0 HD23 LEU A 131 2.921 10.703 -4.920 1.00 0.00 H new ATOM 2057 N ASN A 132 5.592 12.915 -5.062 1.00 0.00 N ATOM 2058 CA ASN A 132 6.316 14.209 -4.904 1.00 0.00 C ATOM 2059 C ASN A 132 7.032 14.259 -3.550 1.00 0.00 C ATOM 2060 O ASN A 132 6.672 15.023 -2.679 1.00 0.00 O ATOM 2061 CB ASN A 132 5.312 15.361 -4.989 1.00 0.00 C ATOM 2062 CG ASN A 132 6.052 16.662 -5.302 1.00 0.00 C ATOM 2063 OD1 ASN A 132 6.952 17.050 -4.584 1.00 0.00 O ATOM 2064 ND2 ASN A 132 5.707 17.357 -6.351 1.00 0.00 N ATOM 0 H ASN A 132 4.658 12.888 -4.652 1.00 0.00 H new ATOM 0 HA ASN A 132 7.057 14.300 -5.698 1.00 0.00 H new ATOM 0 HB2 ASN A 132 4.572 15.156 -5.763 1.00 0.00 H new ATOM 0 HB3 ASN A 132 4.771 15.456 -4.048 1.00 0.00 H new ATOM 0 HD21 ASN A 132 6.193 18.227 -6.569 1.00 0.00 H new ATOM 0 HD22 ASN A 132 4.951 17.030 -6.953 1.00 0.00 H new ATOM 2071 N TRP A 133 8.043 13.451 -3.367 1.00 0.00 N ATOM 2072 CA TRP A 133 8.783 13.453 -2.067 1.00 0.00 C ATOM 2073 C TRP A 133 9.197 14.885 -1.706 1.00 0.00 C ATOM 2074 O TRP A 133 9.326 15.229 -0.548 1.00 0.00 O ATOM 2075 CB TRP A 133 10.034 12.578 -2.192 1.00 0.00 C ATOM 2076 CG TRP A 133 9.636 11.213 -2.650 1.00 0.00 C ATOM 2077 CD1 TRP A 133 9.688 10.778 -3.929 1.00 0.00 C ATOM 2078 CD2 TRP A 133 9.123 10.104 -1.860 1.00 0.00 C ATOM 2079 NE1 TRP A 133 9.232 9.473 -3.975 1.00 0.00 N ATOM 2080 CE2 TRP A 133 8.874 9.014 -2.724 1.00 0.00 C ATOM 2081 CE3 TRP A 133 8.850 9.940 -0.490 1.00 0.00 C ATOM 2082 CZ2 TRP A 133 8.371 7.804 -2.248 1.00 0.00 C ATOM 2083 CZ3 TRP A 133 8.344 8.723 -0.007 1.00 0.00 C ATOM 2084 CH2 TRP A 133 8.105 7.658 -0.885 1.00 0.00 C ATOM 0 H TRP A 133 8.390 12.789 -4.061 1.00 0.00 H new ATOM 0 HA TRP A 133 8.135 13.058 -1.284 1.00 0.00 H new ATOM 0 HB2 TRP A 133 10.734 13.022 -2.900 1.00 0.00 H new ATOM 0 HB3 TRP A 133 10.547 12.517 -1.232 1.00 0.00 H new ATOM 0 HD1 TRP A 133 10.030 11.355 -4.776 1.00 0.00 H new ATOM 0 HE1 TRP A 133 9.168 8.918 -4.829 1.00 0.00 H new ATOM 0 HE3 TRP A 133 9.031 10.755 0.195 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 8.188 6.986 -2.929 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 8.138 8.607 1.047 1.00 0.00 H new ATOM 0 HH2 TRP A 133 7.715 6.724 -0.508 1.00 0.00 H new ATOM 2095 N ASP A 134 9.405 15.719 -2.690 1.00 0.00 N ATOM 2096 CA ASP A 134 9.811 17.127 -2.410 1.00 0.00 C ATOM 2097 C ASP A 134 8.680 17.866 -1.684 1.00 0.00 C ATOM 2098 O ASP A 134 8.920 18.782 -0.921 1.00 0.00 O ATOM 2099 CB ASP A 134 10.124 17.841 -3.728 1.00 0.00 C ATOM 2100 CG ASP A 134 11.581 18.312 -3.722 1.00 0.00 C ATOM 2101 OD1 ASP A 134 11.865 19.283 -3.040 1.00 0.00 O ATOM 2102 OD2 ASP A 134 12.386 17.694 -4.398 1.00 0.00 O ATOM 0 H ASP A 134 9.311 15.485 -3.678 1.00 0.00 H new ATOM 0 HA ASP A 134 10.698 17.122 -1.777 1.00 0.00 H new ATOM 0 HB2 ASP A 134 9.952 17.168 -4.568 1.00 0.00 H new ATOM 0 HB3 ASP A 134 9.456 18.692 -3.860 1.00 0.00 H new ATOM 2107 N ASP A 135 7.451 17.480 -1.912 1.00 0.00 N ATOM 2108 CA ASP A 135 6.312 18.165 -1.232 1.00 0.00 C ATOM 2109 C ASP A 135 6.017 17.475 0.102 1.00 0.00 C ATOM 2110 O ASP A 135 5.267 17.977 0.917 1.00 0.00 O ATOM 2111 CB ASP A 135 5.069 18.098 -2.126 1.00 0.00 C ATOM 2112 CG ASP A 135 4.735 19.497 -2.646 1.00 0.00 C ATOM 2113 OD1 ASP A 135 4.292 20.312 -1.853 1.00 0.00 O ATOM 2114 OD2 ASP A 135 4.929 19.731 -3.827 1.00 0.00 O ATOM 0 H ASP A 135 7.187 16.720 -2.540 1.00 0.00 H new ATOM 0 HA ASP A 135 6.575 19.207 -1.049 1.00 0.00 H new ATOM 0 HB2 ASP A 135 5.246 17.421 -2.962 1.00 0.00 H new ATOM 0 HB3 ASP A 135 4.226 17.697 -1.564 1.00 0.00 H new ATOM 2119 N PHE A 136 6.612 16.338 0.338 1.00 0.00 N ATOM 2120 CA PHE A 136 6.380 15.630 1.624 1.00 0.00 C ATOM 2121 C PHE A 136 7.702 15.556 2.384 1.00 0.00 C ATOM 2122 O PHE A 136 8.766 15.748 1.822 1.00 0.00 O ATOM 2123 CB PHE A 136 5.861 14.215 1.357 1.00 0.00 C ATOM 2124 CG PHE A 136 4.481 14.283 0.746 1.00 0.00 C ATOM 2125 CD1 PHE A 136 4.321 14.738 -0.566 1.00 0.00 C ATOM 2126 CD2 PHE A 136 3.363 13.882 1.488 1.00 0.00 C ATOM 2127 CE1 PHE A 136 3.046 14.792 -1.139 1.00 0.00 C ATOM 2128 CE2 PHE A 136 2.087 13.937 0.916 1.00 0.00 C ATOM 2129 CZ PHE A 136 1.929 14.391 -0.398 1.00 0.00 C ATOM 0 H PHE A 136 7.249 15.870 -0.306 1.00 0.00 H new ATOM 0 HA PHE A 136 5.638 16.169 2.213 1.00 0.00 H new ATOM 0 HB2 PHE A 136 6.540 13.689 0.686 1.00 0.00 H new ATOM 0 HB3 PHE A 136 5.829 13.648 2.287 1.00 0.00 