USER MOD reduce.3.24.130724 H: found=0, std=0, add=1293, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1293 hydrogens (26 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 126 THR OG1 : rot 180:sc= -0.038 USER MOD Set 1.2: A 170 NDP O2D : rot 13:sc= -0.0196 USER MOD Set 2.1: A 116 THR OG1 : rot -129:sc= -0.673 USER MOD Set 2.2: A 155 TYR OH : rot 85:sc= 1.1 USER MOD Set 3.1: A 63 THR OG1 : rot 20:sc= -1.07 USER MOD Set 3.2: A 65 GLN : amide:sc= 0 X(o=-1.1,f=-1.1) USER MOD Set 4.1: A 39 MET CE :methyl -134:sc= -3.72! (180deg=-6.48!) USER MOD Set 4.2: A 59 ASN : amide:sc= -2.82! C(o=-6.5!,f=-9.1!) USER MOD Set 5.1: A 58 THR OG1 : rot 167:sc= 0.0635 USER MOD Set 5.2: A 92 GLN : amide:sc= 0.0238 K(o=0.087,f=-2!) USER MOD Set 6.1: A 29 TYR OH : rot 180:sc= 0 USER MOD Set 6.2: A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 1 THR N :NH3+ -165:sc= -0.184 (180deg=-0.658) USER MOD Single : A 1 THR OG1 : rot 18:sc= 0.155 USER MOD Single : A 7 GLN :FLIP amide:sc= -6.91! C(o=-9.2!,f=-6.9!) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 HIS : no HD1:sc= -0.502 X(o=-0.5,f=-0.28) USER MOD Single : A 22 HIS : no HD1:sc= -0.463 X(o=-0.46,f=-0.043) USER MOD Single : A 28 HIS : no HD1:sc= -0.283 X(o=-0.28,f=-0.11) USER MOD Single : A 34 THR OG1 : rot -106:sc= 0.178 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 THR OG1 : rot -80:sc= -0.0658 USER MOD Single : A 46 TYR OH : rot 125:sc= 0.475 USER MOD Single : A 48 SER OG : rot 95:sc= 0.361 USER MOD Single : A 51 LYS NZ :NH3+ 150:sc= -1.18 (180deg=-2.28!) USER MOD Single : A 64 HIS : no HE2:sc= -6.94! C(o=-6.9!,f=-8.1!) USER MOD Single : A 68 TYR OH : rot 80:sc= 1.95 USER MOD Single : A 69 GLN : amide:sc= 0.324 K(o=0.32,f=-0.21) USER MOD Single : A 71 GLN : amide:sc= -0.264 K(o=-0.26,f=-2.6!) USER MOD Single : A 77 HIS : no HE2:sc= -4.19! C(o=-4.2!,f=-10!) USER MOD Single : A 85 TYR OH : rot -177:sc= -4.59! USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 GLN : amide:sc= -0.163 X(o=-0.16,f=-0.16) USER MOD Single : A 89 HIS : no HD1:sc= -0.093 X(o=-0.093,f=-0.32) USER MOD Single : A 101 GLN :FLIP amide:sc= -0.626 F(o=-1.2,f=-0.63) USER MOD Single : A 104 THR OG1 : rot 68:sc= -4.75! USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 1.12 (180deg=1.12) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 127 LYS NZ :NH3+ 152:sc= 0 (180deg=-0.0824) USER MOD Single : A 128 MET CE :methyl -138:sc= -2.38 (180deg=-7.68!) USER MOD Single : A 132 ASN : amide:sc= -0.22 X(o=-0.22,f=0) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 SER OG : rot -34:sc=-0.00666! USER MOD Single : A 141 SER OG : rot 160:sc= -0.136 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0.0766 USER MOD Single : A 148 ASN : amide:sc= -0.0964 K(o=-0.096,f=-0.83) USER MOD Single : A 152 THR OG1 : rot 180:sc= 0 USER MOD Single : A 153 HIS :FLIP no HD1:sc= -6.31! C(o=-8.6!,f=-6.3!) USER MOD Single : A 154 THR OG1 : rot 180:sc= -3.68! USER MOD Single : A 159 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 LYS NZ :NH3+ -174:sc= -0.0415 (180deg=-0.143) USER MOD Single : A 170 NDP O3B : rot 158:sc= 1.14 USER MOD Single : A 170 NDP O3D : rot -158:sc= 0.0134 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -4.709 9.114 5.607 1.00 0.00 N ATOM 2 CA THR A 1 -4.315 8.687 4.238 1.00 0.00 C ATOM 3 C THR A 1 -2.807 8.483 4.137 1.00 0.00 C ATOM 4 O THR A 1 -2.050 9.440 3.975 1.00 0.00 O ATOM 5 CB THR A 1 -4.771 9.756 3.243 1.00 0.00 C ATOM 6 OG1 THR A 1 -3.963 10.915 3.347 1.00 0.00 O ATOM 7 CG2 THR A 1 -6.211 10.180 3.438 1.00 0.00 C ATOM 0 H1 THR A 1 -5.736 9.001 5.724 1.00 0.00 H new ATOM 0 H2 THR A 1 -4.214 8.528 6.309 1.00 0.00 H new ATOM 0 H3 THR A 1 -4.452 10.112 5.747 1.00 0.00 H new ATOM 0 HA THR A 1 -4.791 7.734 4.010 1.00 0.00 H new ATOM 0 HB THR A 1 -4.675 9.295 2.260 1.00 0.00 H new ATOM 0 HG1 THR A 1 -3.131 10.693 3.816 1.00 0.00 H new ATOM 0 HG21 THR A 1 -6.470 10.940 2.700 1.00 0.00 H new ATOM 0 HG22 THR A 1 -6.865 9.316 3.314 1.00 0.00 H new ATOM 0 HG23 THR A 1 -6.337 10.590 4.440 1.00 0.00 H new ATOM 17 N ALA A 2 -2.378 7.229 4.233 1.00 0.00 N ATOM 18 CA ALA A 2 -0.960 6.898 4.152 1.00 0.00 C ATOM 19 C ALA A 2 -0.722 5.734 3.196 1.00 0.00 C ATOM 20 O ALA A 2 -1.565 4.848 3.061 1.00 0.00 O ATOM 21 CB ALA A 2 -0.416 6.569 5.534 1.00 0.00 C ATOM 0 H ALA A 2 -2.992 6.425 4.367 1.00 0.00 H new ATOM 0 HA ALA A 2 -0.430 7.767 3.763 1.00 0.00 H new ATOM 0 HB1 ALA A 2 0.643 6.324 5.459 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -0.544 7.430 6.190 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -0.958 5.717 5.945 1.00 0.00 H new ATOM 27 N PHE A 3 0.431 5.744 2.535 1.00 0.00 N ATOM 28 CA PHE A 3 0.781 4.688 1.591 1.00 0.00 C ATOM 29 C PHE A 3 1.803 3.735 2.198 1.00 0.00 C ATOM 30 O PHE A 3 2.927 4.132 2.497 1.00 0.00 O ATOM 31 CB PHE A 3 1.365 5.284 0.307 1.00 0.00 C ATOM 32 CG PHE A 3 0.361 5.943 -0.600 1.00 0.00 C ATOM 33 CD1 PHE A 3 -0.925 6.229 -0.167 1.00 0.00 C ATOM 34 CD2 PHE A 3 0.717 6.282 -1.896 1.00 0.00 C ATOM 35 CE1 PHE A 3 -1.834 6.838 -1.010 1.00 0.00 C ATOM 36 CE2 PHE A 3 -0.188 6.890 -2.742 1.00 0.00 C ATOM 37 CZ PHE A 3 -1.464 7.169 -2.299 1.00 0.00 C ATOM 0 H PHE A 3 1.139 6.471 2.635 1.00 0.00 H new ATOM 0 HA PHE A 3 -0.132 4.140 1.358 1.00 0.00 H new ATOM 0 HB2 PHE A 3 2.125 6.017 0.577 1.00 0.00 H new ATOM 0 HB3 PHE A 3 1.869 4.492 -0.247 1.00 0.00 H new ATOM 0 HD1 PHE A 3 -1.219 5.973 0.840 1.00 0.00 H new ATOM 0 HD2 PHE A 3 1.715 6.068 -2.248 1.00 0.00 H new ATOM 0 HE1 PHE A 3 -2.833 7.055 -0.662 1.00 0.00 H new ATOM 0 HE2 PHE A 3 0.103 7.147 -3.750 1.00 0.00 H new ATOM 0 HZ PHE A 3 -2.173 7.646 -2.959 1.00 0.00 H new ATOM 47 N LEU A 4 1.421 2.477 2.367 1.00 0.00 N ATOM 48 CA LEU A 4 2.328 1.483 2.926 1.00 0.00 C ATOM 49 C LEU A 4 2.527 0.330 1.952 1.00 0.00 C ATOM 50 O LEU A 4 1.596 -0.423 1.668 1.00 0.00 O ATOM 51 CB LEU A 4 1.792 0.954 4.257 1.00 0.00 C ATOM 52 CG LEU A 4 2.628 -0.158 4.895 1.00 0.00 C ATOM 53 CD1 LEU A 4 4.091 0.253 4.980 1.00 0.00 C ATOM 54 CD2 LEU A 4 2.086 -0.501 6.274 1.00 0.00 C ATOM 0 H LEU A 4 0.496 2.121 2.127 1.00 0.00 H new ATOM 0 HA LEU A 4 3.290 1.964 3.101 1.00 0.00 H new ATOM 0 HB2 LEU A 4 1.723 1.785 4.960 1.00 0.00 H new ATOM 0 HB3 LEU A 4 0.779 0.583 4.102 1.00 0.00 H new ATOM 0 HG LEU A 4 2.560 -1.046 4.267 1.00 0.00 H new ATOM 0 HD11 LEU A 4 4.669 -0.551 5.436 1.00 0.00 H new ATOM 0 HD12 LEU A 4 4.472 0.450 3.978 1.00 0.00 H new ATOM 0 HD13 LEU A 4 4.181 1.154 5.587 1.00 0.00 H new ATOM 0 HD21 LEU A 4 2.690 -1.293 6.716 1.00 0.00 H new ATOM 0 HD22 LEU A 4 2.125 0.383 6.911 1.00 0.00 H new ATOM 0 HD23 LEU A 4 1.053 -0.839 6.185 1.00 0.00 H new ATOM 66 N TRP A 5 3.747 0.194 1.442 1.00 0.00 N ATOM 67 CA TRP A 5 4.057 -0.873 0.499 1.00 0.00 C ATOM 68 C TRP A 5 5.560 -1.137 0.438 1.00 0.00 C ATOM 69 O TRP A 5 6.367 -0.281 0.801 1.00 0.00 O ATOM 70 CB TRP A 5 3.512 -0.527 -0.894 1.00 0.00 C ATOM 71 CG TRP A 5 4.430 0.327 -1.719 1.00 0.00 C ATOM 72 CD1 TRP A 5 5.373 -0.106 -2.605 1.00 0.00 C ATOM 73 CD2 TRP A 5 4.490 1.759 -1.738 1.00 0.00 C ATOM 74 NE1 TRP A 5 6.016 0.967 -3.173 1.00 0.00 N ATOM 75 CE2 TRP A 5 5.493 2.122 -2.656 1.00 0.00 C ATOM 76 CE3 TRP A 5 3.794 2.770 -1.068 1.00 0.00 C ATOM 77 CZ2 TRP A 5 5.816 3.451 -2.921 1.00 0.00 C ATOM 78 CZ3 TRP A 5 4.117 4.089 -1.333 1.00 0.00 C ATOM 79 CH2 TRP A 5 5.119 4.418 -2.252 1.00 0.00 C ATOM 0 H TRP A 5 4.532 0.806 1.665 1.00 0.00 H new ATOM 0 HA TRP A 5 3.573 -1.785 0.848 1.00 0.00 H new ATOM 0 HB2 TRP A 5 3.312 -1.453 -1.434 1.00 0.00 H new ATOM 0 HB3 TRP A 5 2.558 -0.012 -0.781 1.00 0.00 H new ATOM 0 HD1 TRP A 5 5.583 -1.142 -2.827 1.00 0.00 H new ATOM 0 HE1 TRP A 5 6.762 0.912 -3.867 1.00 0.00 H new ATOM 0 HE3 TRP A 5 3.019 2.526 -0.357 1.00 0.00 H new ATOM 0 HZ2 TRP A 5 6.589 3.708 -3.630 1.00 0.00 H new ATOM 0 HZ3 TRP A 5 3.586 4.878 -0.821 1.00 0.00 H new ATOM 0 HH2 TRP A 5 5.347 5.457 -2.437 1.00 0.00 H new ATOM 90 N ALA A 6 5.926 -2.325 -0.033 1.00 0.00 N ATOM 91 CA ALA A 6 7.330 -2.700 -0.152 1.00 0.00 C ATOM 92 C ALA A 6 7.802 -2.538 -1.591 1.00 0.00 C ATOM 93 O ALA A 6 7.053 -2.803 -2.531 1.00 0.00 O ATOM 94 CB ALA A 6 7.538 -4.130 0.323 1.00 0.00 C ATOM 0 H ALA A 6 5.270 -3.044 -0.338 1.00 0.00 H new ATOM 0 HA ALA A 6 7.922 -2.038 0.480 1.00 0.00 H new ATOM 0 HB1 ALA A 6 8.591 -4.395 0.228 1.00 0.00 H new ATOM 0 HB2 ALA A 6 7.235 -4.214 1.367 1.00 0.00 H new ATOM 0 HB3 ALA A 6 6.937 -4.806 -0.285 1.00 0.00 H new ATOM 100 N GLN A 7 9.043 -2.094 -1.763 1.00 0.00 N ATOM 101 CA GLN A 7 9.590 -1.892 -3.100 1.00 0.00 C ATOM 102 C GLN A 7 11.097 -2.110 -3.128 1.00 0.00 C ATOM 103 O GLN A 7 11.772 -1.987 -2.107 1.00 0.00 O ATOM 104 CB GLN A 7 9.264 -0.482 -3.592 1.00 0.00 C ATOM 105 CG GLN A 7 9.735 0.613 -2.650 1.00 0.00 C ATOM 106 CD GLN A 7 8.594 1.464 -2.127 1.00 0.00 C ATOM 107 OE1 GLN A 7 7.826 0.915 -1.192 1.00 0.00 O flip ATOM 108 NE2 GLN A 7 8.404 2.601 -2.558 1.00 0.00 N flip ATOM 0 H GLN A 7 9.683 -1.869 -1.002 1.00 0.00 H new ATOM 0 HA GLN A 7 9.130 -2.627 -3.761 1.00 0.00 H new ATOM 0 HB2 GLN A 7 9.723 -0.332 -4.569 1.00 0.00 H new ATOM 0 HB3 GLN A 7 8.186 -0.394 -3.729 1.00 0.00 H new ATOM 0 HG2 GLN A 7 10.262 0.162 -1.809 1.00 0.00 H new ATOM 0 HG3 GLN A 7 10.450 1.251 -3.169 1.00 0.00 H new ATOM 0 HE21 GLN A 7 9.019 2.983 -3.277 1.00 0.00 H new ATOM 0 HE22 GLN A 7 7.632 3.161 -2.197 1.00 0.00 H new ATOM 117 N ASP A 8 11.618 -2.428 -4.310 1.00 0.00 N ATOM 118 CA ASP A 8 13.045 -2.658 -4.481 1.00 0.00 C ATOM 119 C ASP A 8 13.804 -1.337 -4.555 1.00 0.00 C ATOM 120 O ASP A 8 13.206 -0.262 -4.504 1.00 0.00 O ATOM 121 CB ASP A 8 13.302 -3.477 -5.746 1.00 0.00 C ATOM 122 CG ASP A 8 14.392 -4.508 -5.546 1.00 0.00 C ATOM 123 OD1 ASP A 8 14.582 -4.951 -4.394 1.00 0.00 O ATOM 124 OD2 ASP A 8 15.054 -4.874 -6.540 1.00 0.00 O ATOM 0 H ASP A 8 11.070 -2.532 -5.164 1.00 0.00 H new ATOM 0 HA ASP A 8 13.404 -3.215 -3.616 1.00 0.00 H new ATOM 0 HB2 ASP A 8 12.381 -3.977 -6.047 1.00 0.00 H new ATOM 0 HB3 ASP A 8 13.582 -2.808 -6.560 1.00 0.00 H new ATOM 129 N ARG A 9 15.125 -1.426 -4.667 1.00 0.00 N ATOM 130 CA ARG A 9 15.969 -0.240 -4.738 1.00 0.00 C ATOM 131 C ARG A 9 15.658 0.603 -5.972 1.00 0.00 C ATOM 132 O ARG A 9 15.942 1.801 -5.997 1.00 0.00 O ATOM 133 CB ARG A 9 17.446 -0.637 -4.733 1.00 0.00 C ATOM 134 CG ARG A 9 18.085 -0.587 -3.355 1.00 0.00 C ATOM 135 CD ARG A 9 18.802 0.733 -3.123 1.00 0.00 C ATOM 136 NE ARG A 9 19.995 0.862 -3.956 1.00 0.00 N ATOM 137 CZ ARG A 9 20.814 1.910 -3.920 1.00 0.00 C ATOM 138 NH1 ARG A 9 20.574 2.921 -3.094 1.00 0.00 N ATOM 139 NH2 ARG A 9 21.877 1.948 -4.712 1.00 0.00 N ATOM 0 H ARG A 9 15.634 -2.309 -4.711 1.00 0.00 H new ATOM 0 HA ARG A 9 15.756 0.366 -3.858 1.00 0.00 H new ATOM 0 HB2 ARG A 9 17.544 -1.646 -5.133 1.00 0.00 H new ATOM 0 HB3 ARG A 9 17.994 0.026 -5.403 1.00 0.00 H new ATOM 0 HG2 ARG A 9 17.319 -0.726 -2.592 1.00 0.00 H new ATOM 0 HG3 ARG A 9 18.792 -1.410 -3.250 1.00 0.00 H new ATOM 0 HD2 ARG A 9 18.121 1.557 -3.335 1.00 0.00 H new ATOM 0 HD3 ARG A 9 19.083 0.813 -2.073 1.00 0.00 H new ATOM 0 HE ARG A 9 20.213 0.104 -4.603 1.00 0.00 H new ATOM 0 HH11 ARG A 9 19.758 2.897 -2.482 1.00 0.00 H new ATOM 0 HH12 ARG A 9 21.206 3.722 -3.071 1.00 0.00 H new ATOM 0 HH21 ARG A 9 22.067 1.174 -5.349 1.00 0.00 H new ATOM 0 HH22 ARG A 9 22.505 2.751 -4.685 1.00 0.00 H new ATOM 153 N ASP A 10 15.069 -0.015 -6.989 1.00 0.00 N ATOM 154 CA ASP A 10 14.722 0.703 -8.206 1.00 0.00 C ATOM 155 C ASP A 10 13.319 1.277 -8.086 1.00 0.00 C ATOM 156 O ASP A 10 13.042 2.387 -8.541 1.00 0.00 O ATOM 157 CB ASP A 10 14.810 -0.225 -9.419 1.00 0.00 C ATOM 158 CG ASP A 10 16.199 -0.803 -9.606 1.00 0.00 C ATOM 159 OD1 ASP A 10 16.675 -1.510 -8.692 1.00 0.00 O ATOM 160 OD2 ASP A 10 16.811 -0.548 -10.664 1.00 0.00 O ATOM 0 H ASP A 10 14.824 -1.005 -6.994 1.00 0.00 H new ATOM 0 HA ASP A 10 15.430 1.520 -8.344 1.00 0.00 H new ATOM 0 HB2 ASP A 10 14.094 -1.038 -9.303 1.00 0.00 H new ATOM 0 HB3 ASP A 10 14.525 0.326 -10.316 1.00 0.00 H new ATOM 165 N GLY A 11 12.440 0.500 -7.471 1.00 0.00 N ATOM 166 CA GLY A 11 11.066 0.927 -7.295 1.00 0.00 C ATOM 167 C GLY A 11 10.064 -0.203 -7.456 1.00 0.00 C ATOM 168 O GLY A 11 8.862 0.007 -7.296 1.00 0.00 O ATOM 0 H GLY A 11 12.654 -0.421 -7.089 1.00 0.00 H new ATOM 0 HA2 GLY A 11 10.953 1.366 -6.304 1.00 0.00 H new ATOM 0 HA3 GLY A 11 10.840 1.710 -8.018 1.00 0.00 H new ATOM 172 N LEU A 12 10.550 -1.407 -7.767 1.00 0.00 N ATOM 173 CA LEU A 12 9.671 -2.565 -7.938 1.00 0.00 C ATOM 174 C LEU A 12 8.690 -2.665 -6.776 1.00 0.00 C ATOM 175 O LEU A 12 8.812 -1.948 -5.787 1.00 0.00 O ATOM 176 CB LEU A 12 10.495 -3.856 -8.029 1.00 0.00 C ATOM 177 CG LEU A 12 9.860 -4.995 -8.840 1.00 0.00 C ATOM 178 CD1 LEU A 12 9.469 -4.511 -10.227 1.00 0.00 C ATOM 179 CD2 LEU A 12 10.825 -6.167 -8.941 1.00 0.00 C ATOM 0 H LEU A 12 11.541 -1.604 -7.905 1.00 0.00 H new ATOM 0 HA LEU A 12 9.113 -2.434 -8.865 1.00 0.00 H new ATOM 0 HB2 LEU A 12 11.463 -3.617 -8.469 1.00 0.00 H new ATOM 0 HB3 LEU A 12 10.685 -4.216 -7.018 1.00 0.00 H new ATOM 0 HG LEU A 12 8.958 -5.326 -8.326 1.00 0.00 H new ATOM 0 HD11 LEU A 12 9.021 -5.332 -10.786 1.00 0.00 H new ATOM 0 HD12 LEU A 12 8.750 -3.697 -10.139 1.00 0.00 H new ATOM 0 HD13 LEU A 12 10.356 -4.156 -10.752 1.00 0.00 H new ATOM 0 HD21 LEU A 12 10.364 -6.969 -9.518 1.00 0.00 H new ATOM 0 HD22 LEU A 12 11.740 -5.843 -9.436 1.00 0.00 H new ATOM 0 HD23 LEU A 12 11.063 -6.530 -7.941 1.00 0.00 H new ATOM 191 N ILE A 13 7.743 -3.579 -6.887 1.00 0.00 N ATOM 192 CA ILE A 13 6.766 -3.806 -5.833 1.00 0.00 C ATOM 193 C ILE A 13 6.256 -5.238 -5.901 1.00 0.00 C ATOM 194 O ILE A 13 6.007 -5.876 -4.880 1.00 0.00 O ATOM 195 CB ILE A 13 5.581 -2.817 -5.905 1.00 0.00 C ATOM 196 CG1 ILE A 13 4.793 -2.982 -7.207 1.00 0.00 C ATOM 197 CG2 ILE A 13 6.081 -1.387 -5.767 1.00 0.00 C ATOM 198 CD1 ILE A 13 3.340 -2.581 -7.081 1.00 0.00 C ATOM 0 H ILE A 13 7.628 -4.181 -7.702 1.00 0.00 H new ATOM 0 HA ILE A 13 7.269 -3.637 -4.881 1.00 0.00 H new ATOM 0 HB ILE A 13 4.907 -3.040 -5.078 1.00 0.00 H new ATOM 0 HG12 ILE A 13 5.262 -2.382 -7.986 1.00 0.00 H new ATOM 0 HG13 ILE A 13 4.849 -4.022 -7.529 1.00 0.00 H new ATOM 0 HG21 ILE A 13 5.237 -0.700 -5.819 1.00 0.00 H new ATOM 0 HG22 ILE A 13 6.586 -1.269 -4.808 1.00 0.00 H new ATOM 0 HG23 ILE A 13 6.779 -1.166 -6.574 1.00 0.00 H new ATOM 0 HD11 ILE A 13 2.839 -2.722 -8.039 1.00 0.00 H new ATOM 0 HD12 ILE A 13 2.856 -3.199 -6.324 1.00 0.00 H new ATOM 0 HD13 ILE A 13 3.276 -1.533 -6.789 1.00 0.00 H new ATOM 210 N GLY A 14 6.107 -5.734 -7.123 1.00 0.00 N ATOM 211 CA GLY A 14 5.630 -7.080 -7.332 1.00 0.00 C ATOM 212 C GLY A 14 6.094 -7.651 -8.655 1.00 0.00 C ATOM 213 O GLY A 14 6.769 -6.975 -9.432 1.00 0.00 O ATOM 0 H GLY A 14 6.312 -5.218 -7.979 1.00 0.00 H new ATOM 0 HA2 GLY A 14 5.979 -7.718 -6.520 1.00 0.00 H new ATOM 0 HA3 GLY A 14 4.541 -7.087 -7.297 1.00 0.00 H new ATOM 217 N LYS A 15 5.708 -8.888 -8.918 1.00 0.00 N ATOM 218 CA LYS A 15 6.057 -9.558 -10.164 1.00 0.00 C ATOM 219 C LYS A 15 4.812 -10.188 -10.783 1.00 0.00 C ATOM 220 O LYS A 15 4.660 -11.408 -10.800 1.00 0.00 O ATOM 221 CB LYS A 15 7.131 -10.623 -9.927 1.00 0.00 C ATOM 222 CG LYS A 15 6.681 -11.758 -9.021 1.00 0.00 C ATOM 223 CD LYS A 15 6.544 -13.067 -9.784 1.00 0.00 C ATOM 224 CE LYS A 15 5.304 -13.836 -9.355 1.00 0.00 C ATOM 225 NZ LYS A 15 5.565 -15.298 -9.249 1.00 0.00 N ATOM 0 H LYS A 15 5.148 -9.454 -8.281 1.00 0.00 H new ATOM 0 HA LYS A 15 6.461 -8.817 -10.854 1.00 0.00 H new ATOM 0 HB2 LYS A 15 7.437 -11.037 -10.888 1.00 0.00 H new ATOM 0 HB3 LYS A 15 8.010 -10.148 -9.490 1.00 0.00 H new ATOM 0 HG2 LYS A 15 7.399 -11.883 -8.210 1.00 0.00 H new ATOM 0 HG3 LYS A 15 5.725 -11.502 -8.564 1.00 0.00 H new ATOM 0 HD2 LYS A 15 6.494 -12.862 -10.853 1.00 0.00 H new ATOM 0 HD3 LYS A 15 7.429 -13.681 -9.618 1.00 0.00 H new ATOM 0 HE2 LYS A 15 4.958 -13.459 -8.393 1.00 0.00 H new ATOM 0 HE3 LYS A 15 4.503 -13.662 -10.073 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 4.695 -15.786 -8.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 5.871 -15.664 -10.173 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 6.312 -15.467 -8.545 1.00 0.00 H new ATOM 239 N ASP A 16 3.916 -9.337 -11.280 1.00 0.00 N ATOM 240 CA ASP A 16 2.671 -9.793 -11.892 1.00 0.00 C ATOM 241 C ASP A 16 1.750 -10.421 -10.848 1.00 0.00 C ATOM 242 O ASP A 16 1.065 -11.406 -11.122 1.00 0.00 O ATOM 243 CB ASP A 16 2.954 -10.794 -13.017 1.00 0.00 C ATOM 244 CG ASP A 16 3.181 -10.113 -14.352 1.00 0.00 C ATOM 245 OD1 ASP A 16 2.577 -9.045 -14.584 1.00 0.00 O ATOM 246 OD2 ASP A 16 3.965 -10.647 -15.165 1.00 0.00 O ATOM 0 H ASP A 16 4.031 -8.324 -11.270 1.00 0.00 H new ATOM 0 HA ASP A 16 2.169 -8.924 -12.318 1.00 0.00 H new ATOM 0 HB2 ASP A 16 3.832 -11.386 -12.760 1.00 0.00 H new ATOM 0 HB3 ASP A 16 2.117 -11.486 -13.103 1.00 0.00 H new ATOM 251 N GLY A 17 1.740 -9.839 -9.652 1.00 0.00 N ATOM 252 CA GLY A 17 0.899 -10.348 -8.581 1.00 0.00 C ATOM 253 C GLY A 17 1.086 -9.591 -7.279 1.00 0.00 C ATOM 254 O GLY A 17 0.161 -8.937 -6.798 1.00 0.00 O ATOM 0 H GLY A 17 2.300 -9.023 -9.405 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -0.146 -10.287 -8.885 1.00 0.00 H new ATOM 0 HA3 GLY A 17 1.123 -11.402 -8.419 1.00 0.00 H new ATOM 258 N HIS A 18 2.282 -9.682 -6.704 1.00 0.00 N ATOM 259 CA HIS A 18 2.581 -9.002 -5.446 1.00 0.00 C ATOM 260 C HIS A 18 4.057 -9.155 -5.083 1.00 0.00 C ATOM 261 O HIS A 18 4.874 -9.530 -5.923 1.00 0.00 O ATOM 262 CB HIS A 18 1.699 -9.563 -4.329 1.00 0.00 C ATOM 263 CG HIS A 18 1.958 -11.008 -4.031 1.00 0.00 C ATOM 264 ND1 HIS A 18 1.295 -12.037 -4.665 1.00 0.00 N ATOM 265 CD2 HIS A 18 2.816 -11.594 -3.162 1.00 0.00 C ATOM 266 CE1 HIS A 18 1.733 -13.194 -4.199 1.00 0.00 C ATOM 267 NE2 HIS A 18 2.656 -12.952 -3.287 1.00 0.00 N ATOM 0 H HIS A 18 3.059 -10.219 -7.088 1.00 0.00 H new ATOM 0 HA HIS A 18 2.370 -7.940 -5.568 1.00 0.00 H new ATOM 0 HB2 HIS A 18 1.859 -8.979 -3.423 1.00 0.00 H new ATOM 0 HB3 HIS A 18 0.652 -9.440 -4.607 1.00 0.00 H new ATOM 0 HD2 HIS A 18 3.498 -11.088 -2.495 1.00 0.00 H new ATOM 0 HE1 HIS A 18 1.394 -14.171 -4.511 1.00 0.00 H new ATOM 0 HE2 HIS A 18 3.168 -13.660 -2.760 1.00 0.00 H new ATOM 276 N LEU A 19 4.393 -8.864 -3.828 1.00 0.00 N ATOM 277 CA LEU A 19 5.775 -8.973 -3.364 1.00 0.00 C ATOM 278 C LEU A 19 6.232 -10.433 -3.379 1.00 0.00 C ATOM 279 O LEU A 19 5.733 -11.252 -2.607 1.00 0.00 O ATOM 280 CB LEU A 19 5.940 -8.396 -1.947 1.00 0.00 C ATOM 281 CG LEU A 19 4.738 -7.631 -1.385 1.00 0.00 C ATOM 282 CD1 LEU A 19 3.739 -8.591 -0.758 1.00 0.00 C ATOM 283 CD2 LEU A 19 5.195 -6.600 -0.367 1.00 0.00 C ATOM 0 H LEU A 19 3.731 -8.552 -3.117 1.00 0.00 H new ATOM 0 HA LEU A 19 6.395 -8.392 -4.047 1.00 0.00 H new ATOM 0 HB2 LEU A 19 6.172 -9.216 -1.268 1.00 0.00 H new ATOM 0 HB3 LEU A 19 6.802 -7.728 -1.947 1.00 0.00 H new ATOM 0 HG LEU A 19 4.245 -7.112 -2.207 1.00 0.00 H new ATOM 0 HD11 LEU A 19 2.892 -8.029 -0.364 1.00 0.00 H new ATOM 0 HD12 LEU A 19 3.388 -9.295 -1.513 1.00 0.00 H new ATOM 0 HD13 LEU A 19 4.220 -9.138 0.053 1.00 0.00 H new ATOM 0 HD21 LEU A 19 4.329 -6.065 0.023 1.00 0.00 H new ATOM 0 HD22 LEU A 19 5.711 -7.101 0.452 1.00 0.00 H new ATOM 0 HD23 LEU A 19 5.873 -5.893 -0.845 1.00 0.00 H new ATOM 295 N PRO A 20 7.183 -10.785 -4.264 1.00 0.00 N ATOM 296 CA PRO A 20 7.692 -12.149 -4.379 1.00 0.00 C ATOM 297 C PRO A 20 8.892 -12.419 -3.475 1.00 0.00 C ATOM 298 O PRO A 20 9.694 -13.312 -3.749 1.00 0.00 O ATOM 299 CB PRO A 20 8.109 -12.207 -5.842 1.00 0.00 C ATOM 300 CG PRO A 20 8.594 -10.827 -6.146 1.00 0.00 C ATOM 301 CD PRO A 20 7.832 -9.887 -5.238 1.00 0.00 C ATOM 0 HA PRO A 20 6.955 -12.894 -4.079 1.00 0.00 H new ATOM 0 HB2 PRO A 20 