H new ATOM 0 HD1 PHE A 136 5.183 15.048 -1.138 1.00 0.00 H new ATOM 0 HD2 PHE A 136 3.486 13.530 2.502 1.00 0.00 H new ATOM 0 HE1 PHE A 136 2.924 15.143 -2.153 1.00 0.00 H new ATOM 0 HE2 PHE A 136 1.225 13.629 1.489 1.00 0.00 H new ATOM 0 HZ PHE A 136 0.945 14.432 -0.840 1.00 0.00 H new ATOM 2139 N THR A 137 7.644 15.267 3.652 1.00 0.00 N ATOM 2140 CA THR A 137 8.899 15.166 4.444 1.00 0.00 C ATOM 2141 C THR A 137 8.821 13.947 5.354 1.00 0.00 C ATOM 2142 O THR A 137 7.819 13.702 5.995 1.00 0.00 O ATOM 2143 CB THR A 137 9.095 16.432 5.282 1.00 0.00 C ATOM 2144 OG1 THR A 137 8.849 17.575 4.473 1.00 0.00 O ATOM 2145 CG2 THR A 137 10.532 16.480 5.808 1.00 0.00 C ATOM 0 H THR A 137 6.784 15.097 4.174 1.00 0.00 H new ATOM 0 HA THR A 137 9.747 15.061 3.767 1.00 0.00 H new ATOM 0 HB THR A 137 8.401 16.423 6.123 1.00 0.00 H new ATOM 0 HG1 THR A 137 9.504 18.273 4.685 1.00 0.00 H new ATOM 0 HG21 THR A 137 10.671 17.382 6.405 1.00 0.00 H new ATOM 0 HG22 THR A 137 10.723 15.603 6.426 1.00 0.00 H new ATOM 0 HG23 THR A 137 11.227 16.490 4.968 1.00 0.00 H new ATOM 2153 N LYS A 138 9.870 13.176 5.408 1.00 0.00 N ATOM 2154 CA LYS A 138 9.853 11.964 6.267 1.00 0.00 C ATOM 2155 C LYS A 138 9.862 12.397 7.732 1.00 0.00 C ATOM 2156 O LYS A 138 10.776 13.051 8.196 1.00 0.00 O ATOM 2157 CB LYS A 138 11.084 11.110 5.959 1.00 0.00 C ATOM 2158 CG LYS A 138 10.716 9.627 6.054 1.00 0.00 C ATOM 2159 CD LYS A 138 11.751 8.898 6.909 1.00 0.00 C ATOM 2160 CE LYS A 138 13.004 8.625 6.074 1.00 0.00 C ATOM 2161 NZ LYS A 138 14.165 9.336 6.678 1.00 0.00 N ATOM 0 H LYS A 138 10.737 13.334 4.894 1.00 0.00 H new ATOM 0 HA LYS A 138 8.957 11.375 6.072 1.00 0.00 H new ATOM 0 HB2 LYS A 138 11.458 11.339 4.961 1.00 0.00 H new ATOM 0 HB3 LYS A 138 11.885 11.342 6.661 1.00 0.00 H new ATOM 0 HG2 LYS A 138 9.724 9.515 6.491 1.00 0.00 H new ATOM 0 HG3 LYS A 138 10.677 9.187 5.058 1.00 0.00 H new ATOM 0 HD2 LYS A 138 12.007 9.500 7.781 1.00 0.00 H new ATOM 0 HD3 LYS A 138 11.337 7.960 7.279 1.00 0.00 H new ATOM 0 HE2 LYS A 138 13.201 7.554 6.033 1.00 0.00 H new ATOM 0 HE3 LYS A 138 12.851 8.961 5.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 15.049 8.948 6.291 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 14.105 10.350 6.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 14.153 9.207 7.710 1.00 0.00 H new ATOM 2175 N VAL A 139 8.836 12.044 8.457 1.00 0.00 N ATOM 2176 CA VAL A 139 8.755 12.436 9.892 1.00 0.00 C ATOM 2177 C VAL A 139 9.280 11.300 10.773 1.00 0.00 C ATOM 2178 O VAL A 139 9.721 11.520 11.884 1.00 0.00 O ATOM 2179 CB VAL A 139 7.296 12.732 10.253 1.00 0.00 C ATOM 2180 CG1 VAL A 139 6.802 13.931 9.440 1.00 0.00 C ATOM 2181 CG2 VAL A 139 6.428 11.508 9.936 1.00 0.00 C ATOM 0 H VAL A 139 8.046 11.498 8.114 1.00 0.00 H new ATOM 0 HA VAL A 139 9.363 13.325 10.058 1.00 0.00 H new ATOM 0 HB VAL A 139 7.226 12.959 11.317 1.00 0.00 H new ATOM 0 HG11 VAL A 139 5.764 14.142 9.697 1.00 0.00 H new ATOM 0 HG12 VAL A 139 7.416 14.802 9.667 1.00 0.00 H new ATOM 0 HG13 VAL A 139 6.874 13.704 8.376 1.00 0.00 H new ATOM 0 HG21 VAL A 139 5.391 11.721 10.194 1.00 0.00 H new ATOM 0 HG22 VAL A 139 6.498 11.278 8.873 1.00 0.00 H new ATOM 0 HG23 VAL A 139 6.778 10.654 10.516 1.00 0.00 H new ATOM 2191 N SER A 140 9.229 10.085 10.292 1.00 0.00 N ATOM 2192 CA SER A 140 9.718 8.941 11.113 1.00 0.00 C ATOM 2193 C SER A 140 10.363 7.893 10.204 1.00 0.00 C ATOM 2194 O SER A 140 9.866 7.590 9.137 1.00 0.00 O ATOM 2195 CB SER A 140 8.538 8.314 11.860 1.00 0.00 C ATOM 2196 OG SER A 140 8.676 8.569 13.251 1.00 0.00 O ATOM 0 H SER A 140 8.871 9.837 9.370 1.00 0.00 H new ATOM 0 HA SER A 140 10.457 9.298 11.830 1.00 0.00 H new ATOM 0 HB2 SER A 140 7.599 8.729 11.494 1.00 0.00 H new ATOM 0 HB3 SER A 140 8.505 7.240 11.677 1.00 0.00 H new ATOM 0 HG SER A 140 7.921 8.171 13.733 1.00 0.00 H new ATOM 2202 N SER A 141 11.468 7.335 10.626 1.00 0.00 N ATOM 2203 CA SER A 141 12.150 6.304 9.796 1.00 0.00 C ATOM 2204 C SER A 141 12.866 5.304 10.707 1.00 0.00 C ATOM 2205 O SER A 141 13.550 5.681 11.639 1.00 0.00 O ATOM 2206 CB SER A 141 13.173 6.977 8.879 1.00 0.00 C ATOM 2207 OG SER A 141 13.219 8.371 9.159 1.00 0.00 O ATOM 0 H SER A 141 11.926 7.551 11.511 1.00 0.00 H new ATOM 0 HA SER A 141 11.409 5.781 9.192 1.00 0.00 H new ATOM 0 HB2 SER A 141 14.157 6.533 9.028 1.00 0.00 H new ATOM 0 HB3 SER A 141 12.904 6.814 7.835 1.00 0.00 H