8.892 -12.948 -6.003 1.00 0.00 H new ATOM 0 HB3 PRO A 20 7.272 -12.484 -6.483 1.00 0.00 H new ATOM 0 HG2 PRO A 20 9.667 -10.747 -5.972 1.00 0.00 H new ATOM 0 HG3 PRO A 20 8.421 -10.578 -7.193 1.00 0.00 H new ATOM 0 HD2 PRO A 20 8.498 -9.179 -4.746 1.00 0.00 H new ATOM 0 HD3 PRO A 20 7.099 -9.302 -5.793 1.00 0.00 H new ATOM 309 N TRP A 21 9.015 -11.648 -2.400 1.00 0.00 N ATOM 310 CA TRP A 21 10.125 -11.817 -1.467 1.00 0.00 C ATOM 311 C TRP A 21 9.617 -12.116 -0.061 1.00 0.00 C ATOM 312 O TRP A 21 8.516 -11.712 0.313 1.00 0.00 O ATOM 313 CB TRP A 21 11.004 -10.565 -1.450 1.00 0.00 C ATOM 314 CG TRP A 21 10.224 -9.287 -1.398 1.00 0.00 C ATOM 315 CD1 TRP A 21 9.307 -8.924 -0.454 1.00 0.00 C ATOM 316 CD2 TRP A 21 10.291 -8.203 -2.331 1.00 0.00 C ATOM 317 NE1 TRP A 21 8.801 -7.679 -0.742 1.00 0.00 N ATOM 318 CE2 TRP A 21 9.389 -7.216 -1.890 1.00 0.00 C ATOM 319 CE3 TRP A 21 11.027 -7.970 -3.497 1.00 0.00 C ATOM 320 CZ2 TRP A 21 9.205 -6.017 -2.574 1.00 0.00 C ATOM 321 CZ3 TRP A 21 10.843 -6.779 -4.174 1.00 0.00 C ATOM 322 CH2 TRP A 21 9.939 -5.816 -3.711 1.00 0.00 C ATOM 0 H TRP A 21 8.364 -10.903 -2.153 1.00 0.00 H new ATOM 0 HA TRP A 21 10.721 -12.665 -1.805 1.00 0.00 H new ATOM 0 HB2 TRP A 21 11.670 -10.610 -0.588 1.00 0.00 H new ATOM 0 HB3 TRP A 21 11.634 -10.561 -2.340 1.00 0.00 H new ATOM 0 HD1 TRP A 21 9.021 -9.527 0.395 1.00 0.00 H new ATOM 0 HE1 TRP A 21 8.102 -7.181 -0.191 1.00 0.00 H new ATOM 0 HE3 TRP A 21 11.727 -8.707 -3.862 1.00 0.00 H new ATOM 0 HZ2 TRP A 21 8.508 -5.272 -2.220 1.00 0.00 H new ATOM 0 HZ3 TRP A 21 11.406 -6.588 -5.075 1.00 0.00 H new ATOM 0 HH2 TRP A 21 9.818 -4.895 -4.263 1.00 0.00 H new ATOM 333 N HIS A 22 10.430 -12.825 0.716 1.00 0.00 N ATOM 334 CA HIS A 22 10.067 -13.176 2.084 1.00 0.00 C ATOM 335 C HIS A 22 10.523 -12.092 3.053 1.00 0.00 C ATOM 336 O HIS A 22 11.666 -12.096 3.512 1.00 0.00 O ATOM 337 CB HIS A 22 10.687 -14.519 2.472 1.00 0.00 C ATOM 338 CG HIS A 22 10.072 -15.133 3.691 1.00 0.00 C ATOM 339 ND1 HIS A 22 9.831 -16.485 3.814 1.00 0.00 N ATOM 340 CD2 HIS A 22 9.647 -14.571 4.848 1.00 0.00 C ATOM 341 CE1 HIS A 22 9.284 -16.728 4.992 1.00 0.00 C ATOM 342 NE2 HIS A 22 9.162 -15.584 5.638 1.00 0.00 N ATOM 0 H HIS A 22 11.344 -13.168 0.421 1.00 0.00 H new ATOM 0 HA HIS A 22 8.982 -13.260 2.139 1.00 0.00 H new ATOM 0 HB2 HIS A 22 10.586 -15.211 1.636 1.00 0.00 H new ATOM 0 HB3 HIS A 22 11.754 -14.381 2.644 1.00 0.00 H new ATOM 0 HD2 HIS A 22 9.683 -13.522 5.102 1.00 0.00 H new ATOM 0 HE1 HIS A 22 8.987 -17.698 5.363 1.00 0.00 H new ATOM 0 HE2 HIS A 22 8.771 -15.470 6.573 1.00 0.00 H new ATOM 351 N LEU A 23 9.625 -11.160 3.354 1.00 0.00 N ATOM 352 CA LEU A 23 9.938 -10.063 4.262 1.00 0.00 C ATOM 353 C LEU A 23 9.120 -10.159 5.549 1.00 0.00 C ATOM 354 O LEU A 23 8.000 -9.653 5.621 1.00 0.00 O ATOM 355 CB LEU A 23 9.676 -8.723 3.572 1.00 0.00 C ATOM 356 CG LEU A 23 10.933 -7.973 3.133 1.00 0.00 C ATOM 357 CD1 LEU A 23 11.654 -8.735 2.034 1.00 0.00 C ATOM 358 CD2 LEU A 23 10.583 -6.567 2.671 1.00 0.00 C ATOM 0 H LEU A 23 8.675 -11.142 2.983 1.00 0.00 H new ATOM 0 HA LEU A 23 10.993 -10.133 4.527 1.00 0.00 H new ATOM 0 HB2 LEU A 23 9.049 -8.897 2.697 1.00 0.00 H new ATOM 0 HB3 LEU A 23 9.108 -8.086 4.250 1.00 0.00 H new ATOM 0 HG LEU A 23 11.602 -7.894 3.990 1.00 0.00 H new ATOM 0 HD11 LEU A 23 12.546 -8.185 1.735 1.00 0.00 H new ATOM 0 HD12 LEU A 23 11.941 -9.720 2.402 1.00 0.00 H new ATOM 0 HD13 LEU A 23 10.992 -8.848 1.175 1.00 0.00 H new ATOM 0 HD21 LEU A 23 11.491 -6.049 2.362 1.00 0.00 H new ATOM 0 HD22 LEU A 23 9.893 -6.622 1.829 1.00 0.00 H new ATOM 0 HD23 LEU A 23 10.114 -6.021 3.490 1.00 0.00 H new ATOM 370 N PRO A 24 9.672 -10.810 6.589 1.00 0.00 N ATOM 371 CA PRO A 24 8.989 -10.968 7.877 1.00 0.00 C ATOM 372 C PRO A 24 8.702 -9.628 8.548 1.00 0.00 C ATOM 373 O PRO A 24 7.583 -9.370 8.989 1.00 0.00 O ATOM 374 CB PRO A 24 9.977 -11.783 8.722 1.00 0.00 C ATOM 375 CG PRO A 24 10.912 -12.404 7.741 1.00 0.00 C ATOM 376 CD PRO A 24 11.001 -11.442 6.593 1.00 0.00 C ATOM 0 HA PRO A 24 8.017 -11.448 7.759 1.00 0.00 H new ATOM 0 HB2 PRO A 24 10.512 -11.146 9.426 1.00 0.00 H new ATOM 0 HB3 PRO A 24 9.460 -12.543 9.308 1.00 0.00 H new ATOM 0 HG2 PRO A 24 11.892 -12.571 8.187 1.00 0.00 H new ATOM 0 HG3 PRO A 24 10.543 -13.375 7.410 1.00 0.00 H new ATOM 0 HD2 PRO A 24 11.796 -10.710 6.740 1.00 0.00 H new ATOM 0 HD3 PRO A 24 11.208 -11.953 5.653 1.00 0.00 H new ATOM 384 N ASP A 25 9.722 -8.780 8.624 1.00 0.00 N ATOM 385 CA ASP A 25 9.588 -7.472 9.242 1.00 0.00 C ATOM 386 C ASP A 25 8.528 -6.630 8.536 1.00 0.00 C ATOM 387 O ASP A 25 7.930 -5.740 9.139 1.00 0.00 O ATOM 388 CB ASP A 25 10.933 -6.748 9.219 1.00 0.00 C ATOM 389 CG ASP A 25 11.634 -6.853 7.878 1.00 0.00 C ATOM 390 OD1 ASP A 25 11.094 -6.326 6.883 1.00 0.00 O ATOM 391 OD2 ASP A 25 12.723 -7.463 7.824 1.00 0.00 O ATOM 0 H ASP A 25 10.655 -8.980 8.262 1.00 0.00 H new ATOM 0 HA ASP A 25 9.270 -7.615 10.275 1.00 0.00 H new ATOM 0 HB2 ASP A 25 10.779 -5.697 9.462 1.00 0.00 H new ATOM 0 HB3 ASP A 25 11.577 -7.163 9.994 1.00 0.00 H new ATOM 396 N ASP A 26 8.303 -6.910 7.256 1.00 0.00 N ATOM 397 CA ASP A 26 7.318 -6.169 6.477 1.00 0.00 C ATOM 398 C ASP A 26 5.909 -6.702 6.719 1.00 0.00 C ATOM 399 O ASP A 26 5.013 -5.954 7.110 1.00 0.00 O ATOM 400 CB ASP A 26 7.653 -6.241 4.987 1.00 0.00 C ATOM 401 CG ASP A 26 7.092 -5.067 4.209 1.00 0.00 C ATOM 402 OD1 ASP A 26 7.603 -3.940 4.382 1.00 0.00 O ATOM 403 OD2 ASP A 26 6.140 -5.274 3.426 1.00 0.00 O ATOM 0 H ASP A 26 8.788 -7.643 6.738 1.00 0.00 H new ATOM 0 HA ASP A 26 7.351 -5.129 6.801 1.00 0.00 H new ATOM 0 HB2 ASP A 26 8.735 -6.272 4.862 1.00 0.00 H new ATOM 0 HB3 ASP A 26 7.258 -7.169 4.573 1.00 0.00 H new ATOM 408 N LEU A 27 5.717 -7.997 6.480 1.00 0.00 N ATOM 409 CA LEU A 27 4.422 -8.626 6.667 1.00 0.00 C ATOM 410 C LEU A 27 3.899 -8.408 8.085 1.00 0.00 C ATOM 411 O LEU A 27 2.744 -8.028 8.277 1.00 0.00 O ATOM 412 CB LEU A 27 4.526 -10.119 6.364 1.00 0.00 C ATOM 413 CG LEU A 27 5.664 -10.855 7.075 1.00 0.00 C ATOM 414 CD1 LEU A 27 5.202 -11.376 8.429 1.00 0.00 C ATOM 415 CD2 LEU A 27 6.180 -11.997 6.210 1.00 0.00 C ATOM 0 H LEU A 27 6.448 -8.629 6.155 1.00 0.00 H new ATOM 0 HA LEU A 27 3.714 -8.166 5.978 1.00 0.00 H new ATOM 0 HB2 LEU A 27 3.583 -10.594 6.635 1.00 0.00 H new ATOM 0 HB3 LEU A 27 4.649 -10.247 5.289 1.00 0.00 H new ATOM 0 HG LEU A 27 6.480 -10.151 7.240 1.00 0.00 H new ATOM 0 HD11 LEU A 27 6.025 -11.896 8.919 1.00 0.00 H new ATOM 0 HD12 LEU A 27 4.880 -10.540 9.050 1.00 0.00 H new ATOM 0 HD13 LEU A 27 4.369 -12.065 8.289 1.00 0.00 H new ATOM 0 HD21 LEU A 27 6.989 -12.510 6.730 1.00 0.00 H new ATOM 0 HD22 LEU A 27 5.370 -12.700 6.015 1.00 0.00 H new ATOM 0 HD23 LEU A 27 6.551 -11.599 5.265 1.00 0.00 H new ATOM 427 N HIS A 28 4.754 -8.648 9.074 1.00 0.00 N ATOM 428 CA HIS A 28 4.371 -8.473 10.471 1.00 0.00 C ATOM 429 C HIS A 28 3.963 -7.029 10.742 1.00 0.00 C ATOM 430 O HIS A 28 2.860 -6.764 11.220 1.00 0.00 O ATOM 431 CB HIS A 28 5.522 -8.878 11.395 1.00 0.00 C ATOM 432 CG HIS A 28 5.152 -9.944 12.379 1.00 0.00 C ATOM 433 ND1 HIS A 28 6.064 -10.839 12.897 1.00 0.00 N ATOM 434 CD2 HIS A 28 3.961 -10.256 12.942 1.00 0.00 C ATOM 435 CE1 HIS A 28 5.450 -11.656 13.734 1.00 0.00 C ATOM 436 NE2 HIS A 28 4.174 -11.323 13.779 1.00 0.00 N ATOM 0 H HIS A 28 5.714 -8.963 8.935 1.00 0.00 H new ATOM 0 HA HIS A 28 3.515 -9.117 10.673 1.00 0.00 H new ATOM 0 HB2 HIS A 28 6.358 -9.228 10.789 1.00 0.00 H new ATOM 0 HB3 HIS A 28 5.868 -7.998 11.938 1.00 0.00 H new ATOM 0 HD2 HIS A 28 3.019 -9.758 12.766 1.00 0.00 H new ATOM 0 HE1 HIS A 28 5.913 -12.460 14.287 1.00 0.00 H new ATOM 0 HE2 HIS A 28 3.461 -11.784 14.344 1.00 0.00 H new ATOM 445 N TYR A 29 4.860 -6.099 10.432 1.00 0.00 N ATOM 446 CA TYR A 29 4.593 -4.680 10.639 1.00 0.00 C ATOM 447 C TYR A 29 3.374 -4.232 9.838 1.00 0.00 C ATOM 448 O TYR A 29 2.708 -3.261 10.197 1.00 0.00 O ATOM 449 CB TYR A 29 5.814 -3.848 10.241 1.00 0.00 C ATOM 450 CG TYR A 29 5.919 -2.533 10.979 1.00 0.00 C ATOM 451 CD1 TYR A 29 6.153 -2.500 12.348 1.00 0.00 C ATOM 452 CD2 TYR A 29 5.786 -1.324 10.307 1.00 0.00 C ATOM 453 CE1 TYR A 29 6.250 -1.300 13.026 1.00 0.00 C ATOM 454 CE2 TYR A 29 5.882 -0.120 10.978 1.00 0.00 C ATOM 455 CZ TYR A 29 6.114 -0.113 12.337 1.00 0.00 C ATOM 456 OH TYR A 29 6.211 1.084 13.009 1.00 0.00 O ATOM 0 H TYR A 29 5.778 -6.302 10.037 1.00 0.00 H new ATOM 0 HA TYR A 29 4.385 -4.525 11.698 1.00 0.00 H new ATOM 0 HB2 TYR A 29 6.716 -4.431 10.426 1.00 0.00 H new ATOM 0 HB3 TYR A 29 5.775 -3.651 9.170 1.00 0.00 H new ATOM 0 HD1 TYR A 29 6.261 -3.427 12.891 1.00 0.00 H new ATOM 0 HD2 TYR A 29 5.605 -1.325 9.242 1.00 0.00 H new ATOM 0 HE1 TYR A 29 6.431 -1.292 14.091 1.00 0.00 H new ATOM 0 HE2 TYR A 29 5.776 0.811 10.441 1.00 0.00 H new ATOM 0 HH TYR A 29 6.093 1.824 12.378 1.00 0.00 H new ATOM 466 N PHE A 30 3.086 -4.946 8.753 1.00 0.00 N ATOM 467 CA PHE A 30 1.946 -4.619 7.905 1.00 0.00 C ATOM 468 C PHE A 30 0.643 -4.689 8.694 1.00 0.00 C ATOM 469 O PHE A 30 -0.104 -3.714 8.765 1.00 0.00 O ATOM 470 CB PHE A 30 1.883 -5.571 6.708 1.00 0.00 C ATOM 471 CG PHE A 30 1.521 -4.891 5.419 1.00 0.00 C ATOM 472 CD1 PHE A 30 0.271 -4.318 5.251 1.00 0.00 C ATOM 473 CD2 PHE A 30 2.430 -4.826 4.376 1.00 0.00 C ATOM 474 CE1 PHE A 30 -0.066 -3.692 4.065 1.00 0.00 C ATOM 475 CE2 PHE A 30 2.099 -4.202 3.188 1.00 0.00 C ATOM 476 CZ PHE A 30 0.850 -3.634 3.033 1.00 0.00 C ATOM 0 H PHE A 30 3.626 -5.753 8.442 1.00 0.00 H new ATOM 0 HA PHE A 30 2.076 -3.599 7.543 1.00 0.00 H new ATOM 0 HB2 PHE A 30 2.850 -6.060 6.592 1.00 0.00 H new ATOM 0 HB3 PHE A 30 1.153 -6.353 6.914 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -0.448 -4.361 6.055 1.00 0.00 H new ATOM 0 HD2 PHE A 30 3.409 -5.268 4.492 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -1.044 -3.249 3.946 1.00 0.00 H new ATOM 0 HE2 PHE A 30 2.816 -4.159 2.382 1.00 0.00 H new ATOM 0 HZ PHE A 30 0.590 -3.145 2.106 1.00 0.00 H new ATOM 486 N ARG A 31 0.378 -5.849 9.286 1.00 0.00 N ATOM 487 CA ARG A 31 -0.834 -6.048 10.072 1.00 0.00 C ATOM 488 C ARG A 31 -0.675 -5.473 11.476 1.00 0.00 C ATOM 489 O ARG A 31 -1.652 -5.068 12.105 1.00 0.00 O ATOM 490 CB ARG A 31 -1.176 -7.536 10.154 1.00 0.00 C ATOM 491 CG ARG A 31 -2.652 -7.808 10.396 1.00 0.00 C ATOM 492 CD ARG A 31 -2.856 -8.990 11.331 1.00 0.00 C ATOM 493 NE ARG A 31 -2.309 -8.736 12.661 1.00 0.00 N ATOM 494 CZ ARG A 31 -2.043 -9.693 13.548 1.00 0.00 C ATOM 495 NH1 ARG A 31 -2.272 -10.966 13.250 1.00 0.00 N ATOM 496 NH2 ARG A 31 -1.545 -9.376 14.735 1.00 0.00 N ATOM 0 H ARG A 31 0.987 -6.666 9.236 1.00 0.00 H new ATOM 0 HA ARG A 31 -1.649 -5.522 9.574 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -0.873 -8.022 9.227 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -0.595 -7.990 10.957 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -3.121 -6.921 10.822 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -3.147 -8.005 9.445 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -3.921 -9.208 11.413 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -2.381 -9.874 10.906 1.00 0.00 H new ATOM 0 HE ARG A 31 -2.120 -7.769 12.926 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -2.654 -11.216 12.338 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -2.066 -11.695 13.933 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -1.366 -8.399 14.969 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -1.341 -10.109 15.415 1.00 0.00 H new ATOM 510 N ALA A 32 0.562 -5.440 11.962 1.00 0.00 N ATOM 511 CA ALA A 32 0.847 -4.915 13.292 1.00 0.00 C ATOM 512 C ALA A 32 0.448 -3.447 13.401 1.00 0.00 C ATOM 513 O ALA A 32 0.028 -2.985 14.462 1.00 0.00 O ATOM 514 CB ALA A 32 2.321 -5.089 13.622 1.00 0.00 C ATOM 0 H ALA A 32 1.383 -5.771 11.454 1.00 0.00 H new ATOM 0 HA ALA A 32 0.255 -5.479 14.013 1.00 0.00 H new ATOM 0 HB1 ALA A 32 2.520 -4.693 14.618 1.00 0.00 H new ATOM 0 HB2 ALA A 32 2.577 -6.148 13.595 1.00 0.00 H new ATOM 0 HB3 ALA A 32 2.924 -4.551 12.890 1.00 0.00 H new ATOM 520 N GLN A 33 0.583 -2.719 12.298 1.00 0.00 N ATOM 521 CA GLN A 33 0.237 -1.303 12.269 1.00 0.00 C ATOM 522 C GLN A 33 -1.211 -1.105 11.833 1.00 0.00 C ATOM 523 O GLN A 33 -1.871 -0.153 12.251 1.00 0.00 O ATOM 524 CB GLN A 33 1.173 -0.547 11.325 1.00 0.00 C ATOM 525 CG GLN A 33 2.498 -0.160 11.962 1.00 0.00 C ATOM 526 CD GLN A 33 2.515 1.277 12.445 1.00 0.00 C ATOM 527 OE1 GLN A 33 1.922 1.605 13.473 1.00 0.00 O ATOM 528 NE2 GLN A 33 3.197 2.142 11.704 1.00 0.00 N ATOM 0 H GLN A 33 0.930 -3.086 11.412 1.00 0.00 H new ATOM 0 HA GLN A 33 0.351 -0.907 13.278 1.00 0.00 H new ATOM 0 HB2 GLN A 33 1.368 -1.165 10.448 1.00 0.00 H new ATOM 0 HB3 GLN A 33 0.671 0.355 10.974 1.00 0.00 H new ATOM 0 HG2 GLN A 33 2.701 -0.824 12.802 1.00 0.00 H new ATOM 0 HG3 GLN A 33 3.301 -0.306 11.239 1.00 0.00 H new ATOM 0 HE21 GLN A 33 3.673 1.826 10.859 1.00 0.00 H new ATOM 0 HE22 GLN A 33 3.245 3.123 11.979 1.00 0.00 H new ATOM 537 N THR A 34 -1.699 -2.008 10.989 1.00 0.00 N ATOM 538 CA THR A 34 -3.068 -1.930 10.494 1.00 0.00 C ATOM 539 C THR A 34 -4.001 -2.805 11.325 1.00 0.00 C ATOM 540 O THR A 34 -4.846 -3.519 10.783 1.00 0.00 O ATOM 541 CB THR A 34 -3.124 -2.356 9.026 1.00 0.00 C ATOM 542 OG1 THR A 34 -2.695 -3.700 8.879 1.00 0.00 O ATOM 543 CG2 THR A 34 -2.271 -1.492 8.120 1.00 0.00 C ATOM 0 H THR A 34 -1.167 -2.802 10.634 1.00 0.00 H new ATOM 0 HA THR A 34 -3.400 -0.895 10.580 1.00 0.00 H new ATOM 0 HB THR A 34 -4.166 -2.242 8.728 1.00 0.00 H new ATOM 0 HG1 THR A 34 -1.802 -3.716 8.475 1.00 0.00 H new ATOM 0 HG21 THR A 34 -2.355 -1.848 7.093 1.00 0.00 H new ATOM 0 HG22 THR A 34 -2.613 -0.458 8.175 1.00 0.00 H new ATOM 0 HG23 THR A 34 -1.230 -1.547 8.439 1.00 0.00 H new ATOM 551 N VAL A 35 -3.846 -2.745 12.643 1.00 0.00 N ATOM 552 CA VAL A 35 -4.678 -3.532 13.545 1.00 0.00 C ATOM 553 C VAL A 35 -5.983 -2.809 13.857 1.00 0.00 C ATOM 554 O VAL A 35 -6.011 -1.874 14.657 1.00 0.00 O ATOM 555 CB VAL A 35 -3.947 -3.838 14.866 1.00 0.00 C ATOM 556 CG1 VAL A 35 -4.730 -4.853 15.686 1.00 0.00 C ATOM 557 CG2 VAL A 35 -2.536 -4.337 14.594 1.00 0.00 C ATOM 0 H VAL A 35 -3.153 -2.160 13.110 1.00 0.00 H new ATOM 0 HA VAL A 35 -4.896 -4.470 13.035 1.00 0.00 H new ATOM 0 HB VAL A 35 -3.876 -2.916 15.442 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -4.199 -5.057 16.616 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -5.718 -4.453 15.913 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -4.835 -5.777 15.117 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -2.036 -4.548 15.539 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -2.581 -5.248 13.997 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -1.979 -3.574 14.051 1.00 0.00 H new ATOM 567 N GLY A 36 -7.064 -3.247 13.219 1.00 0.00 N ATOM 568 CA GLY A 36 -8.357 -2.628 13.441 1.00 0.00 C ATOM 569 C GLY A 36 -8.601 -1.432 12.537 1.00 0.00 C ATOM 570 O GLY A 36 -9.704 -0.888 12.506 1.00 0.00 O ATOM 0 H GLY A 36 -7.067 -4.019 12.553 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -9.141 -3.367 13.277 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -8.429 -2.312 14.482 1.00 0.00 H new ATOM 574 N LYS A 37 -7.571 -1.022 11.800 1.00 0.00 N ATOM 575 CA LYS A 37 -7.685 0.116 10.895 1.00 0.00 C ATOM 576 C LYS A 37 -8.314 -0.307 9.571 1.00 0.00 C ATOM 577 O LYS A 37 -8.764 -1.443 9.423 1.00 0.00 O ATOM 578 CB LYS A 37 -6.307 0.736 10.649 1.00 0.00 C ATOM 579 CG LYS A 37 -6.024 1.951 11.518 1.00 0.00 C ATOM 580 CD LYS A 37 -4.619 1.908 12.098 1.00 0.00 C ATOM 581 CE LYS A 37 -4.216 3.252 12.684 1.00 0.00 C ATOM 582 NZ LYS A 37 -2.771 3.540 12.473 1.00 0.00 N ATOM 0 H LYS A 37 -6.650 -1.461 11.813 1.00 0.00 H new ATOM 0 HA LYS A 37 -8.331 0.861 11.361 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -5.541 -0.017 10.831 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -6.229 1.023 9.600 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -6.147 2.859 10.927 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -6.752 1.997 12.328 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -4.567 1.142 12.872 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -3.912 1.623 11.319 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -4.814 4.041 12.227 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -4.436 3.263 13.752 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -2.537 4.465 12.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -2.199 2.801 12.931 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -2.565 3.555 11.454 1.00 0.00 H new ATOM 596 N ILE A 38 -8.339 0.611 8.610 1.00 0.00 N ATOM 597 CA ILE A 38 -8.912 0.326 7.298 1.00 0.00 C ATOM 598 C ILE A 38 -7.864 0.481 6.200 1.00 0.00 C ATOM 599 O ILE A 38 -7.216 1.522 6.089 1.00 0.00 O ATOM 600 CB ILE A 38 -10.123 1.236 6.970 1.00 0.00 C ATOM 601 CG1 ILE A 38 -10.418 2.211 8.114 1.00 0.00 C ATOM 602 CG2 ILE A 38 -11.352 0.389 6.672 1.00 0.00 C ATOM 603 CD1 ILE A 38 -11.309 3.364 7.704 1.00 0.00 C ATOM 0 H ILE A 38 -7.970 1.556 8.714 1.00 0.00 H new ATOM 0 HA ILE A 38 -9.260 -0.706 7.336 1.00 0.00 H new ATOM 0 HB ILE A 38 -9.870 1.823 6.087 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -10.892 1.668 8.932 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -9.477 2.606 8.497 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -12.196 1.040 6.443 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -11.150 -0.257 5.818 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -11.591 -0.223 7.541 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -11.478 4.016 8.561 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -10.828 3.930 6.907 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -12.264 2.977 7.349 1.00 0.00 H new ATOM 615 N MET A 39 -7.704 -0.562 5.392 1.00 0.00 N ATOM 616 CA MET A 39 -6.734 -0.543 4.301 1.00 0.00 C ATOM 617 C MET A 39 -7.437 -0.621 2.948 1.00 0.00 C ATOM 618 O MET A 39 -8.333 -1.441 2.748 1.00 0.00 O ATOM 619 CB MET A 39 -5.748 -1.706 4.453 1.00 0.00 C ATOM 620 CG MET A 39 -4.855 -1.921 3.240 1.00 0.00 C ATOM 621 SD MET A 39 -5.587 -3.037 2.027 1.00 0.00 S ATOM 622 CE MET A 39 -5.924 -4.471 3.047 1.00 0.00 C ATOM 0 H MET A 39 -8.233 -1.431 5.471 1.00 0.00 H new ATOM 0 HA MET A 39 -6.184 0.397 4.346 1.00 0.00 H new ATOM 0 HB2 MET A 39 -5.121 -1.526 5.326 1.00 0.00 H new ATOM 0 HB3 MET A 39 -6.308 -2.621 4.646 1.00 0.00 H new ATOM 0 HG2 MET A 39 -4.653 -0.960 2.768 1.00 0.00 H new ATOM 0 HG3 MET A 39 -3.896 -2.324 3.566 1.00 0.00 H new ATOM 0 HE1 MET A 39 -5.591 -5.371 2.530 1.00 0.00 H new ATOM 0 HE2 MET A 39 -5.391 -4.378 3.993 1.00 0.00 H new ATOM 0 HE3 MET A 39 -6.995 -4.538 3.239 1.00 0.00 H new ATOM 632 N VAL A 40 -7.021 0.237 2.022 1.00 0.00 N ATOM 633 CA VAL A 40 -7.605 0.268 0.685 1.00 0.00 C ATOM 634 C VAL A 40 -6.774 -0.552 -0.296 1.00 0.00 C ATOM 635 O VAL A 40 -5.570 -0.335 -0.438 1.00 0.00 O ATOM 636 CB VAL A 40 -7.727 1.711 0.160 1.00 0.00 C ATOM 637 CG1 VAL A 40 -8.528 1.744 -1.132 1.00 0.00 C ATOM 638 CG2 VAL A 40 -8.360 2.610 1.212 1.00 0.00 C ATOM 0 H VAL A 40 -6.280 0.922 2.173 1.00 0.00 H new ATOM 0 HA VAL A 40 -8.601 -0.167 0.763 1.00 0.00 H new ATOM 0 HB VAL A 40 -6.726 2.087 -0.051 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -8.603 2.772 -1.487 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -8.028 1.135 -1.886 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -9.527 1.349 -0.951 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -8.438 3.625 0.824 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -9.355 2.238 1.458 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -7.741 2.611 2.109 1.00 0.00 H new ATOM 648 N VAL A 41 -7.424 -1.496 -0.969 1.00 0.00 N ATOM 649 CA VAL A 41 -6.746 -2.351 -1.935 1.00 0.00 C ATOM 650 C VAL A 41 -7.372 -2.216 -3.325 1.00 0.00 C ATOM 651 O VAL A 41 -8.551 -1.888 -3.454 1.00 0.00 O ATOM 652 CB VAL A 41 -6.769 -3.831 -1.480 1.00 0.00 C ATOM 653 CG1 VAL A 41 -8.042 -4.536 -1.930 1.00 0.00 C ATOM 654 CG2 VAL A 41 -5.536 -4.563 -1.986 1.00 0.00 C ATOM 0 H VAL A 41 -8.420 -1.688 -0.863 1.00 0.00 H new ATOM 0 HA VAL A 41 -5.708 -2.023 -1.992 1.00 0.00 H new ATOM 0 HB VAL A 41 -6.757 -3.845 -0.390 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -8.023 -5.572 -1.593 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -8.908 -4.031 -1.502 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -8.107 -4.510 -3.018 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -5.569 -5.602 -1.657 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -5.514 -4.528 -3.075 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -4.641 -4.085 -1.589 1.00 0.00 H new ATOM 664 N GLY A 42 -6.573 -2.462 -4.360 1.00 0.00 N ATOM 665 CA GLY A 42 -7.068 -2.353 -5.722 1.00 0.00 C ATOM 666 C GLY A 42 -7.783 -3.604 -6.191 1.00 0.00 C ATOM 667 O GLY A 42 -7.781 -4.625 -5.503 1.00 0.00 O ATOM 0 H GLY A 42 -5.593 -2.734 -4.280 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -7.749 -1.505 -5.789 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -6.233 -2.145 -6.391 1.00 0.00 H new ATOM 671 N ARG A 43 -8.404 -3.522 -7.366 1.00 0.00 N ATOM 672 CA ARG A 43 -9.134 -4.655 -7.925 1.00 0.00 C ATOM 673 C ARG A 43 -8.214 -5.854 -8.139 1.00 0.00 C ATOM 674 O ARG A 43 -8.406 -6.916 -7.542 1.00 0.00 O ATOM 675 CB ARG A 43 -9.791 -4.266 -9.250 1.00 0.00 C ATOM 676 CG ARG A 43 -10.606 -5.388 -9.874 1.00 0.00 C ATOM 677 CD ARG A 43 -10.580 -5.323 -11.392 1.00 0.00 C ATOM 678 NE ARG A 43 -11.110 -4.058 -11.895 1.00 0.00 N ATOM 679 CZ ARG A 43 -11.624 -3.898 -13.113 1.00 0.00 C ATOM 680 NH1 ARG A 43 -11.675 -4.919 -13.960 1.00 0.00 N ATOM 681 NH2 ARG A 43 -12.085 -2.713 -13.485 1.00 0.00 N ATOM 0 H ARG A 43 -8.416 -2.684 -7.947 1.00 0.00 H new ATOM 0 HA ARG A 43 -9.907 -4.936 -7.210 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -10.439 -3.405 -9.086 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -9.018 -3.955 -9.953 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -10.214 -6.350 -9.544 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -11.637 -5.327 -9.525 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -9.556 -5.452 -11.743 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -11.163 -6.148 -11.800 1.00 0.00 H new ATOM 0 HE ARG A 43 -11.085 -3.248 -11.276 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -11.319 -5.833 -13.679 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -12.070 -4.790 -14.891 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -12.046 -1.925 -12.839 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -12.479 -2.589 -14.418 1.00 0.00 H new ATOM 695 N ARG A 44 -7.213 -5.675 -8.993 1.00 0.00 N ATOM 696 CA ARG A 44 -6.261 -6.740 -9.287 1.00 0.00 C ATOM 697 C ARG A 44 -5.568 -7.221 -8.016 1.00 0.00 C ATOM 698 O ARG A 44 -5.025 -8.325 -7.975 1.00 0.00 O ATOM 699 CB ARG A 44 -5.220 -6.254 -10.298 1.00 0.00 C ATOM 700 CG ARG A 44 -5.563 -6.598 -11.738 1.00 0.00 C ATOM 701 CD ARG A 44 -4.566 -5.986 -12.709 1.00 0.00 C ATOM 702 NE ARG A 44 -4.528 -4.529 -12.609 1.00 0.00 N ATOM 703 CZ ARG A 44 -3.625 -3.767 -13.222 1.00 0.00 C ATOM 704 NH1 ARG A 44 -2.684 -4.320 -13.978 1.00 0.00 N ATOM 705 NH2 ARG A 44 -3.662 -2.450 -13.078 1.00 0.00 N ATOM 0 H ARG A 44 -7.039 -4.803 -9.494 1.00 0.00 H new ATOM 0 HA ARG A 44 -6.812 -7.578 -9.715 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -5.114 -5.173 -10.207 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -4.253 -6.691 -10.049 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -5.575 -7.681 -11.862 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -6.566 -6.239 -11.970 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -3.573 -6.389 -12.511 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -4.829 -6.273 -13.727 1.00 0.00 H new ATOM 0 HE ARG A 44 -5.235 -4.069 -12.036 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -2.651 -5.333 -14.091 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -1.994 -3.732 -14.446 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -4.382 -2.020 -12.497 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -2.970 -1.866 -13.548 1.00 0.00 H new ATOM 719 N THR A 45 -5.584 -6.385 -6.983 1.00 0.00 N ATOM 720 CA THR A 45 -4.951 -6.726 -5.717 1.00 0.00 C ATOM 721 C THR A 45 -5.806 -7.702 -4.911 1.00 0.00 C ATOM 722 O THR A 45 -5.332 -8.769 -4.526 1.00 0.00 O ATOM 723 CB THR A 45 -4.688 -5.461 -4.901 1.00 0.00 C ATOM 724 OG1 THR A 45 -4.394 -4.368 -5.752 1.00 0.00 O ATOM 725 CG2 THR A 45 -3.538 -5.607 -3.928 1.00 0.00 C ATOM 0 H THR A 45 -6.029 -5.467 -6.999 1.00 0.00 H new ATOM 0 HA THR A 45 -4.002 -7.214 -5.939 1.00 0.00 H new ATOM 0 HB THR A 45 -5.603 -5.286 -4.335 1.00 0.00 H new ATOM 0 HG1 THR A 45 -3.458 -4.418 -6.037 1.00 0.00 H new ATOM 0 HG21 THR A 45 -3.404 -4.674 -3.380 1.00 0.00 H new ATOM 0 HG22 THR A 45 -3.755 -6.412 -3.226 1.00 0.00 H new ATOM 0 HG23 THR A 45 -2.625 -5.840 -4.476 1.00 0.00 H new ATOM 733 N TYR A 46 -7.064 -7.338 -4.651 1.00 0.00 N ATOM 734 CA TYR A 46 -7.959 -8.205 -3.880 1.00 0.00 C ATOM 735 C TYR A 46 -7.903 -9.639 -4.399 1.00 0.00 C ATOM 736 O TYR A 46 -7.989 -10.595 -3.629 1.00 0.00 O ATOM 737 CB TYR A 46 -9.409 -7.676 -3.905 1.00 0.00 C ATOM 738 CG TYR A 46 -10.140 -7.870 -5.223 1.00 0.00 C ATOM 739 CD1 TYR A 46 -10.364 -9.139 -5.746 1.00 0.00 C ATOM 740 CD2 TYR A 46 -10.608 -6.778 -5.947 1.00 0.00 C ATOM 741 CE1 TYR A 46 -11.020 -9.316 -6.944 1.00 0.00 C ATOM 742 CE2 TYR A 46 -11.269 -6.949 -7.149 1.00 0.00 C ATOM 743 CZ TYR A 46 -11.470 -8.219 -7.644 1.00 0.00 C ATOM 744 OH TYR A 46 -12.126 -8.392 -8.841 1.00 0.00 O ATOM 0 H TYR A 46 -7.482 -6.460 -4.958 1.00 0.00 H new ATOM 0 HA TYR A 46 -7.617 -8.199 -2.845 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -9.975 -8.172 -3.116 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -9.396 -6.612 -3.667 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -10.016 -10.004 -5.201 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -10.452 -5.780 -5.564 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -11.181 -10.311 -7.333 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -11.626 -6.090 -7.698 1.00 0.00 H new ATOM 0 HH TYR A 46 -12.995 -7.940 -8.806 1.00 0.00 H new ATOM 754 N GLU A 47 -7.760 -9.775 -5.714 1.00 0.00 N ATOM 755 CA GLU A 47 -7.694 -11.092 -6.347 1.00 0.00 C ATOM 756 C GLU A 47 -6.276 -11.644 -6.298 1.00 0.00 C ATOM 757 O GLU A 47 -6.066 -12.857 -6.301 1.00 0.00 O ATOM 758 CB GLU A 47 -8.166 -11.029 -7.806 1.00 0.00 C ATOM 759 CG GLU A 47 -8.028 -9.659 -8.455 1.00 0.00 C ATOM 760 CD GLU A 47 -8.063 -9.727 -9.970 1.00 0.00 C ATOM 761 OE1 GLU A 47 -7.134 -10.316 -10.559 1.00 0.00 O ATOM 762 OE2 GLU A 47 -9.021 -9.190 -10.566 1.00 0.00 O ATOM 0 H GLU A 47 -7.687 -8.991 -6.363 1.00 0.00 H new ATOM 0 HA GLU A 47 -8.357 -11.755 -5.791 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -7.598 -11.753 -8.390 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -9.211 -11.334 -7.850 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -8.833 -9.012 -8.105 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -7.091 -9.203 -8.137 1.00 0.00 H new ATOM 769 N SER A 48 -5.311 -10.740 -6.253 1.00 0.00 N ATOM 770 CA SER A 48 -3.903 -11.121 -6.203 1.00 0.00 C ATOM 771 C SER A 48 -3.294 -10.813 -4.836 1.00 0.00 C ATOM 772 O SER A 48 -2.113 -10.481 -4.734 1.00 0.00 O ATOM 773 CB SER A 48 -3.118 -10.394 -7.297 1.00 0.00 C ATOM 774 OG SER A 48 -3.619 -10.714 -8.583 1.00 0.00 O ATOM 0 H SER A 48 -5.475 -9.733 -6.250 1.00 0.00 H new ATOM 0 HA SER A 48 -3.842 -12.196 -6.370 1.00 0.00 H new ATOM 0 HB2 SER A 48 -3.178 -9.317 -7.138 1.00 0.00 H new ATOM 0 HB3 SER A 48 -2.065 -10.667 -7.235 1.00 0.00 H new ATOM 0 HG SER A 48 -4.262 -10.030 -8.863 1.00 0.00 H new ATOM 780 N PHE A 49 -4.105 -10.923 -3.787 1.00 0.00 N ATOM 781 CA PHE A 49 -3.640 -10.653 -2.430 1.00 0.00 C ATOM 782 C PHE A 49 -3.370 -11.955 -1.672 1.00 0.00 C ATOM 783 O PHE A 49 -4.231 -12.834 -1.613 1.00 0.00 O ATOM 784 CB PHE A 49 -4.674 -9.819 -1.672 1.00 0.00 C ATOM 785 CG PHE A 49 -4.067 -8.788 -0.764 1.00 0.00 C ATOM 786 CD1 PHE A 49 -3.185 -7.839 -1.260 1.00 0.00 C ATOM 787 CD2 PHE A 49 -4.378 -8.767 0.586 1.00 0.00 C ATOM 788 CE1 PHE A 49 -2.627 -6.890 -0.425 1.00 0.00 C ATOM 789 CE2 PHE A 49 -3.822 -7.820 1.425 1.00 0.00 C ATOM 790 CZ PHE A 49 -2.945 -6.880 0.919 1.00 0.00 C ATOM 0 H PHE A 49 -5.086 -11.197 -3.851 1.00 0.00 H new ATOM 0 HA PHE A 49 -2.707 -10.094 -2.500 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -5.324 -9.320 -2.391 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -5.304 -10.485 -1.082 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -2.932 -7.842 -2.310 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -5.063 -9.499 0.987 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -1.942 -6.156 -0.823 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -4.073 -7.815 2.475 1.00 0.00 H new ATOM 0 HZ PHE A 49 -2.509 -6.139 1.573 1.00 0.00 H new ATOM 800 N PRO A 50 -2.168 -12.101 -1.081 1.00 0.00 N ATOM 801 CA PRO A 50 -1.799 -13.307 -0.328 1.00 0.00 C ATOM 802 C PRO A 50 -2.704 -13.544 0.878 1.00 0.00 C ATOM 803 O PRO A 50 -2.865 -14.677 1.331 1.00 0.00 O ATOM 804 CB PRO A 50 -0.363 -13.028 0.136 1.00 0.00 C ATOM 805 CG PRO A 50 0.129 -11.935 -0.749 1.00 0.00 C ATOM 806 CD PRO A 50 -1.077 -11.112 -1.098 1.00 0.00 C ATOM 0 HA PRO A 50 -1.896 -14.203 -0.941 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -0.339 -12.727 1.183 1.00 0.00 H new ATOM 0 HB3 PRO A 50 0.260 -13.918 0.046 1.00 0.00 H new ATOM 0 HG2 PRO A 50 0.881 -11.330 -0.242 1.00 0.00 H new ATOM 0 HG3 PRO A 50 0.598 -12.340 -1.646 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -1.244 -10.314 -0.375 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -0.975 -10.640 -2.075 1.00 0.00 H new ATOM 814 N LYS A 51 -3.290 -12.469 1.398 1.00 0.00 N ATOM 815 CA LYS A 51 -4.175 -12.566 2.555 1.00 0.00 C ATOM 816 C LYS A 51 -5.356 -11.611 2.420 1.00 0.00 C ATOM 817 O LYS A 51 -5.349 -10.515 2.980 1.00 0.00 O ATOM 818 CB LYS A 51 -3.402 -12.262 3.841 1.00 0.00 C ATOM 819 CG LYS A 51 -2.882 -13.505 4.546 1.00 0.00 C ATOM 820 CD LYS A 51 -3.932 -14.102 5.469 1.00 0.00 C ATOM 821 CE LYS A 51 -3.697 -13.698 6.915 1.00 0.00 C ATOM 822 NZ LYS A 51 -4.501 -14.522 7.860 1.00 0.00 N ATOM 0 H LYS A 51 -3.168 -11.523 1.038 1.00 0.00 H new ATOM 0 HA LYS A 51 -4.560 -13.585 2.602 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -2.561 -11.610 3.604 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -4.050 -11.712 4.523 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -2.583 -14.247 3.805 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -1.991 -13.253 5.121 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -4.923 -13.774 5.155 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -3.915 -15.189 5.386 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -2.638 -13.802 7.153 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -3.951 -12.646 7.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -3.995 -14.605 8.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -5.423 -14.068 8.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -4.647 -15.469 7.457 1.00 0.00 H new ATOM 836 N ARG A 52 -6.370 -12.036 1.673 1.00 0.00 N ATOM 837 CA ARG A 52 -7.561 -11.218 1.464 1.00 0.00 C ATOM 838 C ARG A 52 -8.822 -11.944 1.941 1.00 0.00 C ATOM 839 O ARG A 52 -9.169 -12.999 1.409 1.00 0.00 O ATOM 840 CB ARG A 52 -7.705 -10.850 -0.016 1.00 0.00 C ATOM 841 CG ARG A 52 -7.423 -12.003 -0.971 1.00 0.00 C ATOM 842 CD ARG A 52 -8.687 -12.476 -1.669 1.00 0.00 C ATOM 843 NE ARG A 52 -8.391 -13.177 -2.917 1.00 0.00 N ATOM 844 CZ ARG A 52 -9.201 -14.074 -3.477 1.00 0.00 C ATOM 845 NH1 ARG A 52 -10.363 -14.378 -2.912 1.00 0.00 N ATOM 846 NH2 ARG A 52 -8.848 -14.667 -4.610 1.00 0.00 N ATOM 0 H ARG A 52 -6.392 -12.941 1.203 1.00 0.00 H new ATOM 0 HA ARG A 52 -7.444 -10.307 2.051 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -8.717 -10.485 -0.192 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -7.025 -10.029 -0.243 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -6.692 -11.688 -1.716 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -6.980 -12.832 -0.420 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -9.243 -13.137 -1.004 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -9.329 -11.620 -1.877 1.00 0.00 H new ATOM 0 HE ARG A 52 -7.511 -12.967 -3.388 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -10.642 -13.924 -2.042 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -10.977 -15.066 -3.347 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -7.958 -14.436 -5.051 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -9.467 -15.354 -5.040 1.00 0.00 H new ATOM 860 N PRO A 53 -9.535 -11.396 2.949 1.00 0.00 N ATOM 861 CA PRO A 53 -9.177 -10.149 3.622 1.00 0.00 C ATOM 862 C PRO A 53 -8.242 -10.374 4.807 1.00 0.00 C ATOM 863 O PRO A 53 -8.158 -11.480 5.341 1.00 0.00 O ATOM 864 CB PRO A 53 -10.531 -9.632 4.098 1.00 0.00 C ATOM 865 CG PRO A 53 -11.342 -10.859 4.364 1.00 0.00 C ATOM 866 CD PRO A 53 -10.769 -11.971 3.512 1.00 0.00 C ATOM 0 HA PRO A 53 -8.637 -9.462 2.970 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -10.428 -9.025 4.997 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -11.002 -9.004 3.342 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -11.302 -11.125 5.420 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -12.390 -10.688 4.118 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -10.559 -12.860 4.106 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -11.464 -12.269 2.727 1.00 0.00 H new ATOM 874 N LEU A 54 -7.543 -9.320 5.215 1.00 0.00 N ATOM 875 CA LEU A 54 -6.617 -9.403 6.339 1.00 0.00 C ATOM 876 C LEU A 54 -7.372 -9.591 7.656 1.00 0.00 C ATOM 877 O LEU A 54 -8.406 -8.960 7.885 1.00 0.00 O ATOM 878 CB LEU A 54 -5.753 -8.143 6.405 1.00 0.00 C ATOM 879 CG LEU A 54 -4.654 -8.055 5.346 1.00 0.00 C ATOM 880 CD1 LEU A 54 -4.411 -6.608 4.951 1.00 0.00 C ATOM 881 CD2 LEU A 54 -3.372 -8.696 5.854 1.00 0.00 C ATOM 0 H LEU A 54 -7.600 -8.397 4.784 1.00 0.00 H new ATOM 0 HA LEU A 54 -5.973 -10.269 6.186 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -6.400 -7.272 6.308 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -5.291 -8.089 7.391 1.00 0.00 H new ATOM 0 HG LEU A 54 -4.982 -8.601 4.461 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -3.626 -6.564 4.196 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -5.329 -6.183 4.545 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -4.104 -6.038 5.828 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -2.601 -8.624 5.087 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -3.038 -8.179 6.754 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -3.557 -9.745 6.086 1.00 0.00 H new ATOM 893 N PRO A 55 -6.869 -10.470 8.540 1.00 0.00 N ATOM 894 CA PRO A 55 -7.509 -10.747 9.830 1.00 0.00 C ATOM 895 C PRO A 55 -7.319 -9.627 10.850 1.00 0.00 C ATOM 896 O PRO A 55 -6.306 -8.927 10.846 1.00 0.00 O ATOM 897 CB PRO A 55 -6.805 -12.018 10.302 1.00 0.00 C ATOM 898 CG PRO A 55 -5.456 -11.954 9.677 1.00 0.00 C ATOM 899 CD PRO A 55 -5.645 -11.273 8.348 1.00 0.00 C ATOM 0 HA PRO A 55 -8.590 -10.843 9.727 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -6.737 -12.053 11.389 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -7.346 -12.911 9.988 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -4.761 -11.397 10.305 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -5.038 -12.952 9.548 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -4.790 -10.646 8.094 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -5.762 -11.996 7.540 1.00 0.00 H new ATOM 907 N GLU A 56 -8.304 -9.481 11.730 1.00 0.00 N ATOM 908 CA GLU A 56 -8.273 -8.467 12.780 1.00 0.00 C ATOM 909 C GLU A 56 -8.087 -7.060 12.214 1.00 0.00 C ATOM 910 O GLU A 56 -7.549 -6.182 12.888 1.00 0.00 O ATOM 911 CB GLU A 56 -7.154 -8.780 13.777 1.00 0.00 C ATOM 912 CG GLU A 56 -7.650 -9.409 15.069 1.00 0.00 C ATOM 913 CD GLU A 56 -7.098 -8.722 16.303 1.00 0.00 C ATOM 914 OE1 GLU A 56 -7.409 -7.529 16.508 1.00 0.00 O ATOM 915 OE2 GLU A 56 -6.355 -9.376 17.065 1.00 0.00 O ATOM 0 H GLU A 56 -9.144 -10.060 11.736 1.00 0.00 H new ATOM 0 HA GLU A 56 -9.237 -8.492 13.288 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -6.437 -9.453 13.307 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -6.620 -7.859 14.012 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -8.739 -9.370 15.093 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -7.368 -10.462 15.087 1.00 0.00 H new ATOM 922 N ARG A 57 -8.547 -6.840 10.987 1.00 0.00 N ATOM 923 CA ARG A 57 -8.435 -5.524 10.366 1.00 0.00 C ATOM 924 C ARG A 57 -9.568 -5.287 9.372 1.00 0.00 C ATOM 925 O ARG A 57 -10.200 -6.232 8.898 1.00 0.00 O ATOM 926 CB ARG A 57 -7.070 -5.361 9.685 1.00 0.00 C ATOM 927 CG ARG A 57 -6.969 -6.021 8.315 1.00 0.00 C ATOM 928 CD ARG A 57 -7.522 -5.133 7.205 1.00 0.00 C ATOM 929 NE ARG A 57 -7.289 -3.710 7.453 1.00 0.00 N ATOM 930 CZ ARG A 57 -6.139 -3.090 7.205 1.00 0.00 C ATOM 931 NH1 ARG A 57 -5.106 -3.763 6.713 1.00 0.00 N ATOM 932 NH2 ARG A 57 -6.022 -1.792 7.450 1.00 0.00 N ATOM 0 H ARG A 57 -8.997 -7.548 10.407 1.00 0.00 H new ATOM 0 HA ARG A 57 -8.518 -4.773 11.152 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -6.854 -4.298 9.580 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -6.301 -5.779 10.334 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -5.926 -6.257 8.103 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -7.513 -6.965 8.328 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -7.061 -5.413 6.258 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -8.593 -5.310 7.103 1.00 0.00 H new ATOM 0 HE ARG A 57 -8.056 -3.160 7.840 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -5.192 -4.761 6.523 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -4.227 -3.282 6.525 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -6.813 -1.271 7.828 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -5.141 -1.315 7.260 1.00 0.00 H new ATOM 946 N THR A 58 -9.815 -4.020 9.055 1.00 0.00 N ATOM 947 CA THR A 58 -10.865 -3.657 8.111 1.00 0.00 C ATOM 948 C THR A 58 -10.292 -3.519 6.705 1.00 0.00 C ATOM 949 O THR A 58 -9.421 -2.687 6.459 1.00 0.00 O ATOM 950 CB THR A 58 -11.531 -2.348 8.536 1.00 0.00 C ATOM 951 OG1 THR A 58 -11.665 -2.288 9.945 1.00 0.00 O ATOM 952 CG2 THR A 58 -12.907 -2.155 7.936 1.00 0.00 C ATOM 0 H THR A 58 -9.301 -3.227 9.439 1.00 0.00 H new ATOM 0 HA THR A 58 -11.614 -4.449 8.107 1.00 0.00 H new ATOM 0 HB THR A 58 -10.877 -1.558 8.167 1.00 0.00 H new ATOM 0 HG1 THR A 58 -11.901 -1.375 10.213 1.00 0.00 H new ATOM 0 HG21 THR A 58 -13.323 -1.207 8.278 1.00 0.00 H new ATOM 0 HG22 THR A 58 -12.832 -2.147 6.849 1.00 0.00 H new ATOM 0 HG23 THR A 58 -13.558 -2.971 8.249 1.00 0.00 H new ATOM 960 N ASN A 59 -10.777 -4.346 5.786 1.00 0.00 N ATOM 961 CA ASN A 59 -10.297 -4.314 4.410 1.00 0.00 C ATOM 962 C ASN A 59 -11.200 -3.466 3.523 1.00 0.00 C ATOM 963 O ASN A 59 -12.397 -3.331 3.777 1.00 0.00 O ATOM 964 CB ASN A 59 -10.204 -5.732 3.848 1.00 0.00 C ATOM 965 CG ASN A 59 -9.108 -6.542 4.507 1.00 0.00 C ATOM 966 OD1 ASN A 59 -8.049 -6.769 3.921 1.00 0.00 O ATOM 967 ND2 ASN A 59 -9.356 -6.985 5.734 1.00 0.00 N ATOM 0 H ASN A 59 -11.499 -5.044 5.968 1.00 