new ATOM 0 HG SER A 141 14.124 8.618 9.443 1.00 0.00 H new ATOM 2213 N ARG A 142 12.722 4.033 10.443 1.00 0.00 N ATOM 2214 CA ARG A 142 13.401 3.007 11.284 1.00 0.00 C ATOM 2215 C ARG A 142 14.136 2.031 10.363 1.00 0.00 C ATOM 2216 O ARG A 142 13.578 1.547 9.399 1.00 0.00 O ATOM 2217 CB ARG A 142 12.356 2.249 12.107 1.00 0.00 C ATOM 2218 CG ARG A 142 13.051 1.473 13.226 1.00 0.00 C ATOM 2219 CD ARG A 142 12.108 1.341 14.424 1.00 0.00 C ATOM 2220 NE ARG A 142 12.489 2.341 15.466 1.00 0.00 N ATOM 2221 CZ ARG A 142 12.318 2.085 16.743 1.00 0.00 C ATOM 2222 NH1 ARG A 142 11.793 0.953 17.140 1.00 0.00 N ATOM 2223 NH2 ARG A 142 12.671 2.976 17.629 1.00 0.00 N ATOM 0 H ARG A 142 12.161 3.660 9.677 1.00 0.00 H new ATOM 0 HA ARG A 142 14.109 3.485 11.961 1.00 0.00 H new ATOM 0 HB2 ARG A 142 11.634 2.948 12.529 1.00 0.00 H new ATOM 0 HB3 ARG A 142 11.800 1.564 11.466 1.00 0.00 H new ATOM 0 HG2 ARG A 142 13.343 0.485 12.870 1.00 0.00 H new ATOM 0 HG3 ARG A 142 13.965 1.987 13.525 1.00 0.00 H new ATOM 0 HD2 ARG A 142 11.077 1.502 14.109 1.00 0.00 H new ATOM 0 HD3 ARG A 142 12.162 0.333 14.834 1.00 0.00 H new ATOM 0 HE ARG A 142 12.888 3.236 15.182 1.00 0.00 H new ATOM 0 HH11 ARG A 142 11.510 0.254 16.454 1.00 0.00 H new ATOM 0 HH12 ARG A 142 11.667 0.771 18.136 1.00 0.00 H new ATOM 0 HH21 ARG A 142 13.076 3.862 17.328 1.00 0.00 H new ATOM 0 HH22 ARG A 142 12.542 2.786 18.623 1.00 0.00 H new ATOM 2237 N THR A 143 15.383 1.741 10.637 1.00 0.00 N ATOM 2238 CA THR A 143 16.143 0.802 9.760 1.00 0.00 C ATOM 2239 C THR A 143 16.337 -0.534 10.478 1.00 0.00 C ATOM 2240 O THR A 143 16.791 -0.580 11.605 1.00 0.00 O ATOM 2241 CB THR A 143 17.515 1.405 9.444 1.00 0.00 C ATOM 2242 OG1 THR A 143 17.358 2.767 9.064 1.00 0.00 O ATOM 2243 CG2 THR A 143 18.174 0.619 8.308 1.00 0.00 C ATOM 0 H THR A 143 15.906 2.114 11.429 1.00 0.00 H new ATOM 0 HA THR A 143 15.586 0.640 8.837 1.00 0.00 H new ATOM 0 HB THR A 143 18.149 1.350 10.329 1.00 0.00 H new ATOM 0 HG1 THR A 143 18.236 3.154 8.863 1.00 0.00 H new ATOM 0 HG21 THR A 143 19.150 1.050 8.085 1.00 0.00 H new ATOM 0 HG22 THR A 143 18.297 -0.421 8.609 1.00 0.00 H new ATOM 0 HG23 THR A 143 17.545 0.667 7.419 1.00 0.00 H new ATOM 2251 N VAL A 144 16.006 -1.623 9.834 1.00 0.00 N ATOM 2252 CA VAL A 144 16.182 -2.952 10.485 1.00 0.00 C ATOM 2253 C VAL A 144 17.005 -3.872 9.573 1.00 0.00 C ATOM 2254 O VAL A 144 16.727 -4.020 8.392 1.00 0.00 O ATOM 2255 CB VAL A 144 14.807 -3.573 10.760 1.00 0.00 C ATOM 2256 CG1 VAL A 144 14.011 -3.675 9.457 1.00 0.00 C ATOM 2257 CG2 VAL A 144 14.986 -4.970 11.364 1.00 0.00 C ATOM 0 H VAL A 144 15.623 -1.648 8.889 1.00 0.00 H new ATOM 0 HA VAL A 144 16.712 -2.827 11.429 1.00 0.00 H new ATOM 0 HB VAL A 144 14.263 -2.941 11.462 1.00 0.00 H new ATOM 0 HG11 VAL A 144 13.036 -4.117 9.660 1.00 0.00 H new ATOM 0 HG12 VAL A 144 13.877 -2.680 9.033 1.00 0.00 H new ATOM 0 HG13 VAL A 144 14.552 -4.301 8.748 1.00 0.00 H new ATOM 0 HG21 VAL A 144 14.008 -5.410 11.559 1.00 0.00 H new ATOM 0 HG22 VAL A 144 15.535 -5.601 10.665 1.00 0.00 H new ATOM 0 HG23 VAL A 144 15.542 -4.894 12.298 1.00 0.00 H new ATOM 2267 N GLU A 145 18.027 -4.479 10.118 1.00 0.00 N ATOM 2268 CA GLU A 145 18.894 -5.383 9.308 1.00 0.00 C ATOM 2269 C GLU A 145 18.338 -6.808 9.348 1.00 0.00 C ATOM 2270 O GLU A 145 17.566 -7.161 10.219 1.00 0.00 O ATOM 2271 CB GLU A 145 20.311 -5.376 9.886 1.00 0.00 C ATOM 2272 CG GLU A 145 20.257 -5.719 11.377 1.00 0.00 C ATOM 2273 CD GLU A 145 21.632 -6.204 11.842 1.00 0.00 C ATOM 2274 OE1 GLU A 145 22.541 -5.392 11.885 1.00 0.00 O ATOM 2275 OE2 GLU A 145 21.752 -7.379 12.147 1.00 0.00 O ATOM 0 H GLU A 145 18.299 -4.386 11.097 1.00 0.00 H new ATOM 0 HA GLU A 145 18.914 -5.033 8.276 1.00 0.00 H new ATOM 0 HB2 GLU A 145 20.934 -6.098 9.358 1.00 0.00 H new ATOM 0 HB3 GLU A 145 20.768 -4.397 9.744 1.00 0.00 H new ATOM 0 HG2 GLU A 145 19.956 -4.843 11.951 1.00 0.00 H new ATOM 0 HG3 GLU A 145 19.508 -6.491 11.556 1.00 0.00 H new ATOM 2282 N ASP A 146 18.729 -7.628 8.409 1.00 0.00 N ATOM 2283 CA ASP A 146 18.231 -9.033 8.385 1.00 0.00 C ATOM 2284 C ASP A 146 19.377 -9.979 8.008 1.00 0.00 C ATOM 2285 O ASP A 146 20.345 -9.580 7.391 1.00 0.00 O ATOM 2286 CB ASP A 146 17.105 -9.153 7.352 1.00 0.00 C ATOM 2287 CG ASP A 146 15.914 -9.888 7.971 1.00 0.00 C ATOM 2288 OD1 ASP A 146 15.904 -11.107 7.921 1.00 0.00 O ATOM 2289 OD2 ASP A 146 15.031 -9.219 8.483 1.00 0.00 O ATOM 0 H ASP A 146 19.373 -7.384 7.656 1.00 0.00 H new ATOM 0 HA ASP A 146 17.853 -9.303 9.371 1.00 0.00 H new ATOM 0 HB2 ASP A 146 16.799 -8.162 7.017 1.00 0.00 H new ATOM 0 HB3 ASP A 146 17.460 -9.691 6.473 1.00 0.00 H new ATOM 2294 N THR A 147 19.269 -11.232 8.370 1.00 0.00 N ATOM 2295 CA THR A 147 20.346 -12.213 8.030 1.00 0.00 C ATOM 2296 C THR A 147 20.519 -12.296 6.506 1.00 0.00 C ATOM 2297 O THR A 147 21.504 -12.810 6.013 1.00 0.00 O ATOM 2298 CB THR A 147 19.967 -13.594 8.573 1.00 0.00 C ATOM 2299 OG1 THR A 147 18.608 -13.872 8.255 1.00 0.00 O ATOM 2300 CG2 THR A 147 20.158 -13.618 10.091 1.00 0.00 C ATOM 0 H THR A 147 18.480 -11.620 8.887 1.00 0.00 H new ATOM 0 HA THR A 147 21.283 -11.884 8.480 1.00 0.00 H new ATOM 0 HB THR A 147 20.606 -14.351 8.119 1.00 0.00 H new ATOM 0 HG1 THR A 147 18.365 -14.756 8.601 1.00 0.00 H new ATOM 0 HG21 THR A 147 19.888 -14.601 10.476 1.00 0.00 H new ATOM 0 HG22 THR A 147 21.201 -13.409 10.330 1.00 0.00 H new ATOM 0 HG23 THR A 147 19.522 -12.861 10.550 1.00 0.00 H new ATOM 2308 N ASN A 148 19.576 -11.783 5.761 1.00 0.00 N ATOM 2309 CA ASN A 148 19.694 -11.823 4.275 1.00 0.00 C ATOM 2310 C ASN A 148 20.027 -10.417 3.756 1.00 0.00 C ATOM 2311 O ASN A 148 19.330 -9.469 4.060 1.00 0.00 O ATOM 2312 CB ASN A 148 18.376 -12.296 3.662 1.00 0.00 C ATOM 2313 CG ASN A 148 18.666 -13.207 2.468 1.00 0.00 C ATOM 2314 OD1 ASN A 148 18.817 -14.403 2.622 1.00 0.00 O ATOM 2315 ND2 ASN A 148 18.752 -12.687 1.274 1.00 0.00 N ATOM 0 H ASN A 148 18.730 -11.338 6.117 1.00 0.00 H new ATOM 0 HA ASN A 148 20.487 -12.516 3.993 1.00 0.00 H new ATOM 0 HB2 ASN A 148 17.788 -12.832 4.407 1.00 0.00 H new ATOM 0 HB3 ASN A 148 17.783 -11.439 3.343 1.00 0.00 H new ATOM 0 HD21 ASN A 148 18.946 -13.284 0.470 1.00 0.00 H new ATOM 0 HD22 ASN A 148 18.625 -11.683 1.145 1.00 0.00 H new ATOM 2322 N PRO A 149 21.088 -10.323 2.992 1.00 0.00 N ATOM 2323 CA PRO A 149 21.606 -9.050 2.379 1.00 0.00 C ATOM 2324 C PRO A 149 20.475 -8.305 1.663 1.00 0.00 C ATOM 2325 O PRO A 149 20.306 -7.112 1.826 1.00 0.00 O ATOM 2326 CB PRO A 149 22.685 -9.443 1.371 1.00 0.00 C ATOM 2327 CG PRO A 149 22.867 -10.943 1.449 1.00 0.00 C ATOM 2328 CD PRO A 149 21.989 -11.457 2.582 1.00 0.00 C ATOM 0 HA PRO A 149 22.008 -8.391 3.148 1.00 0.00 H new ATOM 0 HB2 PRO A 149 22.393 -9.146 0.364 1.00 0.00 H new ATOM 0 HB3 PRO A 149 23.622 -8.932 1.595 1.00 0.00 H new ATOM 0 HG2 PRO A 149 22.587 -11.412 0.506 1.00 0.00 H new ATOM 0 HG3 PRO A 149 23.912 -11.193 1.632 1.00 0.00 H new ATOM 0 HD2 PRO A 149 21.403 -12.316 2.256 1.00 0.00 H new ATOM 0 HD3 PRO A 149 22.599 -11.788 3.423 1.00 0.00 H new ATOM 2336 N ALA A 150 19.718 -8.994 0.853 1.00 0.00 N ATOM 2337 CA ALA A 150 18.617 -8.323 0.103 1.00 0.00 C ATOM 2338 C ALA A 150 17.402 -8.108 1.010 1.00 0.00 C ATOM 2339 O ALA A 150 16.661 -7.159 0.840 1.00 0.00 O ATOM 2340 CB ALA A 150 18.211 -9.199 -1.085 1.00 0.00 C ATOM 0 H ALA A 150 19.814 -9.994 0.678 1.00 0.00 H new ATOM 0 HA ALA A 150 18.970 -7.353 -0.248 1.00 0.00 H new ATOM 0 HB1 ALA A 150 17.406 -8.713 -1.637 1.00 0.00 H new ATOM 0 HB2 ALA A 150 19.069 -9.340 -1.743 1.00 0.00 H new ATOM 0 HB3 ALA A 150 17.869 -10.168 -0.722 1.00 0.00 H new ATOM 2346 N LEU A 151 17.181 -8.981 1.959 1.00 0.00 N ATOM 2347 CA LEU A 151 15.998 -8.822 2.858 1.00 0.00 C ATOM 2348 C LEU A 151 16.198 -7.640 3.818 1.00 0.00 C ATOM 2349 O LEU A 151 15.314 -7.303 4.582 1.00 0.00 O ATOM 2350 CB LEU A 151 15.785 -10.107 3.663 1.00 0.00 C ATOM 2351 CG LEU A 151 15.464 -11.268 2.712 1.00 0.00 C ATOM 2352 CD1 LEU A 151 15.151 -12.525 3.528 1.00 0.00 C ATOM 2353 CD2 LEU A 151 14.251 -10.913 1.843 1.00 0.00 C ATOM 0 H LEU A 151 17.766 -9.794 2.150 1.00 0.00 H new ATOM 0 HA LEU A 151 15.120 -8.625 2.242 1.00 0.00 H new ATOM 0 HB2 LEU A 151 16.679 -10.336 4.243 1.00 0.00 H new ATOM 0 HB3 LEU A 151 14.970 -9.971 4.374 1.00 0.00 H new ATOM 0 HG LEU A 151 16.325 -11.451 2.070 1.00 0.00 H new ATOM 0 HD11 LEU A 151 14.923 -13.350 2.853 1.00 0.00 H new ATOM 0 HD12 LEU A 151 16.014 -12.786 4.140 1.00 0.00 H new ATOM 0 HD13 LEU A 151 14.293 -12.336 4.173 1.00 0.00 H new ATOM 0 HD21 LEU A 151 14.030 -11.742 1.171 1.00 0.00 H new ATOM 0 HD22 LEU A 151 13.388 -10.724 2.482 1.00 0.00 H new ATOM 0 HD23 LEU A 151 14.472 -10.020 1.258 1.00 0.00 H new ATOM 2365 N THR A 152 17.334 -6.993 3.779 1.00 0.00 N ATOM 2366 CA THR A 152 17.549 -5.822 4.678 1.00 0.00 C ATOM 2367 C THR A 152 16.664 -4.683 4.172 1.00 0.00 C ATOM 2368 O THR A 152 16.418 -4.578 2.986 1.00 0.00 O ATOM 2369 CB THR A 152 19.020 -5.399 4.622 1.00 0.00 C ATOM 2370 OG1 THR A 152 19.845 -6.539 4.816 1.00 0.00 O ATOM 2371 CG2 THR A 152 19.307 -4.368 5.715 1.00 0.00 C ATOM 0 H THR A 152 18.117 -7.223 3.167 1.00 0.00 H new ATOM 0 HA THR A 152 17.297 -6.073 5.708 1.00 0.00 H new ATOM 0 HB THR A 152 19.231 -4.955 3.649 1.00 0.00 H new ATOM 0 HG1 THR A 152 20.117 -6.898 3.946 1.00 0.00 H new ATOM 0 HG21 THR A 152 20.355 -4.072 5.669 1.00 0.00 H new ATOM 0 HG22 THR A 152 18.675 -3.493 5.564 1.00 0.00 H new ATOM 0 HG23 THR A 152 19.095 -4.804 6.691 1.00 0.00 H new ATOM 2379 N HIS A 153 16.175 -3.825 5.033 1.00 0.00 N ATOM 2380 CA HIS A 153 15.308 -2.722 4.517 1.00 0.00 C ATOM 2381 C HIS A 153 15.056 -1.658 5.585 1.00 0.00 C ATOM 2382 O HIS A 153 15.401 -1.814 6.740 1.00 0.00 O ATOM 2383 CB HIS A 153 13.971 -3.304 4.049 1.00 0.00 C ATOM 2384 CG HIS A 153 13.352 -4.126 5.147 1.00 0.00 C ATOM 2385 ND1 HIS A 153 13.904 -5.323 5.580 1.00 0.00 N ATOM 2386 CD2 HIS A 153 12.220 -3.940 5.903 1.00 0.00 C ATOM 2387 CE1 HIS A 153 13.111 -5.806 6.554 1.00 0.00 C ATOM 2388 NE2 HIS A 153 12.070 -5.002 6.791 1.00 0.00 N ATOM 0 H HIS A 153 16.332 -3.837 6.041 1.00 0.00 H new ATOM 0 HA HIS A 153 15.825 -2.246 3.684 1.00 0.00 H new ATOM 0 HB2 HIS A 153 13.295 -2.498 3.762 1.00 0.00 H new ATOM 0 HB3 HIS A 153 14.124 -3.922 3.164 1.00 0.00 H new ATOM 0 HD1 HIS A 153 14.756 -5.758 5.225 1.00 0.00 H new ATOM 0 HD2 HIS A 153 11.549 -3.098 5.821 1.00 0.00 H new ATOM 0 HE1 HIS A 153 13.294 -6.731 7.080 1.00 0.00 H new ATOM 2396 N THR A 154 14.447 -0.571 5.186 1.00 0.00 N ATOM 2397 CA THR A 154 14.151 0.535 6.138 1.00 0.00 C ATOM 2398 C THR A 154 12.701 0.992 5.950 1.00 0.00 C ATOM 2399 O THR A 154 12.123 0.826 4.893 1.00 0.00 O ATOM 2400 CB THR A 154 15.090 1.709 5.843 1.00 0.00 C ATOM 2401 OG1 THR A 154 16.417 1.226 5.699 1.00 0.00 O ATOM 2402 CG2 THR A 154 15.032 2.718 6.989 1.00 0.00 C ATOM 0 H THR A 154 14.139 -0.403 4.228 1.00 0.00 H new ATOM 0 HA THR A 154 14.296 0.190 7.162 1.00 0.00 H new ATOM 0 HB THR A 154 14.778 2.199 4.920 1.00 0.00 H new ATOM 0 HG1 THR A 154 17.050 1.960 5.844 1.00 0.00 H new ATOM 0 HG21 THR A 154 15.701 3.551 6.775 1.00 0.00 H new ATOM 0 HG22 THR A 154 14.013 3.090 7.095 1.00 0.00 H new ATOM 0 HG23 THR A 154 15.340 2.234 7.916 1.00 0.00 H new ATOM 2410 N TYR A 155 12.110 1.571 6.962 1.00 0.00 N ATOM 2411 CA TYR A 155 10.701 2.049 6.837 1.00 0.00 C ATOM 2412 C TYR A 155 10.697 3.578 6.868 1.00 0.00 C ATOM 2413 O TYR A 155 11.248 4.182 7.766 1.00 0.00 O ATOM 2414 CB TYR A 155 9.872 1.523 8.012 1.00 0.00 C ATOM 2415 CG TYR A 155 9.905 0.014 8.033 1.00 0.00 C ATOM 2416 CD1 TYR A 155 9.152 -0.717 7.107 1.00 0.00 C ATOM 2417 CD2 TYR A 155 10.682 -0.654 8.987 1.00 0.00 C ATOM 2418 CE1 TYR A 155 9.176 -2.117 7.135 1.00 0.00 C ATOM 2419 CE2 TYR A 155 10.707 -2.053 9.013 1.00 0.00 C ATOM 2420 CZ TYR A 155 9.954 -2.785 8.088 1.00 0.00 C ATOM 2421 OH TYR A 155 9.977 -4.164 8.115 1.00 0.00 O ATOM 0 H TYR A 155 12.543 1.734 7.871 1.00 0.00 H new ATOM 0 HA TYR A 155 10.272 1.688 5.902 1.00 0.00 H new ATOM 0 HB2 TYR A 155 10.265 1.917 8.950 1.00 0.00 H new ATOM 0 HB3 TYR A 155 8.843 1.871 7.926 1.00 0.00 H new ATOM 0 HD1 TYR A 155 8.553 -0.202 6.371 1.00 0.00 H new ATOM 0 HD2 TYR A 155 11.262 -0.090 9.703 1.00 0.00 H new ATOM 0 HE1 TYR A 155 8.594 -2.681 6.421 1.00 0.00 H new ATOM 0 HE2 TYR A 155 11.308 -2.568 9.748 1.00 0.00 H new ATOM 0 HH TYR A 155 10.875 -4.481 7.884 1.00 0.00 H new ATOM 2431 N GLU A 156 10.100 4.215 5.894 1.00 0.00 N ATOM 2432 CA GLU A 156 10.091 5.708 5.883 1.00 0.00 C ATOM 2433 C GLU A 156 8.650 6.226 5.951 1.00 0.00 C ATOM 2434 O GLU A 156 7.811 5.863 5.149 1.00 0.00 O ATOM 2435 CB GLU A 156 10.748 6.216 4.595 1.00 0.00 C ATOM 2436 CG GLU A 156 12.082 5.496 4.368 1.00 0.00 C ATOM 2437 CD GLU A 156 12.433 5.533 2.879 1.00 0.00 C ATOM 2438 OE1 GLU A 156 12.896 6.566 2.425 1.00 0.00 O ATOM 2439 OE2 GLU A 156 12.233 4.527 2.218 1.00 0.00 O ATOM 0 H GLU A 156 9.622 3.770 5.111 1.00 0.00 H new ATOM 0 HA GLU A 156 10.646 6.071 6.748 1.00 0.00 H new ATOM 0 HB2 GLU A 156 10.085 6.046 3.747 1.00 0.00 H new ATOM 0 HB3 GLU A 156 10.912 7.292 4.660 1.00 0.00 H new ATOM 0 HG2 GLU A 156 12.870 5.974 4.950 1.00 0.00 H new ATOM 0 HG3 GLU A 156 