0.00 H new ATOM 0 HA ASN A 59 -9.306 -3.861 4.417 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -11.159 -6.238 3.986 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -10.021 -5.683 2.775 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -8.655 -7.537 6.228 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -10.247 -6.773 6.182 1.00 0.00 H new ATOM 974 N VAL A 60 -10.611 -2.906 2.472 1.00 0.00 N ATOM 975 CA VAL A 60 -11.345 -2.078 1.526 1.00 0.00 C ATOM 976 C VAL A 60 -10.920 -2.411 0.097 1.00 0.00 C ATOM 977 O VAL A 60 -9.730 -2.437 -0.217 1.00 0.00 O ATOM 978 CB VAL A 60 -11.124 -0.575 1.803 1.00 0.00 C ATOM 979 CG1 VAL A 60 -11.725 0.280 0.696 1.00 0.00 C ATOM 980 CG2 VAL A 60 -11.707 -0.194 3.158 1.00 0.00 C ATOM 0 H VAL A 60 -9.620 -3.013 2.254 1.00 0.00 H new ATOM 0 HA VAL A 60 -12.407 -2.292 1.648 1.00 0.00 H new ATOM 0 HB VAL A 60 -10.051 -0.387 1.823 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -11.555 1.334 0.917 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -11.255 0.028 -0.254 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -12.797 0.091 0.632 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -11.543 0.868 3.339 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -12.777 -0.403 3.166 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -11.219 -0.775 3.941 1.00 0.00 H new ATOM 990 N VAL A 61 -11.900 -2.678 -0.758 1.00 0.00 N ATOM 991 CA VAL A 61 -11.634 -3.026 -2.148 1.00 0.00 C ATOM 992 C VAL A 61 -12.002 -1.883 -3.091 1.00 0.00 C ATOM 993 O VAL A 61 -13.014 -1.208 -2.903 1.00 0.00 O ATOM 994 CB VAL A 61 -12.413 -4.294 -2.556 1.00 0.00 C ATOM 995 CG1 VAL A 61 -12.211 -4.615 -4.031 1.00 0.00 C ATOM 996 CG2 VAL A 61 -11.999 -5.472 -1.686 1.00 0.00 C ATOM 0 H VAL A 61 -12.890 -2.660 -0.512 1.00 0.00 H new ATOM 0 HA VAL A 61 -10.564 -3.217 -2.231 1.00 0.00 H new ATOM 0 HB VAL A 61 -13.475 -4.104 -2.401 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -12.772 -5.513 -4.288 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -12.565 -3.781 -4.637 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -11.151 -4.781 -4.225 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -12.557 -6.359 -1.985 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -10.932 -5.656 -1.807 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -12.212 -5.245 -0.641 1.00 0.00 H new ATOM 1006 N LEU A 62 -11.173 -1.683 -4.111 1.00 0.00 N ATOM 1007 CA LEU A 62 -11.407 -0.633 -5.095 1.00 0.00 C ATOM 1008 C LEU A 62 -11.471 -1.221 -6.501 1.00 0.00 C ATOM 1009 O LEU A 62 -10.442 -1.469 -7.131 1.00 0.00 O ATOM 1010 CB LEU A 62 -10.305 0.425 -5.021 1.00 0.00 C ATOM 1011 CG LEU A 62 -10.647 1.762 -5.681 1.00 0.00 C ATOM 1012 CD1 LEU A 62 -11.653 2.533 -4.840 1.00 0.00 C ATOM 1013 CD2 LEU A 62 -9.388 2.587 -5.897 1.00 0.00 C ATOM 0 H LEU A 62 -10.332 -2.236 -4.277 1.00 0.00 H new ATOM 0 HA LEU A 62 -12.363 -0.161 -4.869 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -10.065 0.605 -3.973 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -9.406 0.025 -5.490 1.00 0.00 H new ATOM 0 HG LEU A 62 -11.097 1.560 -6.653 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -11.883 3.481 -5.326 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -12.566 1.947 -4.737 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -11.231 2.725 -3.853 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -9.650 3.535 -6.367 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -8.909 2.779 -4.937 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -8.701 2.040 -6.542 1.00 0.00 H new ATOM 1025 N THR A 63 -12.688 -1.436 -6.988 1.00 0.00 N ATOM 1026 CA THR A 63 -12.899 -1.987 -8.320 1.00 0.00 C ATOM 1027 C THR A 63 -13.913 -1.144 -9.093 1.00 0.00 C ATOM 1028 O THR A 63 -14.879 -0.642 -8.519 1.00 0.00 O ATOM 1029 CB THR A 63 -13.378 -3.436 -8.218 1.00 0.00 C ATOM 1030 OG1 THR A 63 -13.441 -4.039 -9.500 1.00 0.00 O ATOM 1031 CG2 THR A 63 -14.742 -3.572 -7.573 1.00 0.00 C ATOM 0 H THR A 63 -13.547 -1.236 -6.476 1.00 0.00 H new ATOM 0 HA THR A 63 -11.953 -1.967 -8.861 1.00 0.00 H new ATOM 0 HB THR A 63 -12.645 -3.938 -7.586 1.00 0.00 H new ATOM 0 HG1 THR A 63 -12.881 -3.535 -10.127 1.00 0.00 H new ATOM 0 HG21 THR A 63 -15.022 -4.625 -7.532 1.00 0.00 H new ATOM 0 HG22 THR A 63 -14.709 -3.166 -6.562 1.00 0.00 H new ATOM 0 HG23 THR A 63 -15.479 -3.024 -8.160 1.00 0.00 H new ATOM 1039 N HIS A 64 -13.688 -0.988 -10.394 1.00 0.00 N ATOM 1040 CA HIS A 64 -14.586 -0.199 -11.234 1.00 0.00 C ATOM 1041 C HIS A 64 -15.968 -0.842 -11.321 1.00 0.00 C ATOM 1042 O HIS A 64 -16.977 -0.150 -11.455 1.00 0.00 O ATOM 1043 CB HIS A 64 -14.001 -0.039 -12.638 1.00 0.00 C ATOM 1044 CG HIS A 64 -12.758 0.795 -12.677 1.00 0.00 C ATOM 1045 ND1 HIS A 64 -12.731 2.084 -13.166 1.00 0.00 N ATOM 1046 CD2 HIS A 64 -11.493 0.518 -12.282 1.00 0.00 C ATOM 1047 CE1 HIS A 64 -11.503 2.563 -13.072 1.00 0.00 C ATOM 1048 NE2 HIS A 64 -10.733 1.633 -12.538 1.00 0.00 N ATOM 0 H HIS A 64 -12.895 -1.395 -10.889 1.00 0.00 H new ATOM 0 HA HIS A 64 -14.692 0.784 -10.775 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -13.780 -1.026 -13.045 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -14.752 0.412 -13.286 1.00 0.00 H new ATOM 0 HD1 HIS A 64 -13.534 2.589 -13.542 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -11.146 -0.407 -11.847 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -11.184 3.548 -13.380 1.00 0.00 H new ATOM 1057 N GLN A 65 -16.005 -2.169 -11.249 1.00 0.00 N ATOM 1058 CA GLN A 65 -17.260 -2.911 -11.323 1.00 0.00 C ATOM 1059 C GLN A 65 -18.296 -2.335 -10.364 1.00 0.00 C ATOM 1060 O GLN A 65 -18.010 -2.111 -9.188 1.00 0.00 O ATOM 1061 CB GLN A 65 -17.021 -4.389 -11.007 1.00 0.00 C ATOM 1062 CG GLN A 65 -16.551 -5.199 -12.204 1.00 0.00 C ATOM 1063 CD GLN A 65 -15.593 -6.308 -11.817 1.00 0.00 C ATOM 1064 OE1 GLN A 65 -15.988 -7.465 -11.678 1.00 0.00 O ATOM 1065 NE2 GLN A 65 -14.324 -5.958 -11.641 1.00 0.00 N ATOM 0 H GLN A 65 -15.177 -2.755 -11.139 1.00 0.00 H new ATOM 0 HA GLN A 65 -17.645 -2.820 -12.338 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -16.279 -4.467 -10.212 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -17.944 -4.824 -10.624 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -17.416 -5.630 -12.708 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -16.064 -4.536 -12.918 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -14.041 -4.986 -11.767 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -13.633 -6.661 -11.380 1.00 0.00 H new ATOM 1074 N GLU A 66 -19.501 -2.105 -10.873 1.00 0.00 N ATOM 1075 CA GLU A 66 -20.582 -1.563 -10.060 1.00 0.00 C ATOM 1076 C GLU A 66 -21.275 -2.670 -9.272 1.00 0.00 C ATOM 1077 O GLU A 66 -21.725 -2.457 -8.146 1.00 0.00 O ATOM 1078 CB GLU A 66 -21.598 -0.832 -10.941 1.00 0.00 C ATOM 1079 CG GLU A 66 -22.138 -1.679 -12.082 1.00 0.00 C ATOM 1080 CD GLU A 66 -23.535 -1.267 -12.503 1.00 0.00 C ATOM 1081 OE1 GLU A 66 -24.357 -0.961 -11.613 1.00 0.00 O ATOM 1082 OE2 GLU A 66 -23.807 -1.249 -13.721 1.00 0.00 O ATOM 0 H GLU A 66 -19.753 -2.286 -11.845 1.00 0.00 H new ATOM 0 HA GLU A 66 -20.151 -0.853 -9.354 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -22.431 -0.500 -10.321 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -21.131 0.062 -11.353 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -21.467 -1.600 -12.937 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -22.148 -2.726 -11.779 1.00 0.00 H new ATOM 1089 N ASP A 67 -21.366 -3.850 -9.879 1.00 0.00 N ATOM 1090 CA ASP A 67 -22.014 -4.990 -9.242 1.00 0.00 C ATOM 1091 C ASP A 67 -21.004 -5.890 -8.535 1.00 0.00 C ATOM 1092 O ASP A 67 -21.291 -7.056 -8.263 1.00 0.00 O ATOM 1093 CB ASP A 67 -22.794 -5.800 -10.279 1.00 0.00 C ATOM 1094 CG ASP A 67 -23.805 -4.956 -11.030 1.00 0.00 C ATOM 1095 OD1 ASP A 67 -24.596 -4.250 -10.370 1.00 0.00 O ATOM 1096 OD2 ASP A 67 -23.807 -5.002 -12.278 1.00 0.00 O ATOM 0 H ASP A 67 -20.999 -4.041 -10.811 1.00 0.00 H new ATOM 0 HA ASP A 67 -22.701 -4.601 -8.491 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -22.096 -6.244 -10.989 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -23.309 -6.622 -9.782 1.00 0.00 H new ATOM 1101 N TYR A 68 -19.828 -5.350 -8.228 1.00 0.00 N ATOM 1102 CA TYR A 68 -18.798 -6.124 -7.544 1.00 0.00 C ATOM 1103 C TYR A 68 -19.186 -6.363 -6.088 1.00 0.00 C ATOM 1104 O TYR A 68 -19.608 -5.441 -5.391 1.00 0.00 O ATOM 1105 CB TYR A 68 -17.452 -5.403 -7.613 1.00 0.00 C ATOM 1106 CG TYR A 68 -16.305 -6.211 -7.047 1.00 0.00 C ATOM 1107 CD1 TYR A 68 -15.673 -7.184 -7.810 1.00 0.00 C ATOM 1108 CD2 TYR A 68 -15.857 -6.001 -5.749 1.00 0.00 C ATOM 1109 CE1 TYR A 68 -14.626 -7.925 -7.296 1.00 0.00 C ATOM 1110 CE2 TYR A 68 -14.810 -6.737 -5.228 1.00 0.00 C ATOM 1111 CZ TYR A 68 -14.199 -7.698 -6.005 1.00 0.00 C ATOM 1112 OH TYR A 68 -13.157 -8.433 -5.489 1.00 0.00 O ATOM 0 H TYR A 68 -19.566 -4.387 -8.440 1.00 0.00 H new ATOM 0 HA TYR A 68 -18.707 -7.087 -8.046 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -17.234 -5.156 -8.652 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -17.525 -4.461 -7.070 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -16.005 -7.365 -8.822 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -16.335 -5.250 -5.137 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -14.145 -8.678 -7.902 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -14.472 -6.560 -4.218 1.00 0.00 H new ATOM 0 HH TYR A 68 -12.307 -8.065 -5.809 1.00 0.00 H new ATOM 1122 N GLN A 69 -19.045 -7.605 -5.635 1.00 0.00 N ATOM 1123 CA GLN A 69 -19.388 -7.958 -4.262 1.00 0.00 C ATOM 1124 C GLN A 69 -18.196 -8.572 -3.535 1.00 0.00 C ATOM 1125 O GLN A 69 -17.840 -9.728 -3.766 1.00 0.00 O ATOM 1126 CB GLN A 69 -20.567 -8.932 -4.245 1.00 0.00 C ATOM 1127 CG GLN A 69 -21.846 -8.346 -4.821 1.00 0.00 C ATOM 1128 CD GLN A 69 -22.454 -7.282 -3.929 1.00 0.00 C ATOM 1129 OE1 GLN A 69 -23.419 -7.537 -3.208 1.00 0.00 O ATOM 1130 NE2 GLN A 69 -21.892 -6.080 -3.973 1.00 0.00 N ATOM 0 H GLN A 69 -18.697 -8.382 -6.197 1.00 0.00 H new ATOM 0 HA GLN A 69 -19.670 -7.043 -3.741 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -20.299 -9.825 -4.810 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -20.752 -9.248 -3.218 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -21.635 -7.917 -5.800 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -22.571 -9.145 -4.973 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -21.093 -5.912 -4.585 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -22.259 -5.324 -3.395 1.00 0.00 H new ATOM 1139 N ALA A 70 -17.586 -7.789 -2.651 1.00 0.00 N ATOM 1140 CA ALA A 70 -16.437 -8.249 -1.881 1.00 0.00 C ATOM 1141 C ALA A 70 -16.831 -8.524 -0.434 1.00 0.00 C ATOM 1142 O ALA A 70 -16.947 -7.603 0.376 1.00 0.00 O ATOM 1143 CB ALA A 70 -15.312 -7.226 -1.943 1.00 0.00 C ATOM 0 H ALA A 70 -17.870 -6.830 -2.450 1.00 0.00 H new ATOM 0 HA ALA A 70 -16.082 -9.181 -2.320 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -14.462 -7.585 -1.363 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -15.009 -7.081 -2.980 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -15.659 -6.278 -1.531 1.00 0.00 H new ATOM 1149 N GLN A 71 -17.038 -9.796 -0.117 1.00 0.00 N ATOM 1150 CA GLN A 71 -17.423 -10.197 1.229 1.00 0.00 C ATOM 1151 C GLN A 71 -16.255 -10.050 2.195 1.00 0.00 C ATOM 1152 O GLN A 71 -15.176 -10.599 1.970 1.00 0.00 O ATOM 1153 CB GLN A 71 -17.920 -11.644 1.230 1.00 0.00 C ATOM 1154 CG GLN A 71 -19.320 -11.806 0.659 1.00 0.00 C ATOM 1155 CD GLN A 71 -19.315 -12.399 -0.736 1.00 0.00 C ATOM 1156 OE1 GLN A 71 -18.332 -13.004 -1.164 1.00 0.00 O ATOM 1157 NE2 GLN A 71 -20.418 -12.227 -1.455 1.00 0.00 N ATOM 0 H GLN A 71 -16.945 -10.569 -0.776 1.00 0.00 H new ATOM 0 HA GLN A 71 -18.229 -9.542 1.559 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -17.228 -12.258 0.653 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -17.907 -12.023 2.252 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -19.906 -12.445 1.319 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -19.813 -10.834 0.635 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -21.210 -11.719 -1.061 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -20.474 -12.603 -2.402 1.00 0.00 H new ATOM 1166 N GLY A 72 -16.479 -9.310 3.274 1.00 0.00 N ATOM 1167 CA GLY A 72 -15.438 -9.110 4.261 1.00 0.00 C ATOM 1168 C GLY A 72 -14.792 -7.742 4.169 1.00 0.00 C ATOM 1169 O GLY A 72 -14.265 -7.235 5.159 1.00 0.00 O ATOM 0 H GLY A 72 -17.363 -8.845 3.482 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -15.860 -9.241 5.258 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -14.673 -9.876 4.135 1.00 0.00 H new ATOM 1173 N ALA A 73 -14.823 -7.137 2.983 1.00 0.00 N ATOM 1174 CA ALA A 73 -14.225 -5.820 2.787 1.00 0.00 C ATOM 1175 C ALA A 73 -15.229 -4.837 2.189 1.00 0.00 C ATOM 1176 O ALA A 73 -16.308 -5.230 1.746 1.00 0.00 O ATOM 1177 CB ALA A 73 -12.997 -5.932 1.893 1.00 0.00 C ATOM 0 H ALA A 73 -15.253 -7.536 2.149 1.00 0.00 H new ATOM 0 HA ALA A 73 -13.924 -5.437 3.762 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -12.558 -4.944 1.753 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -12.266 -6.591 2.360 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -13.288 -6.341 0.925 1.00 0.00 H new ATOM 1183 N VAL A 74 -14.864 -3.556 2.175 1.00 0.00 N ATOM 1184 CA VAL A 74 -15.731 -2.518 1.625 1.00 0.00 C ATOM 1185 C VAL A 74 -15.567 -2.426 0.113 1.00 0.00 C ATOM 1186 O VAL A 74 -14.463 -2.560 -0.407 1.00 0.00 O ATOM 1187 CB VAL A 74 -15.430 -1.138 2.244 1.00 0.00 C ATOM 1188 CG1 VAL A 74 -16.546 -0.156 1.923 1.00 0.00 C ATOM 1189 CG2 VAL A 74 -15.226 -1.253 3.750 1.00 0.00 C ATOM 0 H VAL A 74 -13.975 -3.213 2.538 1.00 0.00 H new ATOM 0 HA VAL A 74 -16.756 -2.797 1.870 1.00 0.00 H new ATOM 0 HB VAL A 74 -14.505 -0.761 1.807 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -16.317 0.813 2.367 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -16.635 -0.047 0.842 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -17.486 -0.529 2.329 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -15.015 -0.267 4.165 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -16.129 -1.655 4.210 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -14.388 -1.919 3.954 1.00 0.00 H new ATOM 1199 N VAL A 75 -16.672 -2.217 -0.592 1.00 0.00 N ATOM 1200 CA VAL A 75 -16.632 -2.132 -2.047 1.00 0.00 C ATOM 1201 C VAL A 75 -16.983 -0.737 -2.558 1.00 0.00 C ATOM 1202 O VAL A 75 -18.004 -0.159 -2.187 1.00 0.00 O ATOM 1203 CB VAL A 75 -17.581 -3.163 -2.690 1.00 0.00 C ATOM 1204 CG1 VAL A 75 -17.557 -3.050 -4.209 1.00 0.00 C ATOM 1205 CG2 VAL A 75 -17.208 -4.570 -2.248 1.00 0.00 C ATOM 0 H VAL A 75 -17.600 -2.104 -0.184 1.00 0.00 H new ATOM 0 HA VAL A 75 -15.604 -2.352 -2.337 1.00 0.00 H new ATOM 0 HB VAL A 75 -18.596 -2.952 -2.355 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -18.234 -3.788 -4.639 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -17.874 -2.050 -4.505 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -16.545 -3.232 -4.571 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -17.886 -5.288 -2.709 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -16.185 -4.788 -2.554 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -17.285 -4.643 -1.163 1.00 0.00 H new ATOM 1215 N VAL A 76 -16.127 -0.222 -3.435 1.00 0.00 N ATOM 1216 CA VAL A 76 -16.322 1.088 -4.042 1.00 0.00 C ATOM 1217 C VAL A 76 -15.790 1.077 -5.472 1.00 0.00 C ATOM 1218 O VAL A 76 -15.209 0.083 -5.910 1.00 0.00 O ATOM 1219 CB VAL A 76 -15.628 2.205 -3.238 1.00 0.00 C ATOM 1220 CG1 VAL A 76 -16.191 2.275 -1.827 1.00 0.00 C ATOM 1221 CG2 VAL A 76 -14.121 1.997 -3.208 1.00 0.00 C ATOM 0 H VAL A 76 -15.281 -0.701 -3.744 1.00 0.00 H new ATOM 0 HA VAL A 76 -17.392 1.296 -4.043 1.00 0.00 H new ATOM 0 HB VAL A 76 -15.826 3.155 -3.734 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -15.689 3.069 -1.274 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -17.260 2.483 -1.872 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -16.028 1.323 -1.323 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -13.654 2.798 -2.635 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -13.895 1.038 -2.741 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -13.732 2.006 -4.226 1.00 0.00 H new ATOM 1231 N HIS A 77 -15.997 2.163 -6.208 1.00 0.00 N ATOM 1232 CA HIS A 77 -15.534 2.222 -7.594 1.00 0.00 C ATOM 1233 C HIS A 77 -14.881 3.561 -7.942 1.00 0.00 C ATOM 1234 O HIS A 77 -14.228 3.680 -8.977 1.00 0.00 O ATOM 1235 CB HIS A 77 -16.698 1.949 -8.554 1.00 0.00 C ATOM 1236 CG HIS A 77 -17.763 1.068 -7.976 1.00 0.00 C ATOM 1237 ND1 HIS A 77 -17.494 -0.147 -7.382 1.00 0.00 N ATOM 1238 CD2 HIS A 77 -19.105 1.234 -7.895 1.00 0.00 C ATOM 1239 CE1 HIS A 77 -18.622 -0.691 -6.962 1.00 0.00 C ATOM 1240 NE2 HIS A 77 -19.614 0.128 -7.261 1.00 0.00 N ATOM 0 H HIS A 77 -16.474 3.002 -5.878 1.00 0.00 H new ATOM 0 HA HIS A 77 -14.772 1.451 -7.705 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -17.145 2.899 -8.848 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -16.308 1.486 -9.461 1.00 0.00 H new ATOM 0 HD1 HIS A 77 -16.567 -0.562 -7.282 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -19.669 2.079 -8.261 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -18.717 -1.643 -6.460 1.00 0.00 H new ATOM 1249 N ASP A 78 -15.064 4.572 -7.098 1.00 0.00 N ATOM 1250 CA ASP A 78 -14.487 5.887 -7.366 1.00 0.00 C ATOM 1251 C ASP A 78 -13.692 6.405 -6.173 1.00 0.00 C ATOM 1252 O ASP A 78 -13.896 5.971 -5.040 1.00 0.00 O ATOM 1253 CB ASP A 78 -15.591 6.884 -7.727 1.00 0.00 C ATOM 1254 CG ASP A 78 -15.170 7.838 -8.827 1.00 0.00 C ATOM 1255 OD1 ASP A 78 -14.004 8.286 -8.811 1.00 0.00 O ATOM 1256 OD2 ASP A 78 -16.006 8.138 -9.705 1.00 0.00 O ATOM 0 H ASP A 78 -15.600 4.509 -6.233 1.00 0.00 H new ATOM 0 HA ASP A 78 -13.802 5.782 -8.207 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -16.480 6.339 -8.043 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -15.866 7.455 -6.840 1.00 0.00 H new ATOM 1261 N VAL A 79 -12.787 7.343 -6.441 1.00 0.00 N ATOM 1262 CA VAL A 79 -11.961 7.932 -5.403 1.00 0.00 C ATOM 1263 C VAL A 79 -12.810 8.723 -4.418 1.00 0.00 C ATOM 1264 O VAL A 79 -12.552 8.720 -3.214 1.00 0.00 O ATOM 1265 CB VAL A 79 -10.886 8.857 -6.001 1.00 0.00 C ATOM 1266 CG1 VAL A 79 -9.691 8.050 -6.483 1.00 0.00 C ATOM 1267 CG2 VAL A 79 -11.456 9.704 -7.131 1.00 0.00 C ATOM 0 H VAL A 79 -12.610 7.710 -7.376 1.00 0.00 H new ATOM 0 HA VAL A 79 -11.470 7.112 -4.879 1.00 0.00 H new ATOM 0 HB VAL A 79 -10.550 9.532 -5.214 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -8.943 8.723 -6.902 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -9.259 7.504 -5.645 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -10.014 7.344 -7.248 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -10.674 10.347 -7.534 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -11.832 9.053 -7.920 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -12.271 10.319 -6.749 1.00 0.00 H new ATOM 1277 N ALA A 80 -13.830 9.393 -4.937 1.00 0.00 N ATOM 1278 CA ALA A 80 -14.727 10.183 -4.105 1.00 0.00 C ATOM 1279 C ALA A 80 -15.610 9.274 -3.263 1.00 0.00 C ATOM 1280 O ALA A 80 -15.860 9.545 -2.088 1.00 0.00 O ATOM 1281 CB ALA A 80 -15.576 11.107 -4.966 1.00 0.00 C ATOM 0 H ALA A 80 -14.057 9.405 -5.931 1.00 0.00 H new ATOM 0 HA ALA A 80 -14.126 10.796 -3.433 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -16.241 11.690 -4.328 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -14.927 11.781 -5.526 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -16.169 