12.014 4.464 4.711 1.00 0.00 H new ATOM 2446 N VAL A 157 8.365 7.083 6.897 1.00 0.00 N ATOM 2447 CA VAL A 157 6.986 7.644 7.020 1.00 0.00 C ATOM 2448 C VAL A 157 7.035 9.141 6.703 1.00 0.00 C ATOM 2449 O VAL A 157 7.784 9.884 7.307 1.00 0.00 O ATOM 2450 CB VAL A 157 6.476 7.439 8.449 1.00 0.00 C ATOM 2451 CG1 VAL A 157 5.021 7.902 8.546 1.00 0.00 C ATOM 2452 CG2 VAL A 157 6.567 5.954 8.818 1.00 0.00 C ATOM 0 H VAL A 157 9.031 7.420 7.593 1.00 0.00 H new ATOM 0 HA VAL A 157 6.315 7.139 6.325 1.00 0.00 H new ATOM 0 HB VAL A 157 7.088 8.022 9.138 1.00 0.00 H new ATOM 0 HG11 VAL A 157 4.660 7.755 9.564 1.00 0.00 H new ATOM 0 HG12 VAL A 157 4.957 8.959 8.287 1.00 0.00 H new ATOM 0 HG13 VAL A 157 4.408 7.322 7.856 1.00 0.00 H new ATOM 0 HG21 VAL A 157 6.204 5.809 9.835 1.00 0.00 H new ATOM 0 HG22 VAL A 157 5.958 5.370 8.128 1.00 0.00 H new ATOM 0 HG23 VAL A 157 7.604 5.626 8.753 1.00 0.00 H new ATOM 2462 N TRP A 158 6.250 9.595 5.760 1.00 0.00 N ATOM 2463 CA TRP A 158 6.277 11.047 5.410 1.00 0.00 C ATOM 2464 C TRP A 158 4.931 11.701 5.729 1.00 0.00 C ATOM 2465 O TRP A 158 3.932 11.039 5.932 1.00 0.00 O ATOM 2466 CB TRP A 158 6.569 11.215 3.914 1.00 0.00 C ATOM 2467 CG TRP A 158 7.786 10.429 3.535 1.00 0.00 C ATOM 2468 CD1 TRP A 158 7.887 9.080 3.578 1.00 0.00 C ATOM 2469 CD2 TRP A 158 9.070 10.919 3.052 1.00 0.00 C ATOM 2470 NE1 TRP A 158 9.153 8.713 3.159 1.00 0.00 N ATOM 2471 CE2 TRP A 158 9.919 9.810 2.823 1.00 0.00 C ATOM 2472 CE3 TRP A 158 9.577 12.206 2.794 1.00 0.00 C ATOM 2473 CZ2 TRP A 158 11.224 9.972 2.356 1.00 0.00 C ATOM 2474 CZ3 TRP A 158 10.890 12.372 2.323 1.00 0.00 C ATOM 2475 CH2 TRP A 158 11.712 11.257 2.105 1.00 0.00 C ATOM 0 H TRP A 158 5.596 9.028 5.221 1.00 0.00 H new ATOM 0 HA TRP A 158 7.058 11.528 5.999 1.00 0.00 H new ATOM 0 HB2 TRP A 158 5.713 10.879 3.329 1.00 0.00 H new ATOM 0 HB3 TRP A 158 6.720 12.269 3.681 1.00 0.00 H new ATOM 0 HD1 TRP A 158 7.107 8.401 3.889 1.00 0.00 H new ATOM 0 HE1 TRP A 158 9.480 7.748 3.105 1.00 0.00 H new ATOM 0 HE3 TRP A 158 8.953 13.072 2.959 1.00 0.00 H new ATOM 0 HZ2 TRP A 158 11.853 9.110 2.190 1.00 0.00 H new ATOM 0 HZ3 TRP A 158 11.269 13.364 2.128 1.00 0.00 H new ATOM 0 HH2 TRP A 158 12.721 11.391 1.744 1.00 0.00 H new ATOM 2486 N GLN A 159 4.906 13.006 5.741 1.00 0.00 N ATOM 2487 CA GLN A 159 3.641 13.746 6.012 1.00 0.00 C ATOM 2488 C GLN A 159 3.568 14.924 5.038 1.00 0.00 C ATOM 2489 O GLN A 159 4.575 15.523 4.714 1.00 0.00 O ATOM 2490 CB GLN A 159 3.644 14.263 7.453 1.00 0.00 C ATOM 2491 CG GLN A 159 3.131 13.167 8.389 1.00 0.00 C ATOM 2492 CD GLN A 159 2.984 13.730 9.804 1.00 0.00 C ATOM 2493 OE1 GLN A 159 3.611 13.151 10.792 1.00 0.00 O flip ATOM 2494 NE2 GLN A 159 2.291 14.705 10.014 1.00 0.00 N flip ATOM 0 H GLN A 159 5.719 13.598 5.572 1.00 0.00 H new ATOM 0 HA GLN A 159 2.780 13.091 5.880 1.00 0.00 H new ATOM 0 HB2 GLN A 159 4.652 14.560 7.742 1.00 0.00 H new ATOM 0 HB3 GLN A 159 3.015 15.149 7.534 1.00 0.00 H new ATOM 0 HG2 GLN A 159 2.171 12.791 8.034 1.00 0.00 H new ATOM 0 HG3 GLN A 159 3.822 12.324 8.392 1.00 0.00 H new ATOM 0 HE21 GLN A 159 1.801 15.158 9.243 1.00 0.00 H new ATOM 0 HE22 GLN A 159 2.199 15.071 10.962 1.00 0.00 H new ATOM 2503 N LYS A 160 2.402 15.263 4.555 1.00 0.00 N ATOM 2504 CA LYS A 160 2.301 16.398 3.593 1.00 0.00 C ATOM 2505 C LYS A 160 2.333 17.729 4.346 1.00 0.00 C ATOM 2506 O LYS A 160 1.646 17.914 5.331 1.00 0.00 O ATOM 2507 CB LYS A 160 0.988 16.286 2.817 1.00 0.00 C ATOM 2508 CG LYS A 160 1.119 17.021 1.482 1.00 0.00 C ATOM 2509 CD LYS A 160 -0.203 16.929 0.719 1.00 0.00 C ATOM 2510 CE LYS A 160 -0.013 17.465 -0.701 1.00 0.00 C ATOM 2511 NZ LYS A 160 -0.981 16.800 -1.617 1.00 0.00 N ATOM 0 H LYS A 160 1.520 14.805 4.784 1.00 0.00 H new ATOM 0 HA LYS A 160 3.144 16.359 2.903 1.00 0.00 H new ATOM 0 HB2 LYS A 160 0.744 15.238 2.645 1.00 0.00 H new ATOM 0 HB3 LYS A 160 0.171 16.712 3.400 1.00 0.00 H new ATOM 0 HG2 LYS A 160 1.381 18.065 1.653 1.00 0.00 H new ATOM 0 HG3 LYS A 160 1.924 16.584 0.891 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -0.544 15.894 0.686 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -0.973 17.502 1.235 1.00 0.00 H new ATOM 0 HE2 LYS A 160 -0.164 18.544 -0.717 1.00 0.00 H new ATOM 0 HE3 LYS A 160 1.007 17.281 -1.037 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -0.852 17.164 -2.582 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -0.817 15.773 -1.610 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -1.951 16.998 -1.299 1.00 0.00 H new ATOM 2525 N LYS A 161 3.126 18.659 3.883 1.00 0.00 N ATOM 2526 CA LYS A 161 3.208 19.983 4.563 1.00 0.00 C ATOM 2527 C LYS A 161 2.074 20.884 4.067 1.00 0.00 C ATOM 2528 O LYS A 161 1.491 20.650 3.026 1.00 0.00 O ATOM 2529 CB LYS A 161 4.553 20.639 4.244 1.00 0.00 C ATOM 2530 CG LYS A 161 5.687 19.781 4.808 1.00 0.00 C ATOM 2531 CD LYS A 161 5.945 20.169 6.266 1.00 0.00 C ATOM 2532 CE LYS A 161 7.386 19.818 6.645 1.00 0.00 C ATOM 2533 NZ LYS A 161 8.169 21.071 6.847 1.00 0.00 N ATOM 0 H LYS A 161 3.721 18.557 3.061 1.00 0.00 H new ATOM 0 HA LYS A 161 3.117 19.842 5.640 1.00 0.00 H new ATOM 0 HB2 LYS A 161 4.669 20.750 3.166 1.00 0.00 H new ATOM 0 HB3 LYS A 161 4.592 21.640 4.674 1.00 0.00 H new ATOM 0 HG2 LYS A 161 5.425 18.725 4.743 1.00 0.00 H new ATOM 0 HG3 LYS A 161 6.592 19.922 4.217 1.00 0.00 H new ATOM 0 HD2 LYS A 161 5.772 21.236 6.405 1.00 0.00 H new ATOM 0 HD3 LYS A 161 5.248 19.645 6.921 1.00 0.00 H new ATOM 0 HE2 LYS A 161 7.398 19.219 7.556 1.00 0.00 H new ATOM 0 HE3 LYS A 161 7.842 19.214 5.861 1.00 0.00 H new ATOM 0 HZ1 LYS A 161 9.148 20.831 7.104 1.00 0.00 H new ATOM 0 HZ2 LYS A 161 8.168 21.626 5.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 161 7.738 21.631 7.610 1.00 0.00 H new ATOM 2547 N ALA A 162 1.760 21.913 4.808 1.00 0.00 N ATOM 2548 CA ALA A 162 0.667 22.835 4.386 1.00 0.00 C ATOM 2549 C ALA A 162 0.888 24.212 5.016 1.00 0.00 C ATOM 2550 O ALA A 162 0.709 25.197 4.318 1.00 0.00 O ATOM 2551 CB ALA A 162 -0.682 22.272 4.841 1.00 0.00 C ATOM 2552 OXT ALA A 162 1.231 24.259 6.186 1.00 0.00 O ATOM 0 H ALA A 162 2.214 22.155 5.689 1.00 0.00 H new ATOM 0 HA ALA A 162 0.671 22.930 3.300 1.00 0.00 H new ATOM 0 HB1 ALA A 162 -1.481 22.947 4.532 1.00 0.00 H new ATOM 0 HB2 ALA A 162 -0.839 21.293 4.389 1.00 0.00 H new ATOM 0 HB3 ALA A 162 -0.688 22.175 5.927 1.00 0.00 H new TER 2558 ALA A 162 HETATM 2559 PA NDP A 168 -3.669 -4.071 -10.294 1.00 0.00 P HETATM 2560 O1A NDP A 168 -3.186 -5.214 -11.095 1.00 0.00 O HETATM 2561 O2A NDP A 168 -3.739 -4.248 -8.830 1.00 0.00 O HETATM 2562 O5B NDP A 168 -5.040 -3.499 -10.870 1.00 0.00 O HETATM 2563 C5B NDP A 168 -5.947 -2.764 -10.025 1.00 0.00 C HETATM 2564 C4B NDP A 168 -7.345 -2.813 -10.594 1.00 0.00 C HETATM 2565 O4B NDP A 168 -8.256 -2.124 -9.698 1.00 0.00 O HETATM 2566 C3B NDP A 168 -7.549 -2.127 -11.935 1.00 0.00 C HETATM 2567 O3B NDP A 168 -7.193 -2.996 -13.015 1.00 0.00 O HETATM 2568 C2B NDP A 168 -9.045 -1.838 -11.923 1.00 0.00 C HETATM 2569 O2B NDP A 168 -9.839 -2.945 -12.299 1.00 0.00 O HETATM 2570 C1B NDP A 168 -9.279 -1.495 -10.450 1.00 0.00 C HETATM 2571 N9A NDP A 168 -9.234 -0.060 -10.174 1.00 0.00 N HETATM 2572 C8A NDP A 168 -8.127 0.743 -10.049 1.00 0.00 C HETATM 2573 N7A NDP A 168 -8.410 1.999 -9.798 1.00 0.00 N HETATM 2574 C5A NDP A 168 -9.797 2.025 -9.754 1.00 0.00 C HETATM 2575 C6A NDP A 168 -10.721 3.063 -9.526 1.00 0.00 C HETATM 2576 N6A NDP A 168 -10.368 4.329 -9.289 1.00 0.00 N HETATM 2577 N1A NDP A 168 -12.037 2.753 -9.551 1.00 0.00 N HETATM 2578 C2A NDP A 168 -12.392 1.482 -9.789 1.00 0.00 C HETATM 2579 N3A NDP A 168 -11.619 0.420 -10.017 1.00 0.00 N HETATM 2580 C4A NDP A 168 -10.318 0.764 -9.986 1.00 0.00 C HETATM 2581 O3 NDP A 168 -2.711 -2.770 -10.623 1.00 0.00 O HETATM 2582 PN NDP A 168 -1.197 -2.560 -11.243 1.00 0.00 P HETATM 2583 O1N NDP A 168 -1.009 -1.128 -11.543 1.00 0.00 O HETATM 2584 O2N NDP A 168 -1.014 -3.518 -12.351 1.00 0.00 O HETATM 2585 O5D NDP A 168 -0.371 -2.999 -9.953 1.00 0.00 O HETATM 2586 C5D NDP A 168 -0.712 -4.199 -9.234 1.00 0.00 C HETATM 2587 C4D NDP A 168 0.542 -4.918 -8.789 1.00 0.00 C HETATM 2588 O4D NDP A 168 1.356 -4.039 -7.967 1.00 0.00 O HETATM 2589 C3D NDP A 168 0.333 -6.146 -7.917 1.00 0.00 C HETATM 2590 O3D NDP A 168 0.055 -7.300 -8.716 1.00 0.00 O HETATM 2591 C2D NDP A 168 1.680 -6.274 -7.213 1.00 0.00 C HETATM 2592 O2D NDP A 168 2.673 -6.937 -7.998 1.00 0.00 O HETATM 2593 C1D NDP A 168 2.061 -4.806 -7.004 1.00 0.00 C HETATM 2594 N1N NDP A 168 1.742 -4.289 -5.672 1.00 0.00 N HETATM 2595 C2N NDP A 168 2.494 -3.591 -4.827 1.00 0.00 C HETATM 2596 C3N NDP A 168 2.143 -3.130 -3.668 1.00 0.00 C HETATM 2597 C7N NDP A 168 3.260 -2.495 -3.031 1.00 0.00 C HETATM 2598 O7N NDP A 168 2.765 -2.043 -1.900 1.00 0.00 O HETATM 2599 N7N NDP A 