10.513 -5.661 1.00 0.00 H new ATOM 1287 N ALA A 81 -16.074 8.185 -3.870 1.00 0.00 N ATOM 1288 CA ALA A 81 -16.922 7.226 -3.174 1.00 0.00 C ATOM 1289 C ALA A 81 -16.253 6.754 -1.889 1.00 0.00 C ATOM 1290 O ALA A 81 -16.749 7.004 -0.791 1.00 0.00 O ATOM 1291 CB ALA A 81 -17.231 6.042 -4.078 1.00 0.00 C ATOM 0 H ALA A 81 -15.876 7.946 -4.842 1.00 0.00 H new ATOM 0 HA ALA A 81 -17.859 7.718 -2.912 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -17.865 5.333 -3.545 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -17.748 6.392 -4.971 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -16.301 5.551 -4.366 1.00 0.00 H new ATOM 1297 N VAL A 82 -15.121 6.071 -2.035 1.00 0.00 N ATOM 1298 CA VAL A 82 -14.376 5.563 -0.889 1.00 0.00 C ATOM 1299 C VAL A 82 -14.156 6.655 0.160 1.00 0.00 C ATOM 1300 O VAL A 82 -14.161 6.386 1.360 1.00 0.00 O ATOM 1301 CB VAL A 82 -13.012 4.981 -1.333 1.00 0.00 C ATOM 1302 CG1 VAL A 82 -11.974 6.080 -1.509 1.00 0.00 C ATOM 1303 CG2 VAL A 82 -12.523 3.937 -0.342 1.00 0.00 C ATOM 0 H VAL A 82 -14.699 5.857 -2.939 1.00 0.00 H new ATOM 0 HA VAL A 82 -14.972 4.768 -0.440 1.00 0.00 H new ATOM 0 HB VAL A 82 -13.156 4.498 -2.299 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -11.027 5.640 -1.821 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -12.315 6.784 -2.268 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -11.836 6.605 -0.564 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -11.563 3.542 -0.674 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -12.407 4.394 0.641 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -13.248 3.125 -0.281 1.00 0.00 H new ATOM 1313 N PHE A 83 -13.965 7.888 -0.297 1.00 0.00 N ATOM 1314 CA PHE A 83 -13.746 9.004 0.616 1.00 0.00 C ATOM 1315 C PHE A 83 -14.928 9.170 1.561 1.00 0.00 C ATOM 1316 O PHE A 83 -14.748 9.408 2.755 1.00 0.00 O ATOM 1317 CB PHE A 83 -13.503 10.297 -0.164 1.00 0.00 C ATOM 1318 CG PHE A 83 -12.048 10.634 -0.323 1.00 0.00 C ATOM 1319 CD1 PHE A 83 -11.207 10.667 0.777 1.00 0.00 C ATOM 1320 CD2 PHE A 83 -11.522 10.918 -1.573 1.00 0.00 C ATOM 1321 CE1 PHE A 83 -9.868 10.976 0.634 1.00 0.00 C ATOM 1322 CE2 PHE A 83 -10.183 11.228 -1.722 1.00 0.00 C ATOM 1323 CZ PHE A 83 -9.355 11.257 -0.617 1.00 0.00 C ATOM 0 H PHE A 83 -13.957 8.139 -1.286 1.00 0.00 H new ATOM 0 HA PHE A 83 -12.859 8.785 1.211 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -13.958 10.208 -1.151 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -14.005 11.120 0.345 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -11.603 10.449 1.758 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -12.165 10.897 -2.440 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -9.223 10.998 1.500 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -9.785 11.447 -2.702 1.00 0.00 H new ATOM 0 HZ PHE A 83 -8.309 11.499 -0.731 1.00 0.00 H new ATOM 1333 N ALA A 84 -16.138 9.025 1.030 1.00 0.00 N ATOM 1334 CA ALA A 84 -17.336 9.143 1.849 1.00 0.00 C ATOM 1335 C ALA A 84 -17.306 8.094 2.947 1.00 0.00 C ATOM 1336 O ALA A 84 -17.620 8.376 4.104 1.00 0.00 O ATOM 1337 CB ALA A 84 -18.589 8.996 0.999 1.00 0.00 C ATOM 0 H ALA A 84 -16.313 8.827 0.045 1.00 0.00 H new ATOM 0 HA ALA A 84 -17.358 10.134 2.303 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -19.471 9.088 1.633 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -18.606 9.776 0.238 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -18.589 8.019 0.517 1.00 0.00 H new ATOM 1343 N TYR A 85 -16.895 6.885 2.577 1.00 0.00 N ATOM 1344 CA TYR A 85 -16.790 5.801 3.538 1.00 0.00 C ATOM 1345 C TYR A 85 -15.834 6.223 4.651 1.00 0.00 C ATOM 1346 O TYR A 85 -16.226 6.308 5.814 1.00 0.00 O ATOM 1347 CB TYR A 85 -16.341 4.500 2.845 1.00 0.00 C ATOM 1348 CG TYR A 85 -15.011 3.943 3.314 1.00 0.00 C ATOM 1349 CD1 TYR A 85 -14.852 3.447 4.602 1.00 0.00 C ATOM 1350 CD2 TYR A 85 -13.916 3.918 2.463 1.00 0.00 C ATOM 1351 CE1 TYR A 85 -13.637 2.942 5.027 1.00 0.00 C ATOM 1352 CE2 TYR A 85 -12.699 3.414 2.878 1.00 0.00 C ATOM 1353 CZ TYR A 85 -12.564 2.928 4.160 1.00 0.00 C ATOM 1354 OH TYR A 85 -11.353 2.429 4.578 1.00 0.00 O ATOM 0 H TYR A 85 -16.631 6.636 1.624 1.00 0.00 H new ATOM 0 HA TYR A 85 -17.765 5.595 3.979 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -17.109 3.742 2.999 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -16.283 4.681 1.772 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -15.691 3.456 5.282 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -14.017 4.300 1.458 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -13.529 2.561 6.032 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -11.858 3.401 2.201 1.00 0.00 H new ATOM 0 HH TYR A 85 -10.691 2.535 3.863 1.00 0.00 H new ATOM 1364 N ALA A 86 -14.576 6.487 4.287 1.00 0.00 N ATOM 1365 CA ALA A 86 -13.571 6.902 5.261 1.00 0.00 C ATOM 1366 C ALA A 86 -14.127 7.954 6.212 1.00 0.00 C ATOM 1367 O ALA A 86 -13.749 8.009 7.382 1.00 0.00 O ATOM 1368 CB ALA A 86 -12.330 7.425 4.553 1.00 0.00 C ATOM 0 H ALA A 86 -14.233 6.420 3.329 1.00 0.00 H new ATOM 0 HA ALA A 86 -13.294 6.029 5.852 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -11.590 7.730 5.293 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -11.911 6.639 3.924 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -12.598 8.281 3.934 1.00 0.00 H new ATOM 1374 N LYS A 87 -15.048 8.770 5.711 1.00 0.00 N ATOM 1375 CA LYS A 87 -15.674 9.795 6.530 1.00 0.00 C ATOM 1376 C LYS A 87 -16.532 9.129 7.598 1.00 0.00 C ATOM 1377 O LYS A 87 -16.454 9.459 8.781 1.00 0.00 O ATOM 1378 CB LYS A 87 -16.528 10.721 5.659 1.00 0.00 C ATOM 1379 CG LYS A 87 -16.218 12.197 5.853 1.00 0.00 C ATOM 1380 CD LYS A 87 -15.811 12.861 4.545 1.00 0.00 C ATOM 1381 CE LYS A 87 -14.576 13.731 4.719 1.00 0.00 C ATOM 1382 NZ LYS A 87 -13.630 13.586 3.579 1.00 0.00 N ATOM 0 H LYS A 87 -15.375 8.740 4.745 1.00 0.00 H new ATOM 0 HA LYS A 87 -14.903 10.396 7.012 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -16.377 10.461 4.611 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -17.581 10.547 5.882 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -17.093 12.702 6.261 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -15.416 12.308 6.583 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -15.615 12.096 3.794 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -16.636 13.469 4.173 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -14.877 14.775 4.810 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -14.071 13.463 5.647 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -12.802 14.195 3.736 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -13.323 12.595 3.507 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -14.104 13.866 2.697 1.00 0.00 H new ATOM 1396 N GLN A 88 -17.349 8.181 7.154 1.00 0.00 N ATOM 1397 CA GLN A 88 -18.236 7.443 8.045 1.00 0.00 C ATOM 1398 C GLN A 88 -17.442 6.702 9.119 1.00 0.00 C ATOM 1399 O GLN A 88 -17.988 6.323 10.155 1.00 0.00 O ATOM 1400 CB GLN A 88 -19.083 6.450 7.247 1.00 0.00 C ATOM 1401 CG GLN A 88 -20.240 5.863 8.039 1.00 0.00 C ATOM 1402 CD GLN A 88 -21.253 6.911 8.455 1.00 0.00 C ATOM 1403 OE1 GLN A 88 -21.425 7.189 9.642 1.00 0.00 O ATOM 1404 NE2 GLN A 88 -21.931 7.499 7.476 1.00 0.00 N ATOM 0 H GLN A 88 -17.415 7.904 6.175 1.00 0.00 H new ATOM 0 HA GLN A 88 -18.893 8.161 8.536 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -19.476 6.950 6.362 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -18.444 5.639 6.898 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -20.737 5.101 7.439 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -19.852 5.365 8.928 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -21.756 7.237 6.506 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -22.627 8.212 7.694 1.00 0.00 H new ATOM 1413 N HIS A 89 -16.151 6.499 8.867 1.00 0.00 N ATOM 1414 CA HIS A 89 -15.287 5.804 9.814 1.00 0.00 C ATOM 1415 C HIS A 89 -14.270 6.762 10.434 1.00 0.00 C ATOM 1416 O HIS A 89 -13.087 6.729 10.093 1.00 0.00 O ATOM 1417 CB HIS A 89 -14.561 4.652 9.116 1.00 0.00 C ATOM 1418 CG HIS A 89 -15.274 3.340 9.226 1.00 0.00 C ATOM 1419 ND1 HIS A 89 -15.768 2.848 10.415 1.00 0.00 N ATOM 1420 CD2 HIS A 89 -15.575 2.414 8.284 1.00 0.00 C ATOM 1421 CE1 HIS A 89 -16.341 1.677 10.201 1.00 0.00 C ATOM 1422 NE2 HIS A 89 -16.238 1.391 8.917 1.00 0.00 N ATOM 0 H HIS A 89 -15.682 6.806 8.015 1.00 0.00 H new ATOM 0 HA HIS A 89 -15.912 5.404 10.613 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -14.433 4.899 8.062 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -13.563 4.551 9.543 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -15.338 2.470 7.232 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -16.814 1.059 10.950 1.00 0.00 H new ATOM 0 HE2 HIS A 89 -16.593 0.547 8.467 1.00 0.00 H new ATOM 1431 N PRO A 90 -14.718 7.632 11.357 1.00 0.00 N ATOM 1432 CA PRO A 90 -13.842 8.600 12.024 1.00 0.00 C ATOM 1433 C PRO A 90 -12.987 7.964 13.119 1.00 0.00 C ATOM 1434 O PRO A 90 -12.160 8.633 13.738 1.00 0.00 O ATOM 1435 CB PRO A 90 -14.830 9.593 12.632 1.00 0.00 C ATOM 1436 CG PRO A 90 -16.045 8.780 12.913 1.00 0.00 C ATOM 1437 CD PRO A 90 -16.115 7.742 11.824 1.00 0.00 C ATOM 0 HA PRO A 90 -13.126 9.046 11.334 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -14.433 10.042 13.542 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -15.048 10.409 11.943 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -15.981 8.311 13.895 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -16.939 9.403 12.915 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -16.487 6.790 12.201 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -16.783 8.049 11.020 1.00 0.00 H new ATOM 1445 N ASP A 91 -13.193 6.671 13.356 1.00 0.00 N ATOM 1446 CA ASP A 91 -12.441 5.954 14.380 1.00 0.00 C ATOM 1447 C ASP A 91 -11.211 5.269 13.788 1.00 0.00 C ATOM 1448 O ASP A 91 -10.268 4.941 14.508 1.00 0.00 O ATOM 1449 CB ASP A 91 -13.338 4.919 15.066 1.00 0.00 C ATOM 1450 CG ASP A 91 -13.666 5.297 16.497 1.00 0.00 C ATOM 1451 OD1 ASP A 91 -14.274 6.368 16.704 1.00 0.00 O ATOM 1452 OD2 ASP A 91 -13.315 4.521 17.411 1.00 0.00 O ATOM 0 H ASP A 91 -13.873 6.100 12.854 1.00 0.00 H new ATOM 0 HA ASP A 91 -12.101 6.681 15.117 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -14.263 4.812 14.500 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -12.843 3.948 15.054 1.00 0.00 H new ATOM 1457 N GLN A 92 -11.225 5.050 12.476 1.00 0.00 N ATOM 1458 CA GLN A 92 -10.107 4.400 11.801 1.00 0.00 C ATOM 1459 C GLN A 92 -9.457 5.334 10.785 1.00 0.00 C ATOM 1460 O GLN A 92 -9.998 6.392 10.461 1.00 0.00 O ATOM 1461 CB GLN A 92 -10.578 3.122 11.106 1.00 0.00 C ATOM 1462 CG GLN A 92 -10.939 2.004 12.071 1.00 0.00 C ATOM 1463 CD GLN A 92 -12.273 1.360 11.746 1.00 0.00 C ATOM 1464 OE1 GLN A 92 -12.449 0.773 10.679 1.00 0.00 O ATOM 1465 NE2 GLN A 92 -13.222 1.468 12.669 1.00 0.00 N ATOM 0 H GLN A 92 -11.996 5.312 11.861 1.00 0.00 H new ATOM 0 HA GLN A 92 -9.363 4.145 12.556 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -11.446 3.353 10.489 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -9.793 2.773 10.435 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -10.158 1.244 12.049 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -10.969 2.401 13.086 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -13.032 1.964 13.540 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -14.140 1.055 12.507 1.00 0.00 H new ATOM 1474 N GLU A 93 -8.292 4.932 10.285 1.00 0.00 N ATOM 1475 CA GLU A 93 -7.560 5.727 9.304 1.00 0.00 C ATOM 1476 C GLU A 93 -7.494 5.003 7.962 1.00 0.00 C ATOM 1477 O GLU A 93 -7.708 3.794 7.888 1.00 0.00 O ATOM 1478 CB GLU A 93 -6.147 6.025 9.811 1.00 0.00 C ATOM 1479 CG GLU A 93 -5.771 7.496 9.732 1.00 0.00 C ATOM 1480 CD GLU A 93 -4.345 7.709 9.263 1.00 0.00 C ATOM 1481 OE1 GLU A 93 -3.966 7.121 8.229 1.00 0.00 O ATOM 1482 OE2 GLU A 93 -3.607 8.464 9.931 1.00 0.00 O ATOM 0 H GLU A 93 -7.834 4.058 10.544 1.00 0.00 H new ATOM 0 HA GLU A 93 -8.091 6.668 9.162 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -6.063 5.692 10.845 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -5.431 5.444 9.230 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -6.453 8.006 9.052 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -5.899 7.953 10.713 1.00 0.00 H new ATOM 1489 N LEU A 94 -7.199 5.750 6.904 1.00 0.00 N ATOM 1490 CA LEU A 94 -7.109 5.176 5.566 1.00 0.00 C ATOM 1491 C LEU A 94 -5.653 4.946 5.170 1.00 0.00 C ATOM 1492 O LEU A 94 -4.833 5.863 5.216 1.00 0.00 O ATOM 1493 CB LEU A 94 -7.793 6.094 4.548 1.00 0.00 C ATOM 1494 CG LEU A 94 -8.935 5.449 3.761 1.00 0.00 C ATOM 1495 CD1 LEU A 94 -10.022 4.956 4.703 1.00 0.00 C ATOM 1496 CD2 LEU A 94 -9.508 6.435 2.753 1.00 0.00 C ATOM 0 H LEU A 94 -7.018 6.753 6.946 1.00 0.00 H new ATOM 0 HA LEU A 94 -7.619 4.213 5.574 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -8.181 6.967 5.072 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -7.043 6.452 3.843 1.00 0.00 H new ATOM 0 HG LEU A 94 -8.538 4.591 3.218 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -10.826 4.500 4.124 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -9.603 4.218 5.387 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -10.417 5.796 5.274 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -10.320 5.961 2.201 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -9.889 7.311 3.277 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -8.726 6.740 2.058 1.00 0.00 H new ATOM 1508 N VAL A 95 -5.341 3.712 4.784 1.00 0.00 N ATOM 1509 CA VAL A 95 -3.985 3.356 4.383 1.00 0.00 C ATOM 1510 C VAL A 95 -3.992 2.493 3.125 1.00 0.00 C ATOM 1511 O VAL A 95 -4.629 1.441 3.086 1.00 0.00 O ATOM 1512 CB VAL A 95 -3.251 2.599 5.507 1.00 0.00 C ATOM 1513 CG1 VAL A 95 -1.796 2.356 5.133 1.00 0.00 C ATOM 1514 CG2 VAL A 95 -3.351 3.365 6.818 1.00 0.00 C ATOM 0 H VAL A 95 -6.009 2.943 4.741 1.00 0.00 H new ATOM 0 HA VAL A 95 -3.459 4.288 4.177 1.00 0.00 H new ATOM 0 HB VAL A 95 -3.732 1.630 5.639 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -1.297 1.820 5.941 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -1.749 1.762 4.220 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -1.298 3.312 4.970 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -2.827 2.816 7.601 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -2.898 4.349 6.700 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -4.399 3.479 7.094 1.00 0.00 H new ATOM 1524 N ILE A 96 -3.277 2.945 2.099 1.00 0.00 N ATOM 1525 CA ILE A 96 -3.198 2.212 0.841 1.00 0.00 C ATOM 1526 C ILE A 96 -2.106 1.149 0.897 1.00 0.00 C ATOM 1527 O ILE A 96 -0.981 1.424 1.317 1.00 0.00 O ATOM 1528 CB ILE A 96 -2.921 3.154 -0.347 1.00 0.00 C ATOM 1529 CG1 ILE A 96 -3.817 4.393 -0.267 1.00 0.00 C ATOM 1530 CG2 ILE A 96 -3.135 2.424 -1.664 1.00 0.00 C ATOM 1531 CD1 ILE A 96 -5.294 4.078 -0.355 1.00 0.00 C ATOM 0 H ILE A 96 -2.745 3.815 2.115 1.00 0.00 H new ATOM 0 HA ILE A 96 -4.166 1.733 0.693 1.00 0.00 H new ATOM 0 HB ILE A 96 -1.881 3.478 -0.298 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -3.620 4.914 0.670 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -3.551 5.076 -1.073 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -2.935 3.103 -2.493 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -2.458 1.572 -1.722 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.165 2.073 -1.722 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -5.868 5.003 -0.291 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -5.505 3.585 -1.304 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -5.575 3.419 0.467 1.00 0.00 H new ATOM 1543 N ALA A 97 -2.443 -0.066 0.476 1.00 0.00 N ATOM 1544 CA ALA A 97 -1.488 -1.168 0.484 1.00 0.00 C ATOM 1545 C ALA A 97 -1.118 -1.596 -0.933 1.00 0.00 C ATOM 1546 O ALA A 97 -0.016 -2.089 -1.173 1.00 0.00 O ATOM 1547 CB ALA A 97 -2.052 -2.347 1.263 1.00 0.00 C ATOM 0 H ALA A 97 -3.369 -0.312 0.126 1.00 0.00 H new ATOM 0 HA ALA A 97 -0.579 -0.820 0.974 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -1.330 -3.163 1.262 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -2.253 -2.042 2.290 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -2.978 -2.682 0.796 1.00 0.00 H new ATOM 1553 N GLY A 98 -2.044 -1.408 -1.868 1.00 0.00 N ATOM 1554 CA GLY A 98 -1.789 -1.785 -3.246 1.00 0.00 C ATOM 1555 C GLY A 98 -3.051 -1.798 -4.092 1.00 0.00 C ATOM 1556 O GLY A 98 -4.154 -1.677 -3.559 1.00 0.00 O ATOM 0 H GLY A 98 -2.964 -1.002 -1.697 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -1.071 -1.090 -3.682 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -1.330 -2.774 -3.269 1.00 0.00 H new ATOM 1560 N GLY A 99 -2.902 -1.940 -5.415 1.00 0.00 N ATOM 1561 CA GLY A 99 -1.588 -2.078 -6.028 1.00 0.00 C ATOM 1562 C GLY A 99 -1.019 -0.752 -6.492 1.00 0.00 C ATOM 1563 O GLY A 99 -1.393 0.305 -5.983 1.00 0.00 O ATOM 0 H GLY A 99 -3.679 -1.962 -6.076 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -0.903 -2.532 -5.312 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -1.657 -2.757 -6.878 1.00 0.00 H new ATOM 1567 N ALA A 100 -0.110 -0.808 -7.460 1.00 0.00 N ATOM 1568 CA ALA A 100 0.515 0.394 -7.996 1.00 0.00 C ATOM 1569 C ALA A 100 -0.525 1.344 -8.581 1.00 0.00 C ATOM 1570 O ALA A 100 -0.374 2.563 -8.514 1.00 0.00 O ATOM 1571 CB ALA A 100 1.548 0.026 -9.052 1.00 0.00 C ATOM 0 H ALA A 100 0.210 -1.676 -7.890 1.00 0.00 H new ATOM 0 HA ALA A 100 1.015 0.908 -7.175 1.00 0.00 H new ATOM 0 HB1 ALA A 100 2.007 0.934 -9.444 1.00 0.00 H new ATOM 0 HB2 ALA A 100 2.316 -0.605 -8.605 1.00 0.00 H new ATOM 0 HB3 ALA A 100 1.062 -0.514 -9.864 1.00 0.00 H new ATOM 1577 N GLN A 101 -1.581 0.776 -9.157 1.00 0.00 N ATOM 1578 CA GLN A 101 -2.645 1.573 -9.757 1.00 0.00 C ATOM 1579 C GLN A 101 -3.374 2.397 -8.699 1.00 0.00 C ATOM 1580 O GLN A 101 -3.699 3.563 -8.922 1.00 0.00 O ATOM 1581 CB GLN A 101 -3.637 0.666 -10.491 1.00 0.00 C ATOM 1582 CG GLN A 101 -3.749 0.967 -11.976 1.00 0.00 C ATOM 1583 CD GLN A 101 -4.251 2.371 -12.250 1.00 0.00 C ATOM 1584 OE1 GLN A 101 -5.563 2.511 -12.398 1.00 0.00 O flip ATOM 1585 NE2 GLN A 101 -3.469 3.319 -12.327 1.00 0.00 N flip ATOM 0 H GLN A 101 -1.722 -0.232 -9.221 1.00 0.00 H new ATOM 0 HA GLN A 101 -2.192 2.259 -10.473 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -3.333 -0.372 -10.361 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -4.620 0.770 -10.032 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -2.773 0.836 -12.444 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -4.424 0.247 -12.439 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -2.468 3.165 -12.207 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -3.822 4.258 -12.511 1.00 0.00 H new ATOM 1594 N ILE A 102 -3.628 1.782 -7.548 1.00 0.00 N ATOM 1595 CA ILE A 102 -4.319 2.458 -6.456 1.00 0.00 C ATOM 1596 C ILE A 102 -3.492 3.620 -5.919 1.00 0.00 C ATOM 1597 O ILE A 102 -4.004 4.724 -5.734 1.00 0.00 O ATOM 1598 CB ILE A 102 -4.633 1.485 -5.302 1.00 0.00 C ATOM 1599 CG1 ILE A 102 -5.394 0.268 -5.827 1.00 0.00 C ATOM 1600 CG2 ILE A 102 -5.435 2.189 -4.215 1.00 0.00 C ATOM 1601 CD1 ILE A 102 -6.758 0.606 -6.386 1.00 0.00 C ATOM 0 H ILE A 102 -3.366 0.817 -7.348 1.00 0.00 H new ATOM 0 HA ILE A 102 -5.256 2.841 -6.862 1.00 0.00 H new ATOM 0 HB ILE A 102 -3.693 1.145 -4.868 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -4.801 -0.214 -6.604 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -5.510 -0.455 -5.019 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -5.648 1.488 -3.408 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -4.860 3.028 -3.824 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -6.372 2.556 -4.634 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -7.242 -0.304 -6.740 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -7.368 1.061 -5.606 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -6.648 1.305 -7.215 1.00 0.00 H new ATOM 1613 N PHE A 103 -2.212 3.365 -5.669 1.00 0.00 N ATOM 1614 CA PHE A 103 -1.316 4.394 -5.152 1.00 0.00 C ATOM 1615 C PHE A 103 -1.336 5.631 -6.045 1.00 0.00 C ATOM 1616 O PHE A 103 -1.161 6.752 -5.570 1.00 0.00 O ATOM 1617 CB PHE A 103 0.109 3.850 -5.041 1.00 0.00 C ATOM 1618 CG PHE A 103 0.268 2.800 -3.979 1.00 0.00 C ATOM 1619 CD1 PHE A 103 -0.162 3.037 -2.683 1.00 0.00 C ATOM 1620 CD2 PHE A 103 0.847 1.577 -4.276 1.00 0.00 C ATOM 1621 CE1 PHE A 103 -0.018 2.072 -1.704 1.00 0.00 C ATOM 1622 CE2 PHE A 103 0.994 0.609 -3.301 1.00 0.00 C ATOM 1623 CZ PHE A 103 0.560 0.857 -2.013 1.00 0.00 C ATOM 0 H PHE A 103 -1.772 2.457 -5.816 1.00 0.00 H new ATOM 0 HA PHE A 103 -1.665 4.680 -4.160 1.00 0.00 H new ATOM 0 HB2 PHE A 103 0.405 3.431 -6.003 1.00 0.00 H new ATOM 0 HB3 PHE A 103 0.789 4.675 -4.830 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -0.614 3.986 -2.435 1.00 0.00 H new ATOM 0 HD2 PHE A 103 1.187 1.378 -5.281 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -0.358 2.268 -0.698 1.00 0.00 H new ATOM 0 HE2 PHE A 103 1.448 -0.340 -3.545 1.00 0.00 H new ATOM 0 HZ PHE A 103 0.673 0.102 -1.249 1.00 0.00 H new ATOM 1633 N THR A 104 -1.550 5.417 -7.340 1.00 0.00 N ATOM 1634 CA THR A 104 -1.592 6.513 -8.301 1.00 0.00 C ATOM 1635 C THR A 104 -2.777 7.438 -8.035 1.00 0.00 C ATOM 1636 O THR A 104 -2.611 8.648 -7.896 1.00 0.00 O ATOM 1637 CB THR A 104 -1.672 5.967 -9.727 1.00 0.00 C ATOM 1638 OG1 THR A 104 -0.698 4.959 -9.933 1.00 0.00 O ATOM 1639 CG2 THR A 104 -1.466 7.029 -10.785 1.00 0.00 C ATOM 0 H THR A 104 -1.697 4.494 -7.748 1.00 0.00 H new ATOM 0 HA THR A 104 -0.674 7.090 -8.187 1.00 0.00 H new ATOM 0 HB THR A 104 -2.681 5.567 -9.828 1.00 0.00 H new ATOM 0 HG1 THR A 104 -0.924 4.171 -9.396 1.00 0.00 H new ATOM 0 HG21 THR A 104 -1.535 6.576 -11.774 1.00 0.00 H new ATOM 0 HG22 THR A 104 -2.233 7.797 -10.684 1.00 0.00 H new ATOM 0 HG23 THR A 104 -0.482 7.480 -10.661 1.00 0.00 H new ATOM 1647 N ALA A 105 -3.975 6.867 -7.973 1.00 0.00 N ATOM 1648 CA ALA A 105 -5.180 7.656 -7.731 1.00 0.00 C ATOM 1649 C ALA A 105 -5.039 8.513 -6.485 1.00 0.00 C ATOM 1650 O ALA A 105 -5.156 9.737 -6.552 1.00 0.00 O ATOM 1651 CB ALA A 105 -6.395 6.748 -7.619 1.00 0.00 C ATOM 0 H ALA A 105 -4.139 5.867 -8.086 1.00 0.00 H new ATOM 0 HA ALA A 105 -5.319 8.324 -8.581 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -7.285 7.351 -7.439 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -6.518 6.188 -8.546 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -6.254 6.053 -6.792 1.00 0.00 H new ATOM 1657 N PHE A 106 -4.790 7.879 -5.348 1.00 0.00 N ATOM 1658 CA PHE A 106 -4.640 8.605 -4.099 1.00 0.00 C ATOM 1659 C PHE A 106 -3.348 9.419 -4.081 1.00 0.00 C ATOM 1660 O PHE A 106 -3.173 10.283 -3.229 1.00 0.00 O ATOM 1661 CB PHE A 106 -4.665 7.632 -2.919 1.00 0.00 C ATOM 1662 CG PHE A 106 -5.982 6.930 -2.748 1.00 0.00 C ATOM 1663 CD1 PHE A 106 -6.293 5.818 -3.514 1.00 0.00 C ATOM 1664 CD2 PHE A 106 -6.909 7.381 -1.822 1.00 0.00 C ATOM 1665 CE1 PHE A 106 -7.503 5.168 -3.360 1.00 0.00 C ATOM 1666 CE2 PHE A 106 -8.121 6.736 -1.663 1.00 0.00 C ATOM 1667 CZ PHE A 106 -8.418 5.628 -2.433 1.00 0.00 C ATOM 0 H PHE A 106 -4.688 6.867 -5.266 1.00 0.00 H new ATOM 0 HA PHE A 106 -5.476 9.299 -4.011 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -3.881 6.888 -3.056 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -4.431 8.177 -2.004 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -5.581 5.455 -4.240 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -6.682 8.247 -1.217 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -7.733 4.302 -3.963 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -8.835 7.098 -0.938 1.00 0.00 H new ATOM 0 HZ PHE A 106 -9.364 5.122 -2.310 1.00 0.00 H new ATOM 1677 N LYS A 107 -2.437 9.141 -5.016 1.00 0.00 N ATOM 1678 CA LYS A 107 -1.167 9.865 -5.074 1.00 0.00 C ATOM 1679 C LYS A 107 -1.399 11.370 -4.951 1.00 0.00 C ATOM 1680 O LYS A 107 -0.588 12.092 -4.372 1.00 0.00 O ATOM 1681 CB LYS A 107 -0.400 9.514 -6.367 1.00 0.00 C ATOM 1682 CG LYS A 107 -0.546 10.513 -7.516 1.00 0.00 C ATOM 1683 CD LYS A 107 0.809 11.000 -8.008 1.00 0.00 C ATOM 1684 CE LYS A 107 0.796 12.493 -8.296 1.00 0.00 C ATOM 1685 NZ LYS A 107 -0.202 12.848 -9.342 1.00 0.00 N ATOM 0 H LYS A 107 -2.553 8.428 -5.736 1.00 0.00 H new ATOM 0 HA LYS A 107 -0.551 9.556 -4.230 1.00 0.00 H new ATOM 0 HB2 LYS A 107 0.659 9.418 -6.125 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -0.737 8.537 -6.714 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -1.087 10.046 -8.339 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -1.142 11.364 -7.186 1.00 0.00 H new ATOM 0 HD2 LYS A 107 1.569 10.780 -7.259 1.00 0.00 H new ATOM 0 HD3 LYS A 107 1.085 10.457 -8.912 1.00 0.00 H new ATOM 0 HE2 LYS A 107 0.570 13.038 -7.379 1.00 0.00 H new ATOM 0 HE3 LYS A 107 1.788 12.809 -8.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -0.180 13.874 -9.509 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 0.028 12.348 -10.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -1.152 12.570 -9.024 1.00 0.00 H new ATOM 1699 N ASP A 108 -2.525 11.827 -5.489 1.00 0.00 N ATOM 1700 CA ASP A 108 -2.888 13.235 -5.431 1.00 0.00 C ATOM 1701 C ASP A 108 -3.668 13.536 -4.154 1.00 0.00 C ATOM 1702 O ASP A 108 -3.487 14.583 -3.533 1.00 0.00 O ATOM 1703 CB ASP A 108 -3.721 13.621 -6.654 1.00 0.00 C ATOM 1704 CG ASP A 108 -2.868 13.850 -7.886 1.00 0.00 C ATOM 1705 OD1 ASP A 108 -2.348 14.975 -8.048 1.00 0.00 O ATOM 1706 OD2 ASP A 108 -2.718 12.905 -8.689 1.00 0.00 O ATOM 0 H ASP A 108 -3.204 11.238 -5.972 1.00 0.00 H new ATOM 0 HA ASP A 108 -1.971 13.824 -5.428 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -4.447 12.834 -6.859 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -4.287 14.526 -6.434 1.00 0.00 H new ATOM 1711 N ASP A 109 -4.547 12.610 -3.780 1.00 0.00 N ATOM 1712 CA ASP A 109 -5.375 12.772 -2.584 1.00 0.00 C ATOM 1713 C ASP A 109 -4.699 12.210 -1.329 1.00 0.00 C ATOM 1714 O ASP A 109 -5.328 12.107 -0.276 1.00 0.00 O ATOM 1715 CB ASP A 109 -6.733 12.096 -2.791 1.00 0.00 C ATOM 1716 CG ASP A 109 -7.890 13.061 -2.628 1.00 0.00 C ATOM 1717 OD1 ASP A 109 -8.036 13.633 -1.527 1.00 0.00 O ATOM 1718 OD2 ASP A 109 -8.652 13.246 -3.601 1.00 0.00 O ATOM 0 H ASP A 109 -4.706 11.739 -4.287 1.00 0.00 H new ATOM 0 HA ASP A 109 -5.515 13.842 -2.429 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -6.768 11.656 -3.788 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -6.842 11.279 -2.078 1.00 0.00 H new ATOM 1723 N VAL A 110 -3.429 11.832 -1.444 1.00 0.00 N ATOM 1724 CA VAL A 110 -2.696 11.266 -0.314 1.00 0.00 C ATOM 1725 C VAL A 110 -2.079 12.355 0.560 1.00 0.00 C ATOM 1726 O VAL A 110 -1.892 13.489 0.119 1.00 0.00 O ATOM 1727 CB VAL A 110 -1.583 10.310 -0.792 1.00 0.00 C ATOM 1728 CG1 VAL A 110 -0.533 11.062 -1.597 1.00 0.00 C ATOM 1729 CG2 VAL A 110 -0.946 9.595 0.390 1.00 0.00 C ATOM 0 H VAL A 110 -2.887 11.907 -2.305 1.00 0.00 H new ATOM 0 HA VAL A 110 -3.420 10.707 0.279 1.00 0.00 H new ATOM 0 HB VAL A 110 -2.034 9.560 -1.442 1.00 0.00 H new ATOM 0 HG11 VAL A 110 0.241 10.368 -1.923 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -1.001 11.519 -2.469 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -0.086 11.839 -0.976 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -0.164 8.926 0.032 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -0.512 10.329 1.069 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -1.705 9.017 0.917 1.00 0.00 H new ATOM 1739 N ASP A 111 -1.770 12.001 1.806 1.00 0.00 N ATOM 1740 CA ASP A 111 -1.180 12.946 2.749 1.00 0.00 C ATOM 1741 C ASP A 111 0.118 12.401 3.344 1.00 0.00 C ATOM 1742 O ASP A 111 1.098 13.132 3.485 1.00 0.00 O ATOM 1743 CB ASP A 111 -2.172 13.266 3.869 1.00 0.00 C ATOM 1744 CG ASP A 111 -2.113 14.720 4.295 1.00 0.00 C ATOM 1745 OD1 ASP A 111 -1.258 15.056 5.141 1.00 0.00 O ATOM 1746 OD2 ASP A 111 -2.922 15.522 3.783 1.00 0.00 O ATOM 0 H ASP A 111 -1.919 11.066 2.185 1.00 0.00 H new ATOM 0 HA ASP A 111 -0.946 13.860 2.203 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -3.182 13.029 3.535 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -1.963 12.629 4.729 1.00 0.00 H new ATOM 1751 N THR A 112 0.120 11.117 3.696 1.00 0.00 N ATOM 1752 CA THR A 112 1.304 10.488 4.278 1.00 0.00 C ATOM 1753 C THR A 112 1.850 9.398 3.362 1.00 0.00 C ATOM 1754 O THR A 112 1.130 8.864 2.519 1.00 0.00 O ATOM 1755 CB THR A 112 0.983 9.900 5.654 1.00 0.00 C ATOM 1756 OG1 THR A 112 0.384 10.876 6.489 1.00 0.00 O ATOM 1757 CG2 THR A 112 2.203 9.362 6.378 1.00 0.00 C ATOM 0 H THR A 112 -0.681 10.494 3.589 1.00 0.00 H new ATOM 0 HA THR A 112 2.066 11.258 4.393 1.00 0.00 H new ATOM 0 HB THR A 112 0.301 9.072 5.461 1.00 0.00 H new ATOM 0 HG1 THR A 112 0.185 10.481 7.363 1.00 0.00 H new ATOM 0 HG21 THR A 112 1.904 8.960 7.346 1.00 0.00 H new ATOM 0 HG22 THR A 112 2.660 8.572 5.783 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.923 10.167 6.526 1.00 0.00 H new ATOM 1765 N LEU A 113 3.130 9.077 3.530 1.00 0.00 N ATOM 1766 CA LEU A 113 3.775 8.057 2.717 1.00 0.00 C ATOM 1767 C LEU A 113 4.721 7.195 3.554 1.00 0.00 C ATOM 1768 O LEU A 113 5.525 7.707 4.333 1.00 0.00 O ATOM 1769 CB LEU A 113 4.547 8.723 1.580 1.00 0.00 C ATOM 1770 CG LEU A 113 4.170 8.274 0.171 1.00 0.00 C ATOM 1771 CD1 LEU A 113 2.684 8.481 -0.084 1.00 0.00 C ATOM 1772 CD2 LEU A 113 4.997 9.038 -0.846 1.00 0.00 C ATOM 0 H LEU A 113 3.739 9.511 4.223 1.00 0.00 H new ATOM 0 HA LEU A 113 3.003 7.406 2.307 1.00 0.00 H new ATOM 0 HB2 LEU A 113 4.401 9.801 1.649 1.00 0.00 H new ATOM 0 HB3 LEU A 113 5.610 8.535 1.729 1.00 0.00 H new ATOM 0 HG LEU A 113 4.380 7.209 0.074 1.00 0.00 H new ATOM 0 HD11 LEU A 113 2.439 8.154 -1.095 1.00 0.00 H new ATOM 0 HD12 LEU A 113 2.107 7.900 0.635 1.00 0.00 H new ATOM 0 HD13 LEU A 113 2.440 9.538 0.024 1.00 0.00 H new ATOM 0 HD21 LEU A 113 4.726 8.716 -1.851 1.00 0.00 H new ATOM 0 HD22 LEU A 113 4.804 10.106 -0.743 1.00 0.00 H new ATOM 0 HD23 LEU A 113 6.056 8.842 -0.675 1.00 0.00 H new ATOM 1784 N LEU A 114 4.621 5.884 3.369 1.00 0.00 N ATOM 1785 CA LEU A 114 5.464 4.928 4.082 1.00 0.00 C ATOM 1786 C LEU A 114 5.949 3.853 3.116 1.00 0.00 C ATOM 1787 O LEU A 114 5.152 3.067 2.598 1.00 0.00 O ATOM 1788 CB LEU A 114 4.690 4.287 5.237 1.00 0.00 C ATOM 1789 CG LEU A 114 4.206 5.262 6.312 1.00 0.00 C ATOM 1790 CD1 LEU A 114 2.852 4.832 6.853 1.00 0.00 C ATOM 1791 CD2 LEU A 114 5.225 5.359 7.438 1.00 0.00 C ATOM 0 H LEU A 114 3.958 5.454 2.725 1.00 0.00 H new ATOM 0 HA LEU A 114 6.324 5.456 4.495 1.00 0.00 H new ATOM 0 HB2 LEU A 114 3.826 3.762 4.829 1.00 0.00 H new ATOM 0 HB3 LEU A 114 5.325 3.537 5.708 1.00 0.00 H new ATOM 0 HG LEU A 114 4.096 6.248 5.860 1.00 0.00 H new ATOM 0 HD11 LEU A 114 2.524 5.538 7.616 1.00 0.00 H new ATOM 0 HD12 LEU A 114 2.125 4.813 6.041 1.00 0.00 H new ATOM 0 HD13 LEU A 114 2.934 3.837 7.290 1.00 0.00 H new ATOM 0 HD21 LEU A 114 4.866 6.057 8.195 1.00 0.00 H new ATOM 0 HD22 LEU A 114 5.365 4.376 7.888 1.00 0.00 H new ATOM 0 HD23 LEU A 114 6.175 5.714 7.039 1.00 0.00 H new ATOM 1803 N VAL A 115 7.250 3.835 2.846 1.00 0.00 N ATOM 1804 CA VAL A 115 7.802 2.866 1.906 1.00 0.00 C ATOM 1805 C VAL A 115 8.994 2.097 2.468 1.00 0.00 C ATOM 1806 O VAL A 115 9.735 2.593 3.315 1.00 0.00 O ATOM 1807 CB VAL A 115 8.233 3.555 0.599 1.00 0.00 C ATOM 1808 CG1 VAL A 115 7.046 4.236 -0.057 1.00 0.00 C ATOM 1809 CG2 VAL A 115 9.348 4.556 0.858 1.00 0.00 C ATOM 0 H VAL A 115 7.933 4.470 3.258 1.00 0.00 H new ATOM 0 HA VAL A 115 7.001 2.152 1.714 1.00 0.00 H new ATOM 0 HB VAL A 115 8.614 2.792 -0.080 1.00 0.00 H new ATOM 0 HG11 VAL A 115 7.368 4.718 -0.980 1.00 0.00 H new ATOM 0 HG12 VAL A 115 6.280 3.494 -0.283 1.00 0.00 H new ATOM 0 HG13 VAL A 115 6.636 4.985 0.620 1.00 0.00 H new ATOM 0 HG21 VAL A 115 9.636 5.030 -0.080 1.00 0.00 H new ATOM 0 HG22 VAL A 115 8.999 5.316 1.557 1.00 0.00 H new ATOM 0 HG23 VAL A 115 10.209 4.040 1.283 1.00 0.00 H new ATOM 1819 N THR A 116 9.170 0.882 1.955 1.00 0.00 N ATOM 1820 CA THR A 116 10.271 0.014 2.355 1.00 0.00 C ATOM 1821 C THR A 116 11.113 -0.343 1.131 1.00 0.00 C ATOM 1822 O THR A 116 10.745 -1.222 0.352 1.00 0.00 O ATOM 1823 CB THR A 116 9.729 -1.259 3.013 1.00 0.00 C ATOM 1824 OG1 THR A 116 9.164 -0.968 4.278 1.00 0.00 O ATOM 1825 CG2 THR A 116 10.780 -2.331 3.216 1.00 0.00 C ATOM 0 H THR A 116 8.554 0.473 1.252 1.00 0.00 H new ATOM 0 HA THR A 116 10.895 0.539 3.078 1.00 0.00 H new ATOM 0 HB THR A 116 8.978 -1.640 2.321 1.00 0.00 H new ATOM 0 HG1 THR A 116 9.539 -1.573 4.951 1.00 0.00 H new ATOM 0 HG21 THR A 116 10.325 -3.203 3.686 1.00 0.00 H new ATOM 0 HG22 THR A 116 11.199 -2.617 2.251 1.00 0.00 H new ATOM 0 HG23 THR A 116 11.573 -1.946 3.857 1.00 0.00 H new ATOM 1833 N ARG A 117 12.230 0.356 0.953 1.00 0.00 N ATOM 1834 CA ARG A 117 13.101 0.118 -0.194 1.00 0.00 C ATOM 1835 C ARG A 117 14.093 -1.013 0.069 1.00 0.00 C ATOM 1836 O ARG A 117 15.062 -0.844 0.809 1.00 0.00 O ATOM 1837 CB ARG A 117 13.859 1.397 -0.552 1.00 0.00 C ATOM 1838 CG ARG A 117 14.057 1.589 -2.047 1.00 0.00 C ATOM 1839 CD ARG A 117 13.039 2.558 -2.628 1.00 0.00 C ATOM 1840 NE ARG A 117 13.677 3.628 -3.393 1.00 0.00 N ATOM 1841 CZ ARG A 117 13.006 4.548 -4.081 1.00 0.00 C ATOM 1842 NH1 ARG A 117 11.679 4.534 -4.103 1.00 0.00 N ATOM 1843 NH2 ARG A 117 13.664 5.486 -4.748 1.00 0.00 N ATOM 0 H ARG A 117 12.553 1.089 1.585 1.00 0.00 H new ATOM 0 HA ARG A 117 12.468 -0.181 -1.029 1.00 0.00 H new ATOM 0 HB2 ARG A 117 13.317 2.254 -0.153 1.00 0.00 H new ATOM 0 HB3 ARG A 117 14.834 1.380 -0.064 1.00 0.00 H new ATOM 0 HG2 ARG A 117 15.064 1.962 -2.236 1.00 0.00 H new ATOM 0 HG3 ARG A 117 13.973 0.627 -2.552 1.00 0.00 H new ATOM 0 HD2 ARG A 117 12.347 2.015 -3.272 1.00 0.00 H new ATOM 0 HD3 ARG A 117 12.449 2.992 -1.821 1.00 0.00 H new ATOM 0 HE ARG A 117 14.696 3.672 -3.400 1.00 0.00 H new ATOM 0 HH11 ARG A 117 11.168 3.815 -3.591 1.00 0.00 H new ATOM 0 HH12 ARG A 117 11.170 5.242 -4.632 1.00 0.00 H new ATOM 0 HH21 ARG A 117 14.684 5.502 -4.733 1.00 0.00 H new ATOM 0 HH22 ARG A 117 13.150 6.192 -5.276 1.00 0.00 H new ATOM 1857 N LEU A 118 13.840 -2.165 -0.546 1.00 0.00 N ATOM 1858 CA LEU A 118 14.704 -3.330 -0.391 1.00 0.00 C ATOM 1859 C LEU A 118 16.046 -3.109 -1.083 1.00 0.00 C ATOM 1860 O LEU A 118 16.108 -2.533 -2.170 1.00 0.00 O ATOM 1861 CB LEU A 118 14.024 -4.572 -0.973 1.00 0.00 C ATOM 1862 CG LEU A 118 13.277 -5.441 0.040 1.00 0.00 C ATOM 1863 CD1 LEU A 118 11.831 -4.986 0.168 1.00 0.00 C ATOM 1864 CD2 LEU A 118 13.344 -6.906 -0.364 1.00 0.00 C ATOM 0 H LEU A 118 13.039 -2.316 -1.159 1.00 0.00 H new ATOM 0 HA LEU A 118 14.882 -3.480 0.674 1.00 0.00 H new ATOM 0 HB2 LEU A 118 13.321 -4.254 -1.743 1.00 0.00 H new ATOM 0 HB3 LEU A 118 14.780 -5.184 -1.465 1.00 0.00 H new ATOM 0 HG LEU A 118 13.758 -5.331 1.012 1.00 0.00 H new ATOM 0 HD11 LEU A 118 11.314 -5.615 0.893 1.00 0.00 H new ATOM 0 HD12 LEU A 118 11.804 -3.949 0.503 1.00 0.00 H new ATOM 0 HD13 LEU A 118 11.337 -5.067 -0.800 1.00 0.00 H new ATOM 0 HD21 LEU A 118 12.807 -7.510 0.368 1.00 0.00 H new ATOM 0 HD22 LEU A 118 12.887 -7.034 -1.345 1.00 0.00 H new ATOM 0 HD23 LEU A 118 14.385 -7.225 -0.404 1.00 0.00 H new ATOM 1876 N ALA A 119 17.117 -3.578 -0.450 1.00 0.00 N ATOM 1877 CA ALA A 119 18.457 -3.439 -1.008 1.00 0.00 C ATOM 1878 C ALA A 119 18.640 -4.350 -2.214 1.00 0.00 C ATOM 1879 O ALA A 119 19.044 -3.905 -3.288 1.00 0.00 O ATOM 1880 CB ALA A 119 19.506 -3.754 0.046 1.00 0.00 C ATOM 0 H ALA A 119 17.083 -4.058 0.450 1.00 0.00 H new ATOM 0 HA ALA A 119 18.582 -2.406 -1.333 1.00 0.00 H new ATOM 0 HB1 ALA A 119 20.501 -3.646 -0.387 1.00 0.00 H new ATOM 0 HB2 ALA A 119 19.398 -3.066 0.884 1.00 0.00 H new ATOM 0 HB3 ALA A 119 19.373 -4.777 0.397 1.00 0.00 H new ATOM 1886 N GLY A 120 18.341 -5.632 -2.026 1.00 0.00 N ATOM 1887 CA GLY A 120 18.479 -6.596 -3.102 1.00 0.00 C ATOM 1888 C GLY A 120 17.861 -6.115 -4.400 1.00 0.00 C ATOM 1889 O GLY A 120 16.999 -5.237 -4.397 1.00 0.00 O ATOM 0 H GLY A 120 18.005 -6.021 -1.145 1.00 0.00 H new ATOM 0 HA2 GLY A 120 19.536 -6.806 -3.263 1.00 0.00 H new ATOM 0 HA3 GLY A 120 18.010 -7.534 -2.806 1.00 0.00 H new ATOM 1893 N SER A 121 18.306 -6.687 -5.510 1.00 0.00 N ATOM 1894 CA SER A 121 17.794 -6.309 -6.822 1.00 0.00 C ATOM 1895 C SER A 121 16.881 -7.392 -7.388 1.00 0.00 C ATOM 1896 O SER A 121 17.163 -8.584 -7.267 1.00 0.00 O ATOM 1897 CB SER A 121 18.951 -6.044 -7.787 1.00 0.00 C ATOM 1898 OG SER A 121 18.626 -5.011 -8.701 1.00 0.00 O ATOM 0 H SER A 121 19.020 -7.415 -5.529 1.00 0.00 H new ATOM 0 HA SER A 121 17.210 -5.396 -6.705 1.00 0.00 H new ATOM 0 HB2 SER A 121 19.843 -5.768 -7.224 1.00 0.00 H new ATOM 0 HB3 SER A 121 19.189 -6.956 -8.334 1.00 0.00 H new ATOM 0 HG SER A 121 19.382 -4.859 -9.306 1.00 0.00 H new ATOM 1904 N PHE A 122 15.786 -6.965 -8.009 1.00 0.00 N ATOM 1905 CA PHE A 122 14.826 -7.892 -8.599 1.00 0.00 C ATOM 1906 C PHE A 122 14.192 -7.290 -9.848 1.00 0.00 C ATOM 1907 O PHE A 122 14.268 -6.082 -10.075 1.00 0.00 O ATOM 1908 CB PHE A 122 13.740 -8.253 -7.585 1.00 0.00 C ATOM 1909 CG PHE A 122 14.279 -8.823 -6.305 1.00 0.00 C ATOM 1910 CD1 PHE A 122 14.516 -10.183 -6.181 1.00 0.00 C ATOM 1911 CD2 PHE A 122 14.550 -7.998 -5.226 1.00 0.00 C ATOM 1912 CE1 PHE A 122 15.013 -10.709 -5.003 1.00 0.00 C ATOM 1913 CE2 PHE A 122 15.046 -8.518 -4.046 1.00 0.00 C ATOM 1914 CZ PHE A 122 15.278 -9.875 -3.934 1.00 0.00 C ATOM 0 H PHE A 122 15.541 -5.981 -8.117 1.00 0.00 H new ATOM 0 HA PHE A 122 15.361 -8.799 -8.882 1.00 0.00 H new ATOM 0 HB2 PHE A 122 13.155 -7.361 -7.358 1.00 0.00 H new ATOM 0 HB3 PHE A 122 13.059 -8.975 -8.036 1.00 0.00 H new ATOM 0 HD1 PHE A 122 14.310 -10.839 -7.014 1.00 0.00 H new ATOM 0 HD2 PHE A 122 14.372 -6.936 -5.308 1.00 0.00 H new ATOM 0 HE1 PHE A 122 15.194 -11.770 -4.919 1.00 0.00 H new ATOM 0 HE2 PHE A 122 15.252 -7.864 -3.212 1.00 0.00 H new ATOM 0 HZ PHE A 122 15.666 -10.283 -3.012 1.00 0.00 H new ATOM 1924 N GLU A 123 13.566 -8.139 -10.657 1.00 0.00 N ATOM 1925 CA GLU A 123 12.920 -7.687 -11.883 1.00 0.00 C ATOM 1926 C GLU A 123 11.469 -8.154 -11.942 1.00 0.00 C ATOM 1927 O GLU A 123 11.164 -9.307 -11.639 1.00 0.00 O ATOM 1928 CB GLU A 123 13.683 -8.200 -13.106 1.00 0.00 C ATOM 1929 CG GLU A 123 13.672 -9.715 -13.238 1.00 0.00 C ATOM 1930 CD GLU A 123 15.051 -10.288 -13.500 1.00 0.00 C ATOM 1931 OE1 GLU A 123 15.734 -9.795 -14.422 1.00 0.00 O ATOM 1932 OE2 GLU A 123 15.448 -11.230 -12.782 1.00 0.00 O ATOM 0 H GLU A 123 13.493 -9.142 -10.486 1.00 0.00 H new ATOM 0 HA GLU A 123 12.931 -6.597 -11.887 1.00 0.00 H new ATOM 0 HB2 GLU A 123 13.249 -7.762 -14.005 1.00 0.00 H new ATOM 0 HB3 GLU A 123 14.716 -7.856 -13.050 1.00 0.00 H new ATOM 0 HG2 GLU A 123 13.268 -10.153 -12.325 1.00 0.00 H new ATOM 0 HG3 GLU A 123 13.004 -10.000 -14.051 1.00 0.00 H new ATOM 1939 N GLY A 124 10.581 -7.248 -12.335 1.00 0.00 N ATOM 1940 CA GLY A 124 9.172 -7.580 -12.430 1.00 0.00 C ATOM 1941 C GLY A 124 8.472 -6.809 -13.531 1.00 0.00 C ATOM 1942 O GLY A 124 9.037 -6.598 -14.605 1.00 0.00 O ATOM 0 H GLY A 124 10.812 -6.288 -12.590 1.00 0.00 H new ATOM 0 HA2 GLY A 124 9.065 -8.649 -12.613 1.00 0.00 H new ATOM 0 HA3 GLY A 124 8.686 -7.370 -11.477 1.00 0.00 H new ATOM 1946 N ASP A 125 7.241 -6.386 -13.267 1.00 0.00 N ATOM 1947 CA ASP A 125 6.467 -5.634 -14.246 1.00 0.00 C ATOM 1948 C ASP A 125 5.552 -4.622 -13.563 1.00 0.00 C ATOM 1949 O ASP A 125 4.524 -4.231 -14.116 1.00 0.00 O ATOM 1950 CB ASP A 125 5.639 -6.585 -15.112 1.00 0.00 C ATOM 1951 CG ASP A 125 6.354 -6.971 -16.393 1.00 0.00 C ATOM 1952 OD1 ASP A 125 7.470 -7.524 -16.306 1.00 0.00 O ATOM 1953 OD2 ASP A 125 5.796 -6.721 -17.482 1.00 0.00 O ATOM 0 H ASP A 125 6.758 -6.551 -12.384 1.00 0.00 H new ATOM 0 HA ASP A 125 7.166 -5.090 -14.881 1.00 0.00 H new ATOM 0 HB2 ASP A 125 5.410 -7.485 -14.542 1.00 0.00 H new ATOM 0 HB3 ASP A 125 4.688 -6.113 -15.358 1.00 0.00 H new ATOM 1958 N THR A 126 5.928 -4.201 -12.359 1.00 0.00 N ATOM 1959 CA THR A 126 5.132 -3.234 -11.610 1.00 0.00 C ATOM 1960 C THR A 126 6.017 -2.349 -10.737 1.00 0.00 C ATOM 1961 O THR A 126 6.557 -2.796 -9.724 1.00 0.00 O ATOM 1962 CB THR A 126 4.094 -3.952 -10.745 1.00 0.00 C ATOM 1963 OG1 THR A 126 3.974 -5.312 -11.124 1.00 0.00 O ATOM 1964 CG2 THR A 126 2.716 -3.330 -10.829 1.00 0.00 C ATOM 0 H THR A 126 6.775 -4.512 -11.883 1.00 0.00 H new ATOM 0 HA THR A 126 4.617 -2.598 -12.330 1.00 0.00 H new ATOM 0 HB THR A 126 4.458 -3.860 -9.722 1.00 0.00 H new ATOM 0 HG1 THR A 126 3.306 -5.752 -10.557 1.00 0.00 H new ATOM 0 HG21 THR A 126 2.027 -3.885 -10.193 1.00 0.00 H new ATOM 0 HG22 THR A 126 2.764 -2.294 -10.494 1.00 0.00 H new ATOM 0 HG23 THR A 126 2.364 -3.362 -11.860 1.00 0.00 H new ATOM 1972 N LYS A 127 6.154 -1.088 -11.137 1.00 0.00 N ATOM 1973 CA LYS A 127 6.962 -0.126 -10.397 1.00 0.00 C ATOM 1974 C LYS A 127 6.084 0.996 -9.848 1.00 0.00 C ATOM 1975 O LYS A 127 4.935 1.152 -10.260 1.00 0.00 O ATOM 1976 CB LYS A 127 8.053 0.457 -11.299 1.00 0.00 C ATOM 1977 CG LYS A 127 9.383 -0.271 -11.192 1.00 0.00 C ATOM 1978 CD LYS A 127 9.483 -1.402 -12.203 1.00 0.00 C ATOM 1979 CE LYS A 127 10.879 -1.497 -12.797 1.00 0.00 C ATOM 1980 NZ LYS A 127 11.910 -1.760 -11.755 1.00 0.00 N ATOM 0 H LYS A 127 5.713 -0.708 -11.974 1.00 0.00 H new ATOM 0 HA LYS A 127 7.434 -0.643 -9.561 1.00 0.00 H new ATOM 0 HB2 LYS A 127 7.713 0.425 -12.334 1.00 0.00 H new ATOM 0 HB3 LYS A 127 8.201 1.506 -11.044 1.00 0.00 H new ATOM 0 HG2 LYS A 127 10.199 0.434 -11.352 1.00 0.00 H new ATOM 0 HG3 LYS A 127 9.500 -0.671 -10.185 1.00 0.00 H new ATOM 0 HD2 LYS A 127 9.227 -2.346 -11.721 1.00 0.00 H new ATOM 0 HD3 LYS A 127 8.757 -1.244 -13.001 1.00 0.00 H new ATOM 0 HE2 LYS A 127 10.903 -2.293 -13.541 1.00 0.00 H new ATOM 0 HE3 LYS A 127 11.116 -0.568 -13.