168 4.547 -2.340 -3.434 1.00 0.00 N HETATM 2600 C4N NDP A 168 0.738 -3.391 -3.207 1.00 0.00 C HETATM 2601 C5N NDP A 168 -0.136 -4.147 -4.063 1.00 0.00 C HETATM 2602 C6N NDP A 168 0.285 -4.638 -5.306 1.00 0.00 C HETATM 2603 P2B NDP A 168 -11.418 -2.936 -12.844 1.00 0.00 P HETATM 2604 O1X NDP A 168 -11.991 -4.019 -11.848 1.00 0.00 O HETATM 2605 O2X NDP A 168 -11.855 -1.544 -12.388 1.00 0.00 O HETATM 2606 O3X NDP A 168 -11.236 -3.562 -14.225 1.00 0.00 O HETATM 0 HO3N NDP A 168 -0.910 -7.471 -8.720 1.00 0.00 H new HETATM 0 HO3A NDP A 168 -7.998 -3.434 -13.362 1.00 0.00 H new HETATM 0 HO2N NDP A 168 2.236 -7.487 -8.682 1.00 0.00 H new HETATM 0 H72N NDP A 168 5.213 -1.851 -2.836 1.00 0.00 H new HETATM 0 H71N NDP A 168 4.848 -2.713 -4.335 1.00 0.00 H new HETATM 0 H62A NDP A 168 -11.085 5.037 -9.131 1.00 0.00 H new HETATM 0 H61A NDP A 168 -9.382 4.588 -9.266 1.00 0.00 H new HETATM 0 H52N NDP A 168 -1.324 -3.950 -8.367 1.00 0.00 H new HETATM 0 H52A NDP A 168 -5.941 -3.185 -9.020 1.00 0.00 H new HETATM 0 H51N NDP A 168 -1.309 -4.854 -9.868 1.00 0.00 H new HETATM 0 H51A NDP A 168 -5.617 -1.729 -9.939 1.00 0.00 H new HETATM 0 H42N NDP A 168 0.794 -3.909 -2.250 1.00 0.00 H new HETATM 0 H41N NDP A 168 0.266 -2.426 -3.020 1.00 0.00 H new HETATM 0 H8A NDP A 168 -7.107 0.371 -10.149 1.00 0.00 H new HETATM 0 H6N NDP A 168 -0.364 -5.219 -5.961 1.00 0.00 H new HETATM 0 H5N NDP A 168 -1.157 -4.344 -3.735 1.00 0.00 H new HETATM 0 H4D NDP A 168 0.996 -5.222 -9.732 1.00 0.00 H new HETATM 0 H4B NDP A 168 -7.528 -3.880 -10.718 1.00 0.00 H new HETATM 0 H3D NDP A 168 -0.511 -6.061 -7.232 1.00 0.00 H new HETATM 0 H3B NDP A 168 -6.935 -1.237 -12.074 1.00 0.00 H new HETATM 0 H2N NDP A 168 3.516 -3.384 -5.143 1.00 0.00 H new HETATM 0 H2D NDP A 168 1.617 -6.875 -6.306 1.00 0.00 H new HETATM 0 H2B NDP A 168 -9.322 -1.062 -12.637 1.00 0.00 H new HETATM 0 H2A NDP A 168 -13.465 1.290 -9.797 1.00 0.00 H new HETATM 0 H1D NDP A 168 3.143 -4.733 -7.110 1.00 0.00 H new HETATM 0 H1B NDP A 168 -10.277 -1.841 -10.182 1.00 0.00 H new HETATM 2633 N1 TRR A 170 4.126 -4.791 1.430 1.00 0.00 N HETATM 2634 C2 TRR A 170 3.941 -3.475 1.787 1.00 0.00 C HETATM 2635 N2 TRR A 170 4.907 -2.823 2.521 1.00 0.00 N HETATM 2636 N3 TRR A 170 2.790 -2.813 1.411 1.00 0.00 N HETATM 2637 C4 TRR A 170 1.822 -3.468 0.676 1.00 0.00 C HETATM 2638 N4 TRR A 170 0.676 -2.802 0.303 1.00 0.00 N HETATM 2639 C5 TRR A 170 2.006 -4.797 0.315 1.00 0.00 C HETATM 2640 C6 TRR A 170 3.168 -5.454 0.698 1.00 0.00 C HETATM 2641 C7 TRR A 170 0.954 -5.518 -0.486 1.00 0.00 C HETATM 2642 C11 TRR A 170 0.994 -7.012 -0.312 1.00 0.00 C HETATM 2643 C12 TRR A 170 1.385 -7.821 -1.375 1.00 0.00 C HETATM 2644 C13 TRR A 170 1.424 -9.213 -1.221 1.00 0.00 C HETATM 2645 C14 TRR A 170 1.072 -9.784 0.001 1.00 0.00 C HETATM 2646 C15 TRR A 170 0.680 -8.977 1.067 1.00 0.00 C HETATM 2647 C16 TRR A 170 0.642 -7.584 0.909 1.00 0.00 C HETATM 2648 O13 TRR A 170 1.812 -10.038 -2.275 1.00 0.00 O HETATM 2649 O14 TRR A 170 1.110 -11.152 0.154 1.00 0.00 O HETATM 2650 O15 TRR A 170 0.333 -9.571 2.280 1.00 0.00 O HETATM 2651 C17 TRR A 170 2.164 -9.459 -3.506 1.00 0.00 C HETATM 2652 C18 TRR A 170 2.363 -11.776 0.164 1.00 0.00 C HETATM 2653 C19 TRR A 170 -0.057 -8.757 3.355 1.00 0.00 C HETATM 0 H193 TRR A 170 0.755 -8.076 3.609 1.00 0.00 H new HETATM 0 H192 TRR A 170 -0.938 -8.181 3.074 1.00 0.00 H new HETATM 0 H191 TRR A 170 -0.291 -9.381 4.217 1.00 0.00 H new HETATM 0 H183 TRR A 170 2.874 -11.582 -0.779 1.00 0.00 H new HETATM 0 H182 TRR A 170 2.959 -11.382 0.987 1.00 0.00 H new HETATM 0 H181 TRR A 170 2.233 -12.851 0.292 1.00 0.00 H new HETATM 0 H173 TRR A 170 1.317 -8.898 -3.900 1.00 0.00 H new HETATM 0 H172 TRR A 170 3.010 -8.787 -3.363 1.00 0.00 H new HETATM 0 H171 TRR A 170 2.439 -10.243 -4.211 1.00 0.00 H new HETATM 0 H72 TRR A 170 -0.030 -5.151 -0.194 1.00 0.00 H new HETATM 0 H71 TRR A 170 1.083 -5.278 -1.541 1.00 0.00 H new HETATM 0 H6 TRR A 170 3.321 -6.496 0.418 1.00 0.00 H new HETATM 0 H42 TRR A 170 -0.040 -3.284 -0.240 1.00 0.00 H new HETATM 0 H41 TRR A 170 0.543 -1.826 0.570 1.00 0.00 H new HETATM 0 H22 TRR A 170 4.773 -1.848 2.787 1.00 0.00 H new HETATM 0 H21 TRR A 170 5.756 -3.316 2.798 1.00 0.00 H new HETATM 0 H16 TRR A 170 0.337 -6.949 1.741 1.00 0.00 H new HETATM 0 H12 TRR A 170 1.661 -7.371 -2.329 1.00 0.00 H new HETATM 0 H1 TRR A 170 4.978 -5.278 1.709 1.00 0.00 H new