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 12.710 -2.271 -12.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 12.245 -0.857 -11.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 11.496 -2.336 -10.994 1.00 0.00 H new ATOM 1994 N MET A 128 6.627 1.773 -8.917 1.00 0.00 N ATOM 1995 CA MET A 128 5.883 2.876 -8.317 1.00 0.00 C ATOM 1996 C MET A 128 5.555 3.946 -9.355 1.00 0.00 C ATOM 1997 O MET A 128 6.155 3.990 -10.428 1.00 0.00 O ATOM 1998 CB MET A 128 6.679 3.492 -7.165 1.00 0.00 C ATOM 1999 CG MET A 128 5.880 4.485 -6.335 1.00 0.00 C ATOM 2000 SD MET A 128 4.350 3.781 -5.689 1.00 0.00 S ATOM 2001 CE MET A 128 3.588 5.232 -4.967 1.00 0.00 C ATOM 0 H MET A 128 7.577 1.661 -8.562 1.00 0.00 H new ATOM 0 HA MET A 128 4.946 2.476 -7.929 1.00 0.00 H new ATOM 0 HB2 MET A 128 7.038 2.694 -6.515 1.00 0.00 H new ATOM 0 HB3 MET A 128 7.558 3.994 -7.569 1.00 0.00 H new ATOM 0 HG2 MET A 128 6.493 4.834 -5.504 1.00 0.00 H new ATOM 0 HG3 MET A 128 5.645 5.356 -6.946 1.00 0.00 H new ATOM 0 HE1 MET A 128 3.150 4.971 -4.004 1.00 0.00 H new ATOM 0 HE2 MET A 128 4.342 6.006 -4.825 1.00 0.00 H new ATOM 0 HE3 MET A 128 2.808 5.603 -5.632 1.00 0.00 H new ATOM 2011 N ILE A 129 4.595 4.807 -9.025 1.00 0.00 N ATOM 2012 CA ILE A 129 4.181 5.877 -9.924 1.00 0.00 C ATOM 2013 C ILE A 129 4.785 7.217 -9.502 1.00 0.00 C ATOM 2014 O ILE A 129 5.093 7.424 -8.328 1.00 0.00 O ATOM 2015 CB ILE A 129 2.643 6.006 -9.968 1.00 0.00 C ATOM 2016 CG1 ILE A 129 2.098 6.418 -8.597 1.00 0.00 C ATOM 2017 CG2 ILE A 129 2.010 4.696 -10.421 1.00 0.00 C ATOM 2018 CD1 ILE A 129 1.953 7.914 -8.431 1.00 0.00 C ATOM 0 H ILE A 129 4.089 4.783 -8.139 1.00 0.00 H new ATOM 0 HA ILE A 129 4.546 5.617 -10.918 1.00 0.00 H new ATOM 0 HB ILE A 129 2.384 6.782 -10.689 1.00 0.00 H new ATOM 0 HG12 ILE A 129 1.127 5.948 -8.445 1.00 0.00 H new ATOM 0 HG13 ILE A 129 2.762 6.037 -7.821 1.00 0.00 H new ATOM 0 HG21 ILE A 129 0.926 4.805 -10.446 1.00 0.00 H new ATOM 0 HG22 ILE A 129 2.372 4.442 -11.417 1.00 0.00 H new ATOM 0 HG23 ILE A 129 2.279 3.902 -9.724 1.00 0.00 H new ATOM 0 HD11 ILE A 129 1.562 8.134 -7.437 1.00 0.00 H new ATOM 0 HD12 ILE A 129 2.926 8.389 -8.551 1.00 0.00 H new ATOM 0 HD13 ILE A 129 1.266 8.299 -9.184 1.00 0.00 H new ATOM 2030 N PRO A 130 4.959 8.149 -10.456 1.00 0.00 N ATOM 2031 CA PRO A 130 5.526 9.474 -10.173 1.00 0.00 C ATOM 2032 C PRO A 130 4.634 10.296 -9.248 1.00 0.00 C ATOM 2033 O PRO A 130 3.438 10.447 -9.498 1.00 0.00 O ATOM 2034 CB PRO A 130 5.618 10.132 -11.554 1.00 0.00 C ATOM 2035 CG PRO A 130 4.631 9.400 -12.396 1.00 0.00 C ATOM 2036 CD PRO A 130 4.616 7.989 -11.880 1.00 0.00 C ATOM 0 HA PRO A 130 6.485 9.404 -9.660 1.00 0.00 H new ATOM 0 HB2 PRO A 130 5.381 11.195 -11.502 1.00 0.00 H new ATOM 0 HB3 PRO A 130 6.625 10.050 -11.964 1.00 0.00 H new ATOM 0 HG2 PRO A 130 3.642 9.853 -12.322 1.00 0.00 H new ATOM 0 HG3 PRO A 130 4.917 9.428 -13.447 1.00 0.00 H new ATOM 0 HD2 PRO A 130 3.639 7.523 -12.009 1.00 0.00 H new ATOM 0 HD3 PRO A 130 5.340 7.362 -12.401 1.00 0.00 H new ATOM 2044 N LEU A 131 5.220 10.817 -8.174 1.00 0.00 N ATOM 2045 CA LEU A 131 4.473 11.615 -7.206 1.00 0.00 C ATOM 2046 C LEU A 131 5.088 13.002 -7.041 1.00 0.00 C ATOM 2047 O LEU A 131 6.232 13.236 -7.429 1.00 0.00 O ATOM 2048 CB LEU A 131 4.438 10.912 -5.841 1.00 0.00 C ATOM 2049 CG LEU A 131 4.612 9.388 -5.867 1.00 0.00 C ATOM 2050 CD1 LEU A 131 5.467 8.928 -4.697 1.00 0.00 C ATOM 2051 CD2 LEU A 131 3.257 8.699 -5.840 1.00 0.00 C ATOM 0 H LEU A 131 6.209 10.701 -7.952 1.00 0.00 H new ATOM 0 HA LEU A 131 3.457 11.724 -7.586 1.00 0.00 H new ATOM 0 HB2 LEU A 131 5.223 11.337 -5.215 1.00 0.00 H new ATOM 0 HB3 LEU A 131 3.487 11.141 -5.360 1.00 0.00 H new ATOM 0 HG LEU A 131 5.120 9.115 -6.792 1.00 0.00 H new ATOM 0 HD11 LEU A 131 5.579 7.844 -4.732 1.00 0.00 H new ATOM 0 HD12 LEU A 131 6.449 9.397 -4.758 1.00 0.00 H new ATOM 0 HD13 LEU A 131 4.986 9.213 -3.761 1.00 0.00 H new ATOM 0 HD21 LEU A 131 3.398 7.618 -5.859 1.00 0.00 H new ATOM 0 HD22 LEU A 131 2.724 8.980 -4.931 1.00 0.00 H new ATOM 0 HD23 LEU A 131 2.676 9.004 -6.710 1.00 0.00 H new ATOM 2063 N ASN A 132 4.325 13.912 -6.440 1.00 0.00 N ATOM 2064 CA ASN A 132 4.799 15.270 -6.198 1.00 0.00 C ATOM 2065 C ASN A 132 5.598 15.309 -4.901 1.00 0.00 C ATOM 2066 O ASN A 132 5.078 15.668 -3.845 1.00 0.00 O ATOM 2067 CB ASN A 132 3.623 16.246 -6.123 1.00 0.00 C ATOM 2068 CG ASN A 132 3.945 17.588 -6.752 1.00 0.00 C ATOM 2069 OD1 ASN A 132 3.215 18.073 -7.616 1.00 0.00 O ATOM 2070 ND2 ASN A 132 5.045 18.195 -6.320 1.00 0.00 N ATOM 0 H ASN A 132 3.376 13.732 -6.112 1.00 0.00 H new ATOM 0 HA ASN A 132 5.441 15.572 -7.026 1.00 0.00 H new ATOM 0 HB2 ASN A 132 2.760 15.810 -6.626 1.00 0.00 H new ATOM 0 HB3 ASN A 132 3.343 16.394 -5.080 1.00 0.00 H new ATOM 0 HD21 ASN A 132 5.313 19.100 -6.707 1.00 0.00 H new ATOM 0 HD22 ASN A 132 5.621 17.756 -5.602 1.00 0.00 H new ATOM 2077 N TRP A 133 6.859 14.907 -4.989 1.00 0.00 N ATOM 2078 CA TRP A 133 7.737 14.858 -3.828 1.00 0.00 C ATOM 2079 C TRP A 133 7.960 16.235 -3.206 1.00 0.00 C ATOM 2080 O TRP A 133 8.115 16.345 -1.991 1.00 0.00 O ATOM 2081 CB TRP A 133 9.074 14.225 -4.210 1.00 0.00 C ATOM 2082 CG TRP A 133 8.929 12.815 -4.697 1.00 0.00 C ATOM 2083 CD1 TRP A 133 8.584 12.415 -5.956 1.00 0.00 C ATOM 2084 CD2 TRP A 133 9.115 11.618 -3.932 1.00 0.00 C ATOM 2085 NE1 TRP A 133 8.544 11.043 -6.020 1.00 0.00 N ATOM 2086 CE2 TRP A 133 8.868 10.531 -4.792 1.00 0.00 C ATOM 2087 CE3 TRP A 133 9.467 11.359 -2.604 1.00 0.00 C ATOM 2088 CZ2 TRP A 133 8.962 9.209 -4.366 1.00 0.00 C ATOM 2089 CZ3 TRP A 133 9.561 10.046 -2.183 1.00 0.00 C ATOM 2090 CH2 TRP A 133 9.309 8.985 -3.062 1.00 0.00 C ATOM 0 H TRP A 133 7.299 14.608 -5.859 1.00 0.00 H new ATOM 0 HA TRP A 133 7.244 14.244 -3.074 1.00 0.00 H new ATOM 0 HB2 TRP A 133 9.547 14.826 -4.986 1.00 0.00 H new ATOM 0 HB3 TRP A 133 9.738 14.240 -3.346 1.00 0.00 H new ATOM 0 HD1 TRP A 133 8.373 13.080 -6.781 1.00 0.00 H new ATOM 0 HE1 TRP A 133 8.311 10.495 -6.848 1.00 0.00 H new ATOM 0 HE3 TRP A 133 9.662 12.171 -1.919 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 8.768 8.389 -5.041 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 9.833 9.835 -1.159 1.00 0.00 H new ATOM 0 HH2 TRP A 133 9.390 7.970 -2.703 1.00 0.00 H new ATOM 2101 N ASP A 134 7.981 17.285 -4.023 1.00 0.00 N ATOM 2102 CA ASP A 134 8.191 18.636 -3.509 1.00 0.00 C ATOM 2103 C ASP A 134 7.132 19.001 -2.473 1.00 0.00 C ATOM 2104 O ASP A 134 7.442 19.576 -1.430 1.00 0.00 O ATOM 2105 CB ASP A 134 8.170 19.648 -4.656 1.00 0.00 C ATOM 2106 CG ASP A 134 9.205 20.742 -4.481 1.00 0.00 C ATOM 2107 OD1 ASP A 134 10.386 20.499 -4.808 1.00 0.00 O ATOM 2108 OD2 ASP A 134 8.835 21.841 -4.017 1.00 0.00 O ATOM 0 H ASP A 134 7.857 17.228 -5.034 1.00 0.00 H new ATOM 0 HA ASP A 134 9.167 18.664 -3.025 1.00 0.00 H new ATOM 0 HB2 ASP A 134 8.349 19.129 -5.598 1.00 0.00 H new ATOM 0 HB3 ASP A 134 7.179 20.097 -4.723 1.00 0.00 H new ATOM 2113 N ASP A 135 5.881 18.663 -2.768 1.00 0.00 N ATOM 2114 CA ASP A 135 4.774 18.954 -1.861 1.00 0.00 C ATOM 2115 C ASP A 135 4.780 18.018 -0.651 1.00 0.00 C ATOM 2116 O ASP A 135 3.931 18.133 0.233 1.00 0.00 O ATOM 2117 CB ASP A 135 3.441 18.838 -2.601 1.00 0.00 C ATOM 2118 CG ASP A 135 3.032 20.139 -3.265 1.00 0.00 C ATOM 2119 OD1 ASP A 135 3.923 20.971 -3.538 1.00 0.00 O ATOM 2120 OD2 ASP A 135 1.822 20.325 -3.511 1.00 0.00 O ATOM 0 H ASP A 135 5.607 18.187 -3.628 1.00 0.00 H new ATOM 0 HA ASP A 135 4.900 19.975 -1.500 1.00 0.00 H new ATOM 0 HB2 ASP A 135 3.515 18.056 -3.356 1.00 0.00 H new ATOM 0 HB3 ASP A 135 2.665 18.532 -1.900 1.00 0.00 H new ATOM 2125 N PHE A 136 5.736 17.092 -0.616 1.00 0.00 N ATOM 2126 CA PHE A 136 5.838 16.144 0.487 1.00 0.00 C ATOM 2127 C PHE A 136 7.212 16.217 1.143 1.00 0.00 C ATOM 2128 O PHE A 136 8.238 16.239 0.463 1.00 0.00 O ATOM 2129 CB PHE A 136 5.574 14.721 -0.011 1.00 0.00 C ATOM 2130 CG PHE A 136 4.116 14.413 -0.206 1.00 0.00 C ATOM 2131 CD1 PHE A 136 3.344 15.172 -1.071 1.00 0.00 C ATOM 2132 CD2 PHE A 136 3.519 13.365 0.475 1.00 0.00 C ATOM 2133 CE1 PHE A 136 2.003 14.890 -1.254 1.00 0.00 C ATOM 2134 CE2 PHE A 136 2.179 13.078 0.296 1.00 0.00 C ATOM 2135 CZ PHE A 136 1.420 13.842 -0.569 1.00 0.00 C ATOM 0 H PHE A 136 6.448 16.979 -1.337 1.00 0.00 H new ATOM 0 HA PHE A 136 5.086 16.408 1.231 1.00 0.00 H new ATOM 0 HB2 PHE A 136 6.098 14.572 -0.955 1.00 0.00 H new ATOM 0 HB3 PHE A 136 5.995 14.012 0.702 1.00 0.00 H new ATOM 0 HD1 PHE A 136 3.795 15.993 -1.608 1.00 0.00 H new ATOM 0 HD2 PHE A 136 4.107 12.765 1.154 1.00 0.00 H new ATOM 0 HE1 PHE A 136 1.412 15.488 -1.932 1.00 0.00 H new ATOM 0 HE2 PHE A 136 1.726 12.257 0.832 1.00 0.00 H new ATOM 0 HZ PHE A 136 0.372 13.620 -0.709 1.00 0.00 H new ATOM 2145 N THR A 137 7.221 16.263 2.469 1.00 0.00 N ATOM 2146 CA THR A 137 8.465 16.343 3.224 1.00 0.00 C ATOM 2147 C THR A 137 8.675 15.088 4.064 1.00 0.00 C ATOM 2148 O THR A 137 7.759 14.620 4.741 1.00 0.00 O ATOM 2149 CB THR A 137 8.456 17.582 4.123 1.00 0.00 C ATOM 2150 OG1 THR A 137 8.435 18.765 3.345 1.00 0.00 O ATOM 2151 CG2 THR A 137 9.651 17.664 5.050 1.00 0.00 C ATOM 0 H THR A 137 6.379 16.246 3.045 1.00 0.00 H new ATOM 0 HA THR A 137 9.290 16.421 2.515 1.00 0.00 H new ATOM 0 HB THR A 137 7.555 17.489 4.729 1.00 0.00 H new ATOM 0 HG1 THR A 137 8.428 19.546 3.937 1.00 0.00 H new ATOM 0 HG21 THR A 137 9.579 18.566 5.657 1.00 0.00 H new ATOM 0 HG22 THR A 137 9.668 16.789 5.700 1.00 0.00 H new ATOM 0 HG23 THR A 137 10.567 17.695 4.460 1.00 0.00 H new ATOM 2159 N LYS A 138 9.889 14.550 4.018 1.00 0.00 N ATOM 2160 CA LYS A 138 10.222 13.352 4.777 1.00 0.00 C ATOM 2161 C LYS A 138 10.040 13.592 6.270 1.00 0.00 C ATOM 2162 O LYS A 138 10.617 14.521 6.835 1.00 0.00 O ATOM 2163 CB LYS A 138 11.661 12.922 4.490 1.00 0.00 C ATOM 2164 CG LYS A 138 12.057 11.630 5.186 1.00 0.00 C ATOM 2165 CD LYS A 138 12.976 10.787 4.317 1.00 0.00 C ATOM 2166 CE LYS A 138 14.432 10.945 4.727 1.00 0.00 C ATOM 2167 NZ LYS A 138 15.317 11.183 3.553 1.00 0.00 N ATOM 0 H LYS A 138 10.658 14.925 3.463 1.00 0.00 H new ATOM 0 HA LYS A 138 9.546 12.555 4.467 1.00 0.00 H new ATOM 0 HB2 LYS A 138 11.788 12.800 3.414 1.00 0.00 H new ATOM 0 HB3 LYS A 138 12.339 13.716 4.803 1.00 0.00 H new ATOM 0 HG2 LYS A 138 12.556 11.861 6.127 1.00 0.00 H new ATOM 0 HG3 LYS A 138 11.162 11.059 5.431 1.00 0.00 H new ATOM 0 HD2 LYS A 138 12.688 9.738 4.392 1.00 0.00 H new ATOM 0 HD3 LYS A 138 12.858 11.077 3.273 1.00 0.00 H new ATOM 0 HE2 LYS A 138 14.524 11.777 5.426 1.00 0.00 H new ATOM 0 HE3 LYS A 138 14.760 10.049 5.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 16.301 11.285 3.875 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 15.249 10.378 2.898 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 15.020 12.052 3.065 1.00 0.00 H new ATOM 2181 N VAL A 139 9.231 12.751 6.903 1.00 0.00 N ATOM 2182 CA VAL A 139 8.971 12.874 8.332 1.00 0.00 C ATOM 2183 C VAL A 139 9.942 12.026 9.140 1.00 0.00 C ATOM 2184 O VAL A 139 10.309 12.385 10.259 1.00 0.00 O ATOM 2185 CB VAL A 139 7.530 12.459 8.691 1.00 0.00 C ATOM 2186 CG1 VAL A 139 7.096 13.110 9.995 1.00 0.00 C ATOM 2187 CG2 VAL A 139 6.567 12.811 7.566 1.00 0.00 C ATOM 0 H VAL A 139 8.744 11.977 6.450 1.00 0.00 H new ATOM 0 HA VAL A 139 9.107 13.926 8.582 1.00 0.00 H new ATOM 0 HB VAL A 139 7.511 11.377 8.824 1.00 0.00 H new ATOM 0 HG11 VAL A 139 6.077 12.805 10.232 1.00 0.00 H new ATOM 0 HG12 VAL A 139 7.764 12.798 10.798 1.00 0.00 H new ATOM 0 HG13 VAL A 139 7.136 14.194 9.891 1.00 0.00 H new ATOM 0 HG21 VAL A 139 5.557 12.508 7.843 1.00 0.00 H new ATOM 0 HG22 VAL A 139 6.588 13.887 7.392 1.00 0.00 H new ATOM 0 HG23 VAL A 139 6.865 12.290 6.656 1.00 0.00 H new ATOM 2197 N SER A 140 10.357 10.896 8.573 1.00 0.00 N ATOM 2198 CA SER A 140 11.287 10.005 9.260 1.00 0.00 C ATOM 2199 C SER A 140 11.929 9.016 8.294 1.00 0.00 C ATOM 2200 O SER A 140 11.475 8.851 7.163 1.00 0.00 O ATOM 2201 CB SER A 140 10.567 9.248 10.377 1.00 0.00 C ATOM 2202 OG SER A 140 9.709 10.108 11.107 1.00 0.00 O ATOM 0 H SER A 140 10.067 10.578 7.648 1.00 0.00 H new ATOM 0 HA SER A 140 12.078 10.619 9.691 1.00 0.00 H new ATOM 0 HB2 SER A 140 9.988 8.429 9.951 1.00 0.00 H new ATOM 0 HB3 SER A 140 11.300 8.804 11.050 1.00 0.00 H new ATOM 0 HG SER A 140 10.102 11.005 11.148 1.00 0.00 H new ATOM 2208 N SER A 141 12.991 8.359 8.754 1.00 0.00 N ATOM 2209 CA SER A 141 13.700 7.383 7.936 1.00 0.00 C ATOM 2210 C SER A 141 14.536 6.446 8.805 1.00 0.00 C ATOM 2211 O SER A 141 15.380 6.891 9.583 1.00 0.00 O ATOM 2212 CB SER A 141 14.599 8.093 6.922 1.00 0.00 C ATOM 2213 OG SER A 141 15.202 9.242 7.491 1.00 0.00 O ATOM 0 H SER A 141 13.378 8.486 9.689 1.00 0.00 H new ATOM 0 HA SER A 141 12.959 6.789 7.402 1.00 0.00 H new ATOM 0 HB2 SER A 141 15.372 7.408 6.574 1.00 0.00 H new ATOM 0 HB3 SER A 141 14.012 8.381 6.050 1.00 0.00 H new ATOM 0 HG SER A 141 15.992 9.491 6.966 1.00 0.00 H new ATOM 2219 N ARG A 142 14.296 5.147 8.662 1.00 0.00 N ATOM 2220 CA ARG A 142 15.024 4.141 9.426 1.00 0.00 C ATOM 2221 C ARG A 142 15.489 3.008 8.517 1.00 0.00 C ATOM 2222 O ARG A 142 14.685 2.392 7.817 1.00 0.00 O ATOM 2223 CB ARG A 142 14.143 3.584 10.546 1.00 0.00 C ATOM 2224 CG ARG A 142 14.910 2.769 11.576 1.00 0.00 C ATOM 2225 CD ARG A 142 14.228 2.800 12.935 1.00 0.00 C ATOM 2226 NE ARG A 142 15.168 3.104 14.011 1.00 0.00 N ATOM 2227 CZ ARG A 142 14.905 2.910 15.302 1.00 0.00 C ATOM 2228 NH1 ARG A 142 13.734 2.413 15.680 1.00 0.00 N ATOM 2229 NH2 ARG A 142 15.815 3.214 16.216 1.00 0.00 N ATOM 0 H ARG A 142 13.600 4.765 8.021 1.00 0.00 H new ATOM 0 HA ARG A 142 15.900 4.615 9.867 1.00 0.00 H new ATOM 0 HB2 ARG A 142 13.643 4.412 11.049 1.00 0.00 H new ATOM 0 HB3 ARG A 142 13.364 2.960 10.108 1.00 0.00 H new ATOM 0 HG2 ARG A 142 14.995 1.737 11.234 1.00 0.00 H new ATOM 0 HG3 ARG A 142 15.924 3.159 11.668 1.00 0.00 H new ATOM 0 HD2 ARG A 142 13.434 3.547 12.925 1.00 0.00 H new ATOM 0 HD3 ARG A 142 13.757 1.836 13.127 1.00 0.00 H new ATOM 0 HE ARG A 142 16.079 3.487 13.759 1.00 0.00 H new ATOM 0 HH11 ARG A 142 13.030 2.178 14.980 1.00 0.00 H new ATOM 0 HH12 ARG A 142 13.538 2.266 16.670 1.00 0.00 H new ATOM 0 HH21 ARG A 142 16.716 3.596 15.931 1.00 0.00 H new ATOM 0 HH22 ARG A 142 15.614 3.066 17.205 1.00 0.00 H new ATOM 2243 N THR A 143 16.791 2.742 8.525 1.00 0.00 N ATOM 2244 CA THR A 143 17.359 1.687 7.694 1.00 0.00 C ATOM 2245 C THR A 143 17.621 0.424 8.508 1.00 0.00 C ATOM 2246 O THR A 143 18.443 0.422 9.424 1.00 0.00 O ATOM 2247 CB THR A 143 18.659 2.165 7.046 1.00 0.00 C ATOM 2248 OG1 THR A 143 18.639 3.569 6.860 1.00 0.00 O ATOM 2249 CG2 THR A 143 18.926 1.527 5.700 1.00 0.00 C ATOM 0 H THR A 143 17.472 3.242 9.097 1.00 0.00 H new ATOM 0 HA THR A 143 16.635 1.449 6.915 1.00 0.00 H new ATOM 0 HB THR A 143 19.451 1.869 7.734 1.00 0.00 H new ATOM 0 HG1 THR A 143 19.480 3.856 6.446 1.00 0.00 H new ATOM 0 HG21 THR A 143 19.863 1.910 5.295 1.00 0.00 H new ATOM 0 HG22 THR A 143 18.996 0.446 5.817 1.00 0.00 H new ATOM 0 HG23 THR A 143 18.111 1.766 5.016 1.00 0.00 H new ATOM 2257 N VAL A 144 16.919 -0.651 8.162 1.00 0.00 N ATOM 2258 CA VAL A 144 17.076 -1.924 8.853 1.00 0.00 C ATOM 2259 C VAL A 144 17.750 -2.950 7.947 1.00 0.00 C ATOM 2260 O VAL A 144 17.380 -3.103 6.783 1.00 0.00 O ATOM 2261 CB VAL A 144 15.720 -2.490 9.332 1.00 0.00 C ATOM 2262 CG1 VAL A 144 15.496 -2.167 10.801 1.00 0.00 C ATOM 2263 CG2 VAL A 144 14.571 -1.961 8.483 1.00 0.00 C ATOM 0 H VAL A 144 16.235 -0.664 7.406 1.00 0.00 H new ATOM 0 HA VAL A 144 17.701 -1.734 9.725 1.00 0.00 H new ATOM 0 HB VAL A 144 15.748 -3.573 9.216 1.00 0.00 H new ATOM 0 HG11 VAL A 144 14.536 -2.573 11.121 1.00 0.00 H new ATOM 0 HG12 VAL A 144 16.294 -2.610 11.397 1.00 0.00 H new ATOM 0 HG13 VAL A 144 15.497 -1.086 10.940 1.00 0.00 H new ATOM 0 HG21 VAL A 144 13.630 -2.377 8.844 1.00 0.00 H new ATOM 0 HG22 VAL A 144 14.538 -0.874 8.553 1.00 0.00 H new ATOM 0 HG23 VAL A 144 14.722 -2.253 7.444 1.00 0.00 H new ATOM 2273 N GLU A 145 18.744 -3.649 8.487 1.00 0.00 N ATOM 2274 CA GLU A 145 19.470 -4.658 7.723 1.00 0.00 C ATOM 2275 C GLU A 145 19.405 -6.017 8.411 1.00 0.00 C ATOM 2276 O GLU A 145 19.399 -6.106 9.639 1.00 0.00 O ATOM 2277 CB GLU A 145 20.930 -4.239 7.533 1.00 0.00 C ATOM 2278 CG GLU A 145 21.540 -3.581 8.759 1.00 0.00 C ATOM 2279 CD GLU A 145 23.048 -3.458 8.666 1.00 0.00 C ATOM 2280 OE1 GLU A 145 23.535 -2.862 7.683 1.00 0.00 O ATOM 2281 OE2 GLU A 145 23.741 -3.959 9.577 1.00 0.00 O ATOM 0 H GLU A 145 19.065 -3.536 9.449 1.00 0.00 H new ATOM 0 HA GLU A 145 18.995 -4.743 6.746 1.00 0.00 H new ATOM 0 HB2 GLU A 145 21.520 -5.117 7.271 1.00 0.00 H new ATOM 0 HB3 GLU A 145 20.994 -3.549 6.691 1.00 0.00 H new ATOM 0 HG2 GLU A 145 21.106 -2.590 8.888 1.00 0.00 H new ATOM 0 HG3 GLU A 145 21.281 -4.161 9.645 1.00 0.00 H new ATOM 2288 N ASP A 146 19.355 -7.073 7.607 1.00 0.00 N ATOM 2289 CA ASP A 146 19.288 -8.433 8.127 1.00 0.00 C ATOM 2290 C ASP A 146 20.528 -9.227 7.729 1.00 0.00 C ATOM 2291 O ASP A 146 21.483 -8.673 7.185 1.00 0.00 O ATOM 2292 CB ASP A 146 18.029 -9.133 7.610 1.00 0.00 C ATOM 2293 CG ASP A 146 16.916 -9.156 8.640 1.00 0.00 C ATOM 2294 OD1 ASP A 146 16.504 -8.068 9.094 1.00 0.00 O ATOM 2295 OD2 ASP A 146 16.457 -10.263 8.993 1.00 0.00 O ATOM 0 H ASP A 146 19.360 -7.012 6.589 1.00 0.00 H new ATOM 0 HA ASP A 146 19.247 -8.382 9.215 1.00 0.00 H new ATOM 0 HB2 ASP A 146 17.678 -8.626 6.711 1.00 0.00 H new ATOM 0 HB3 ASP A 146 18.277 -10.155 7.324 1.00 0.00 H new ATOM 2300 N THR A 147 20.504 -10.529 7.998 1.00 0.00 N ATOM 2301 CA THR A 147 21.625 -11.397 7.661 1.00 0.00 C ATOM 2302 C THR A 147 21.862 -11.408 6.154 1.00 0.00 C ATOM 2303 O THR A 147 23.003 -11.404 5.693 1.00 0.00 O ATOM 2304 CB THR A 147 21.365 -12.819 8.159 1.00 0.00 C ATOM 2305 OG1 THR A 147 19.978 -13.106 8.155 1.00 0.00 O ATOM 2306 CG2 THR A 147 21.881 -13.066 9.561 1.00 0.00 C ATOM 0 H THR A 147 19.722 -11.005 8.448 1.00 0.00 H new ATOM 0 HA THR A 147 22.517 -11.008 8.151 1.00 0.00 H new ATOM 0 HB THR A 147 21.905 -13.469 7.471 1.00 0.00 H new ATOM 0 HG1 THR A 147 19.832 -14.021 8.475 1.00 0.00 H new ATOM 0 HG21 THR A 147 21.664 -14.094 9.853 1.00 0.00 H new ATOM 0 HG22 THR A 147 22.958 -12.901 9.587 1.00 0.00 H new ATOM 0 HG23 THR A 147 21.393 -12.381 10.254 1.00 0.00 H new ATOM 2314 N ASN A 148 20.772 -11.423 5.392 1.00 0.00 N ATOM 2315 CA ASN A 148 20.856 -11.434 3.937 1.00 0.00 C ATOM 2316 C ASN A 148 21.042 -10.018 3.391 1.00 0.00 C ATOM 2317 O ASN A 148 20.373 -9.084 3.834 1.00 0.00 O ATOM 2318 CB ASN A 148 19.592 -12.059 3.340 1.00 0.00 C ATOM 2319 CG ASN A 148 19.669 -13.571 3.275 1.00 0.00 C ATOM 2320 OD1 ASN A 148 20.715 -14.138 2.958 1.00 0.00 O ATOM 2321 ND2 ASN A 148 18.558 -14.233 3.576 1.00 0.00 N ATOM 0 H ASN A 148 19.820 -11.428 5.759 1.00 0.00 H new ATOM 0 HA ASN A 148 21.722 -12.031 3.651 1.00 0.00 H new ATOM 0 HB2 ASN A 148 18.729 -11.768 3.938 1.00 0.00 H new ATOM 0 HB3 ASN A 148 19.433 -11.663 2.337 1.00 0.00 H new ATOM 0 HD21 ASN A 148 18.549 -15.253 3.550 1.00 0.00 H new ATOM 0 HD22 ASN A 148 17.714 -13.722 3.833 1.00 0.00 H new ATOM 2328 N PRO A 149 21.952 -9.836 2.415 1.00 0.00 N ATOM 2329 CA PRO A 149 22.210 -8.521 1.815 1.00 0.00 C ATOM 2330 C PRO A 149 20.967 -7.951 1.145 1.00 0.00 C ATOM 2331 O PRO A 149 20.775 -6.736 1.092 1.00 0.00 O ATOM 2332 CB PRO A 149 23.294 -8.800 0.768 1.00 0.00 C ATOM 2333 CG PRO A 149 23.895 -10.103 1.166 1.00 0.00 C ATOM 2334 CD PRO A 149 22.793 -10.886 1.817 1.00 0.00 C ATOM 0 HA PRO A 149 22.508 -7.785 2.562 1.00 0.00 H new ATOM 0 HB2 PRO A 149 22.869 -8.852 -0.234 1.00 0.00 H new ATOM 0 HB3 PRO A 149 24.043 -8.008 0.756 1.00 0.00 H new ATOM 0 HG2 PRO A 149 24.289 -10.632 0.298 1.00 0.00 H new ATOM 0 HG3 PRO A 149 24.727 -9.955 1.854 1.00 0.00 H new ATOM 0 HD2 PRO A 149 22.239 -11.483 1.092 1.00 0.00 H new ATOM 0 HD3 PRO A 149 23.177 -11.574 2.570 1.00 0.00 H new ATOM 2342 N ALA A 150 20.123 -8.843 0.642 1.00 0.00 N ATOM 2343 CA ALA A 150 18.890 -8.441 -0.024 1.00 0.00 C ATOM 2344 C ALA A 150 17.761 -8.231 0.982 1.00 0.00 C ATOM 2345 O ALA A 150 16.732 -7.638 0.655 1.00 0.00 O ATOM 2346 CB ALA A 150 18.487 -9.479 -1.060 1.00 0.00 C ATOM 0 H ALA A 150 20.270 -9.852 0.683 1.00 0.00 H new ATOM 0 HA ALA A 150 19.074 -7.492 -0.527 1.00 0.00 H new ATOM 0 HB1 ALA A 150 17.565 -9.166 -1.549 1.00 0.00 H new ATOM 0 HB2 ALA A 150 19.278 -9.576 -1.804 1.00 0.00 H new ATOM 0 HB3 ALA A 150 18.329 -10.440 -0.570 1.00 0.00 H new ATOM 2352 N LEU A 151 17.956 -8.719 2.205 1.00 0.00 N ATOM 2353 CA LEU A 151 16.949 -8.582 3.250 1.00 0.00 C ATOM 2354 C LEU A 151 17.056 -7.229 3.956 1.00 0.00 C ATOM 2355 O LEU A 151 16.350 -6.976 4.932 1.00 0.00 O ATOM 2356 CB LEU A 151 17.088 -9.719 4.267 1.00 0.00 C ATOM 2357 CG LEU A 151 16.331 -11.009 3.923 1.00 0.00 C ATOM 2358 CD1 LEU A 151 14.925 -10.969 4.495 1.00 0.00 C ATOM 2359 CD2 LEU A 151 16.288 -11.235 2.417 1.00 0.00 C ATOM 0 H LEU A 151 18.801 -9.212 2.495 1.00 0.00 H new ATOM 0 HA LEU A 151 15.968 -8.637 2.779 1.00 0.00 H new ATOM 0 HB2 LEU A 151 18.146 -9.957 4.377 1.00 0.00 H new ATOM 0 HB3 LEU A 151 16.740 -9.361 5.236 1.00 0.00 H new ATOM 0 HG LEU A 151 16.867 -11.844 4.374 1.00 0.00 H new ATOM 0 HD11 LEU A 151 14.403 -11.892 4.241 1.00 0.00 H new ATOM 0 HD12 LEU A 151 14.976 -10.867 5.579 1.00 0.00 H new ATOM 0 HD13 LEU A 151 14.386 -10.120 4.076 1.00 0.00 H new ATOM 0 HD21 LEU A 151 15.746 -12.156 2.203 1.00 0.00 H new ATOM 0 HD22 LEU A 151 15.783 -10.396 1.938 1.00 0.00 H new ATOM 0 HD23 LEU A 151 17.305 -11.315 2.032 1.00 0.00 H new ATOM 2371 N THR A 152 17.932 -6.359 3.458 1.00 0.00 N ATOM 2372 CA THR A 152 18.106 -5.036 4.047 1.00 0.00 C ATOM 2373 C THR A 152 17.130 -4.048 3.419 1.00 0.00 C ATOM 2374 O THR A 152 17.140 -3.838 2.206 1.00 0.00 O ATOM 2375 CB THR A 152 19.543 -4.549 3.854 1.00 0.00 C ATOM 2376 OG1 THR A 152 20.466 -5.497 4.359 1.00 0.00 O ATOM 2377 CG2 THR A 152 19.825 -3.227 4.536 1.00 0.00 C ATOM 0 H THR A 152 18.529 -6.546 2.652 1.00 0.00 H new ATOM 0 HA THR A 152 17.902 -5.104 5.116 1.00 0.00 H new ATOM 0 HB THR A 152 19.660 -4.417 2.778 1.00 0.00 H new ATOM 0 HG1 THR A 152 21.379 -5.168 4.225 1.00 0.00 H new ATOM 0 HG21 THR A 152 20.862 -2.940 4.359 1.00 0.00 H new ATOM 0 HG22 THR A 152 19.163 -2.461 4.133 1.00 0.00 H new ATOM 0 HG23 THR A 152 19.654 -3.327 5.608 1.00 0.00 H new ATOM 2385 N HIS A 153 16.281 -3.450 4.247 1.00 0.00 N ATOM 2386 CA HIS A 153 15.292 -2.492 3.762 1.00 0.00 C ATOM 2387 C HIS A 153 15.413 -1.161 4.492 1.00 0.00 C ATOM 2388 O HIS A 153 16.069 -1.065 5.529 1.00 0.00 O ATOM 2389 CB HIS A 153 13.873 -3.047 3.932 1.00 0.00 C ATOM 2390 CG HIS A 153 13.817 -4.536 4.089 1.00 0.00 C ATOM 2391 ND1 HIS A 153 14.398 -5.524 3.369 1.00 0.00 N flip ATOM 2392 CD2 HIS A 153 13.097 -5.162 5.084 1.00 0.00 C flip ATOM 2393 CE1 HIS A 153 14.022 -6.715 3.937 1.00 0.00 C flip ATOM 2394 NE2 HIS A 153 13.239 -6.470 4.970 1.00 0.00 N flip ATOM 0 H HIS A 153 16.257 -3.610 5.254 1.00 0.00 H new ATOM 0 HA HIS A 153 15.486 -2.326 2.702 1.00 0.00 H new ATOM 0 HB2 HIS A 153 13.414 -2.582 4.805 1.00 0.00 H new ATOM 0 HB3 HIS A 153 13.275 -2.760 3.067 1.00 0.00 H new ATOM 0 HD2 HIS A 153 12.509 -4.661 5.839 1.00 0.00 H new ATOM 0 HE1 HIS A 153 14.319 -7.695 3.594 1.00 0.00 H new ATOM 0 HE2 HIS A 153 12.815 -7.171 5.577 1.00 0.00 H new ATOM 2403 N THR A 154 14.771 -0.136 3.942 1.00 0.00 N ATOM 2404 CA THR A 154 14.800 1.192 4.538 1.00 0.00 C ATOM 2405 C THR A 154 13.394 1.777 4.632 1.00 0.00 C ATOM 2406 O THR A 154 12.731 1.991 3.617 1.00 0.00 O ATOM 2407 CB THR A 154 15.697 2.122 3.721 1.00 0.00 C ATOM 2408 OG1 THR A 154 16.978 1.546 3.534 1.00 0.00 O ATOM 2409 CG2 THR A 154 15.893 3.480 4.360 1.00 0.00 C ATOM 0 H THR A 154 14.224 -0.201 3.084 1.00 0.00 H new ATOM 0 HA THR A 154 15.205 1.101 5.546 1.00 0.00 H new ATOM 0 HB THR A 154 15.182 2.258 2.770 1.00 0.00 H new ATOM 0 HG1 THR A 154 17.537 2.155 3.008 1.00 0.00 H new ATOM 0 HG21 THR A 154 16.539 4.089 3.728 1.00 0.00 H new ATOM 0 HG22 THR A 154 14.927 3.972 4.472 1.00 0.00 H new ATOM 0 HG23 THR A 154 16.354 3.358 5.340 1.00 0.00 H new ATOM 2417 N TYR A 155 12.949 2.040 5.856 1.00 0.00 N ATOM 2418 CA TYR A 155 11.625 2.607 6.082 1.00 0.00 C ATOM 2419 C TYR A 155 11.705 4.128 6.124 1.00 0.00 C ATOM 2420 O TYR A 155 12.599 4.691 6.753 1.00 0.00 O ATOM 2421 CB TYR A 155 11.035 2.079 7.391 1.00 0.00 C ATOM 2422 CG TYR A 155 10.228 0.810 7.227 1.00 0.00 C ATOM 2423 CD1 TYR A 155 8.882 0.859 6.884 1.00 0.00 C ATOM 2424 CD2 TYR A 155 10.811 -0.436 7.419 1.00 0.00 C ATOM 2425 CE1 TYR A 155 8.141 -0.298 6.736 1.00 0.00 C ATOM 2426 CE2 TYR A 155 10.076 -1.598 7.273 1.00 0.00 C ATOM 2427 CZ TYR A 155 8.742 -1.523 6.932 1.00 0.00 C ATOM 2428 OH TYR A 155 8.008 -2.677 6.785 1.00 0.00 O ATOM 0 H TYR A 155 13.486 1.870 6.706 1.00 0.00 H new ATOM 0 HA TYR A 155 10.975 2.308 5.259 1.00 0.00 H new ATOM 0 HB2 TYR A 155 11.846 1.895 8.096 1.00 0.00 H new ATOM 0 HB3 TYR A 155 10.400 2.849 7.829 1.00 0.00 H new ATOM 0 HD1 TYR A 155 8.407 1.817 6.731 1.00 0.00 H new ATOM 0 HD2 TYR A 155 11.855 -0.498 7.687 1.00 0.00 H new ATOM 0 HE1 TYR A 155 7.096 -0.243 6.468 1.00 0.00 H new ATOM 0 HE2 TYR A 155 10.544 -2.559 7.425 1.00 0.00 H new ATOM 0 HH TYR A 155 8.000 -2.942 5.841 1.00 0.00 H new ATOM 2438 N GLU A 156 10.776 4.791 5.446 1.00 0.00 N ATOM 2439 CA GLU A 156 10.765 6.248 5.411 1.00 0.00 C ATOM 2440 C GLU A 156 9.350 6.799 5.532 1.00 0.00 C ATOM 2441 O GLU A 156 8.394 6.209 5.022 1.00 0.00 O ATOM 2442 CB GLU A 156 11.407 6.749 4.116 1.00 0.00 C ATOM 2443 CG GLU A 156 12.866 6.349 3.966 1.00 0.00 C ATOM 2444 CD GLU A 156 13.113 5.488 2.742 1.00 0.00 C ATOM 2445 OE1 GLU A 156 12.535 4.383 2.666 1.00 0.00 O ATOM 2446 OE2 GLU A 156 13.886 5.918 1.860 1.00 0.00 O ATOM 0 H GLU A 156 10.026 4.347 4.917 1.00 0.00 H new ATOM 0 HA GLU A 156 11.341 6.605 6.265 1.00 0.00 H new ATOM 0 HB2 GLU A 156 10.844 6.361 3.267 1.00 0.00 H new ATOM 0 HB3 GLU A 156 11.331 7.836 4.079 1.00 0.00 H new ATOM 0 HG2 GLU A 156 13.480 7.247 3.904 1.00 0.00 H new ATOM 0 HG3 GLU A 156 13.184 5.807 4.857 1.00 0.00 H new ATOM 2453 N VAL A 157 9.230 7.943 6.201 1.00 0.00 N ATOM 2454 CA VAL A 157 7.943 8.596 6.387 1.00 0.00 C ATOM 2455 C VAL A 157 7.886 9.897 5.597 1.00 0.00 C ATOM 2456 O VAL A 157 8.899 10.575 5.418 1.00 0.00 O ATOM 2457 CB VAL A 157 7.645 8.889 7.868 1.00 0.00 C ATOM 2458 CG1 VAL A 157 6.194 9.323 8.041 1.00 0.00 C ATOM 2459 CG2 VAL A 157 7.950 7.670 8.725 1.00 0.00 C ATOM 0 H VAL A 157 10.015 8.437 6.625 1.00 0.00 H new ATOM 0 HA VAL A 157 7.185 7.904 6.020 1.00 0.00 H new ATOM 0 HB VAL A 157 8.288 9.705 8.197 1.00 0.00 H new ATOM 0 HG11 VAL A 157 5.998 9.527 9.094 1.00 0.00 H new ATOM 0 HG12 VAL A 157 6.012 10.225 7.457 1.00 0.00 H new ATOM 0 HG13 VAL A 157 5.533 8.528 7.696 1.00 0.00 H new ATOM 0 HG21 VAL A 157 7.733 7.896 9.769 1.00 0.00 H new ATOM 0 HG22 VAL A 157 7.333 6.833 8.399 1.00 0.00 H new ATOM 0 HG23 VAL A 157 9.003 7.407 8.622 1.00 0.00 H new ATOM 2469 N TRP A 158 6.688 10.236 5.144 1.00 0.00 N ATOM 2470 CA TRP A 158 6.478 11.459 4.378 1.00 0.00 C ATOM 2471 C TRP A 158 5.109 12.067 4.651 1.00 0.00 C ATOM 2472 O TRP A 158 4.111 11.358 4.740 1.00 0.00 O ATOM 2473 CB TRP A 158 6.639 11.183 2.883 1.00 0.00 C ATOM 2474 CG TRP A 158 8.010 10.705 2.513 1.00 0.00 C ATOM 2475 CD1 TRP A 158 8.491 9.432 2.623 1.00 0.00 C ATOM 2476 CD2 TRP A 158 9.077 11.493 1.973 1.00 0.00 C ATOM 2477 NE1 TRP A 158 9.792 9.380 2.184 1.00 0.00 N ATOM 2478 CE2 TRP A 158 10.174 10.633 1.780 1.00 0.00 C ATOM 2479 CE3 TRP A 158 9.210 12.842 1.632 1.00 0.00 C ATOM 2480 CZ2 TRP A 158 11.388 11.078 1.262 1.00 0.00 C ATOM 2481 CZ3 TRP A 158 10.415 13.283 1.119 1.00 0.00 C ATOM 2482 CH2 TRP A 158 11.490 12.404 0.938 1.00 0.00 C ATOM 0 H TRP A 158 5.845 9.682 5.293 1.00 0.00 H new ATOM 0 HA TRP A 158 7.233 12.179 4.695 1.00 0.00 H new ATOM 0 HB2 TRP A 158 5.907 10.436 2.578 1.00 0.00 H new ATOM 0 HB3 TRP A 158 6.417 12.093 2.326 1.00 0.00 H new ATOM 0 HD1 TRP A 158 7.931 8.589 3.000 1.00 0.00 H new ATOM 0 HE1 TRP A 158 10.378 8.545 2.162 1.00 0.00 H new ATOM 0 HE3 TRP A 158 8.386 13.527 1.767 1.00 0.00 H new ATOM 0 HZ2 TRP A 158 12.218 10.402 1.121 1.00 0.00 H new ATOM 0 HZ3 TRP A 158 10.530 14.323 0.853 1.00 0.00 H new ATOM 0 HH2 TRP A 158 12.419 12.780 0.535 1.00 0.00 H new ATOM 2493 N GLN A 159 5.077 13.389 4.775 1.00 0.00 N ATOM 2494 CA GLN A 159 3.835 14.109 5.028 1.00 0.00 C ATOM 2495 C GLN A 159 3.788 15.389 4.200 1.00 0.00 C ATOM 2496 O GLN A 159 4.748 16.159 4.182 1.00 0.00 O ATOM 2497 CB GLN A 159 3.703 14.440 6.516 1.00 0.00 C ATOM 2498 CG GLN A 159 2.861 13.439 7.290 1.00 0.00 C ATOM 2499 CD GLN A 159 1.985 14.100 8.336 1.00 0.00 C ATOM 2500 OE1 GLN A 159 0.868 14.529 8.046 1.00 0.00 O ATOM 2501 NE2 GLN A 159 2.489 14.185 9.562 1.00 0.00 N ATOM 0 H GLN A 159 5.901 13.986 4.704 1.00 0.00 H new ATOM 0 HA GLN A 159 3.000 13.471 4.737 1.00 0.00 H new ATOM 0 HB2 GLN A 159 4.698 14.485 6.959 1.00 0.00 H new ATOM 0 HB3 GLN A 159 3.262 15.431 6.621 1.00 0.00 H new ATOM 0 HG2 GLN A 159 2.233 12.883 6.594 1.00 0.00 H new ATOM 0 HG3 GLN A 159 3.517 12.716 7.775 1.00 0.00 H new ATOM 0 HE21 GLN A 159 3.420 13.816 9.758 1.00 0.00 H new ATOM 0 HE22 GLN A 159 1.945 14.619 10.308 1.00 0.00 H new ATOM 2510 N LYS A 160 2.675 15.609 3.505 1.00 0.00 N ATOM 2511 CA LYS A 160 2.523 16.793 2.667 1.00 0.00 C ATOM 2512 C LYS A 160 2.698 18.069 3.482 1.00 0.00 C ATOM 2513 O LYS A 160 2.305 18.136 4.647 1.00 0.00 O ATOM 2514 CB LYS A 160 1.150 16.791 1.994 1.00 0.00 C ATOM 2515 CG LYS A 160 1.148 17.425 0.613 1.00 0.00 C ATOM 2516 CD LYS A 160 -0.148 17.141 -0.129 1.00 0.00 C ATOM 2517 CE LYS A 160 -1.106 18.319 -0.048 1.00 0.00 C ATOM 2518 NZ LYS A 160 -2.284 18.139 -0.941 1.00 0.00 N ATOM 0 H LYS A 160 1.868 14.985 3.506 1.00 0.00 H new ATOM 0 HA LYS A 160 3.299 16.765 1.902 1.00 0.00 H new ATOM 0 HB2 LYS A 160 0.796 15.763 1.913 1.00 0.00 H new ATOM 0 HB3 LYS A 160 0.442 17.323 2.630 1.00 0.00 H new ATOM 0 HG2 LYS A 160 1.287 18.502 0.706 1.00 0.00 H new ATOM 0 HG3 LYS A 160 1.990 17.044 0.035 1.00 0.00 H new ATOM 0 HD2 LYS A 160 0.071 16.920 -1.174 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -0.623 16.255 0.292 1.00 0.00 H new ATOM 0 HE2 LYS A 160 -1.445 18.441 0.981 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -0.580 19.234 -0.321 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -2.913 18.963 -0.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -1.962 18.048 -1.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -2.801 17.280 -0.665 1.00 0.00 H new ATOM 2532 N LYS A 161 3.294 19.080 2.858 1.00 0.00 N ATOM 2533 CA LYS A 161 3.527 20.358 3.521 1.00 0.00 C ATOM 2534 C LYS A 161 2.209 21.038 3.876 1.00 0.00 C ATOM 2535 O LYS A 161 1.318 21.164 3.035 1.00 0.00 O ATOM 2536 CB LYS A 161 4.363 21.274 2.626 1.00 0.00 C ATOM 2537 CG LYS A 161 5.670 20.648 2.166 1.00 0.00 C ATOM 2538 CD LYS A 161 6.365 21.509 1.123 1.00 0.00 C ATOM 2539 CE LYS A 161 7.494 22.322 1.735 1.00 0.00 C ATOM 2540 NZ LYS A 161 7.008 23.218 2.821 1.00 0.00 N ATOM 0 H LYS A 161 3.624 19.039 1.894 1.00 0.00 H new ATOM 0 HA LYS A 161 4.073 20.165 4.444 1.00 0.00 H new ATOM 0 HB2 LYS A 161 3.774 21.549 1.751 1.00 0.00 H new ATOM 0 HB3 LYS A 161 4.581 22.195 3.166 1.00 0.00 H new ATOM 0 HG2 LYS A 161 6.329 20.510 3.023 1.00 0.00 H new ATOM 0 HG3 LYS A 161 5.475 19.659 1.751 1.00 0.00 H new ATOM 0 HD2 LYS A 161 6.761 20.874 0.330 1.00 0.00 H new ATOM 0 HD3 LYS A 161 5.640 22.180 0.662 1.00 0.00 H new ATOM 0 HE2 LYS A 161 8.253 21.648 2.133 1.00 0.00 H new ATOM 0 HE3 LYS A 161 7.973 22.919 0.959 1.00 0.00 H new ATOM 0 HZ1 LYS A 161 7.787 23.828 3.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 161 6.231 23.809 2.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 161 6.666 22.644 3.618 1.00 0.00 H new ATOM 2554 N ALA A 162 2.093 21.474 5.126 1.00 0.00 N ATOM 2555 CA ALA A 162 0.884 22.142 5.593 1.00 0.00 C ATOM 2556 C ALA A 162 -0.338 21.245 5.430 1.00 0.00 C ATOM 2557 O ALA A 162 -0.904 21.215 4.317 1.00 0.00 O ATOM 2558 CB ALA A 162 0.684 23.452 4.847 1.00 0.00 C ATOM 2559 OXT ALA A 162 -0.719 20.580 6.416 1.00 0.00 O ATOM 0 H ALA A 162 2.821 21.377 5.833 1.00 0.00 H new ATOM 0 HA ALA A 162 1.004 22.356 6.655 1.00 0.00 H new ATOM 0 HB1 ALA A 162 -0.222 23.940 5.206 1.00 0.00 H new ATOM 0 HB2 ALA A 162 1.540 24.104 5.020 1.00 0.00 H new ATOM 0 HB3 ALA A 162 0.590 23.252 3.780 1.00 0.00 H new TER 2565 ALA A 162 HETATM 2566 PA NDP A 170 -3.263 -2.822 -9.641 1.00 0.00 P HETATM 2567 O1A NDP A 170 -2.870 -1.936 -8.528 1.00 0.00 O HETATM 2568 O2A NDP A 170 -3.286 -4.275 -9.382 1.00 0.00 O HETATM 2569 O5B NDP A 170 -4.616 -2.332 -10.323 1.00 0.00 O HETATM 2570 C5B NDP A 170 -5.658 -1.721 -9.540 1.00 0.00 C HETATM 2571 C4B NDP A 170 -6.932 -1.634 -10.343 1.00 0.00 C HETATM 2572 O4B NDP A 170 -8.005 -1.157 -9.489 1.00 0.00 O HETATM 2573 C3B NDP A 170 -6.902 -0.657 -11.507 1.00 0.00 C HETATM 2574 O3B NDP A 170 -6.364 -1.274 -12.681 1.00 0.00 O HETATM 2575 C2B NDP A 170 -8.376 -0.313 -11.675 1.00 0.00 C HETATM 2576 O2B NDP A 170 -9.102 -1.282 -12.403 1.00 0.00 O HETATM 2577 C1B NDP A 170 -8.843 -0.277 -10.218 1.00 0.00 C HETATM 2578 N9A NDP A 170 -8.734 1.048 -9.612 1.00 0.00 N HETATM 2579 C8A NDP A 170 -7.623 1.615 -9.038 1.00 0.00 C HETATM 2580 N7A NDP A 170 -7.824 2.826 -8.577 1.00 0.00 N HETATM 2581 C5A NDP A 170 -9.159 3.073 -8.865 1.00 0.00 C HETATM 2582 C6A NDP A 170 -9.991 4.186 -8.631 1.00 0.00 C HETATM 2583 N6A NDP A 170 -9.579 5.304 -8.030 1.00 0.00 N HETATM 2584 N1A NDP A 170 -11.277 4.108 -9.043 1.00 0.00 N HETATM 2585 C2A NDP A 170 -11.691 2.984 -9.647 1.00 0.00 C HETATM 2586 N3A NDP A 170 -11.005 1.876 -9.924 1.00 0.00 N HETATM 2587 C4A NDP A 170 -9.732 1.986 -9.503 1.00 0.00 C HETATM 2588 O3 NDP A 170 -2.252 -2.537 -10.912 1.00 0.00 O HETATM 2589 PN NDP A 170 -0.620 -2.389 -11.098 1.00 0.00 P HETATM 2590 O1N NDP A 170 -0.183 -3.340 -12.138 1.00 0.00 O HETATM 2591 O2N NDP A 170 -0.304 -0.962 -11.301 1.00 0.00 O HETATM 2592 O5D NDP A 170 -0.192 -2.879 -9.644 1.00 0.00 O HETATM 2593 C5D NDP A 170 -0.600 -4.168 -9.149 1.00 0.00 C HETATM 2594 C4D NDP A 170 0.608 -5.043 -8.917 1.00 0.00 C HETATM 2595 O4D NDP A 170 1.500 -4.395 -7.972 1.00 0.00 O HETATM 2596 C3D NDP A 170 0.329 -6.402 -8.298 1.00 0.00 C HETATM 2597 O3D NDP A 170 -0.029 -7.358 -9.301 1.00 0.00 O HETATM 2598 C2D NDP A 170 1.669 -6.744 -7.659 1.00 0.00 C HETATM 2599 O2D NDP A 170 2.624 -7.270 -8.580 1.00 0.00 O HETATM 2600 C1D NDP A 170 2.125 -5.372 -7.157 1.00 0.00 C HETATM 2601 N1N NDP A 170 1.765 -5.108 -5.765 1.00 0.00 N HETATM 2602 C2N NDP A 170 2.537 -4.973 -4.694 1.00 0.00 C HETATM 2603 C3N NDP A 170 2.154 -4.714 -3.485 1.00 0.00 C HETATM 2604 C7N NDP A 170 3.294 -4.627 -2.618 1.00 0.00 C HETATM 2605 O7N NDP A 170 2.787 -4.276 -1.457 1.00 0.00 O HETATM 2606 N7N NDP A 170 4.616 -4.795 -2.871 1.00 0.00 N HETATM 2607 C4N NDP A 170 0.680 -4.548 -3.241 1.00 0.00 C HETATM 2608 C5N NDP A 170 -0.217 -4.684 -4.360 1.00 0.00 C HETATM 2609 C6N NDP A 170 0.236 -4.961 -5.642 1.00 0.00 C HETATM 2610 P2B NDP A 170 -9.096 -1.547 -14.052 1.00 0.00 P HETATM 2611 O1X NDP A 170 -10.503 -0.905 -14.371 1.00 0.00 O HETATM 2612 O2X NDP A 170 -7.990 -0.584 -14.481 1.00 0.00 O HETATM 2613 O3X NDP A 170 -9.212 -3.070 -14.086 1.00 0.00 O HETATM 0 HO3N NDP A 170 -0.529 -8.093 -8.889 1.00 0.00 H new HETATM 0 HO3A NDP A 170 -6.669 -0.787 -13.475 1.00 0.00 H new HETATM 0 HO2N NDP A 170 2.309 -7.124 -9.497 1.00 0.00 H new HETATM 0 H72N NDP A 170 5.296 -4.693 -2.118 1.00 0.00 H new HETATM 0 H71N NDP A 170 4.930 -5.024 -3.814 1.00 0.00 H new HETATM 0 H62A NDP A 170 -10.230 6.077 -7.889 1.00 0.00 H new HETATM 0 H61A NDP A 170 -8.613 5.386 -7.712 1.00 0.00 H new HETATM 0 H52N NDP A 170 -1.156 -4.049 -8.219 1.00 0.00 H new HETATM 0 H52A NDP A 170 -5.830 -2.302 -8.634 1.00 0.00 H new HETATM 0 H51N NDP A 170 -1.271 -4.644 -9.863 1.00 0.00 H new HETATM 0 H51A NDP A 170 -5.349 -0.724 -9.226 1.00 0.00 H new HETATM 0 H42N NDP A 170 0.384 -5.277 -2.487 1.00 0.00 H new HETATM 0 H41N NDP A 170 0.524 -3.560 -2.808 1.00 0.00 H new HETATM 0 H8A NDP A 170 -6.662 1.105 -8.972 1.00 0.00 H new HETATM 0 H6N NDP A 170 -0.436 -5.066 -6.494 1.00 0.00 H new HETATM 0 H5N NDP A 170 -1.288 -4.565 -4.194 1.00 0.00 H new HETATM 0 H4D NDP A 170 1.017 -5.188 -9.917 1.00 0.00 H new HETATM 0 H4B NDP A 170 -7.070 -2.642 -10.734 1.00 0.00 H new HETATM 0 H3D NDP A 170 -0.503 -6.404 -7.593 1.00 0.00 H new HETATM 0 H3B NDP A 170 -6.272 0.216 -11.337 1.00 0.00 H new HETATM 0 H2N NDP A 170 3.609 -5.093 -4.849 1.00 0.00 H new HETATM 0 H2D NDP A 170 1.579 -7.520 -6.899 1.00 0.00 H new HETATM 0 H2B NDP A 170 -8.530 0.606 -12.241 1.00 0.00 H new HETATM 0 H2A NDP A 170 -12.737 2.976 -9.955 1.00 0.00 H new HETATM 0 H1D NDP A 170 3.213 -5.343 -7.211 1.00 0.00 H new HETATM 0 H1B NDP A 170 -9.895 -0.561 -10.193 1.00 0.00 H new