USER MOD reduce.3.24.130724 H: found=0, std=0, add=1312, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1305 hydrogens (45 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 153 HIS : no HE2:sc= -3.01! C(o=-1.8!,f=-17!) USER MOD Set 1.2: A 155 TYR OH : rot 117:sc= 1.25 USER MOD Set 2.1: A 138 LYS NZ :NH3+ 163:sc= 0.809 (180deg=-0.0641) USER MOD Set 2.2: A 141 SER OG : rot 117:sc= -1.09 USER MOD Set 3.1: A 137 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 161 LYS NZ :NH3+ -145:sc= -0.0285 (180deg=-0.63) USER MOD Set 4.1: A 58 THR OG1 : rot 110:sc= -0.0835 USER MOD Set 4.2: A 92 GLN : amide:sc= -0.148 K(o=-0.23,f=0.54) USER MOD Set 5.1: A 85 TYR OH : rot -107:sc= 1.27 USER MOD Set 5.2: A 89 HIS : no HE2:sc= -1.49 K(o=-0.22,f=-6.3!) USER MOD Set 6.1: A 63 THR OG1 : rot -160:sc= -1.34 USER MOD Set 6.2: A 65 GLN : amide:sc= -2.12 X(o=-3.5,f=-3.3!) USER MOD Single : A 1 THR N :NH3+ -116:sc= 0.335 (180deg=-0.124) USER MOD Single : A 1 THR OG1 : rot 120:sc= -0.142 USER MOD Single : A 7 GLN : amide:sc= -1.3 K(o=-1.3,f=-2.2) USER MOD Single : A 15 LYS NZ :NH3+ -167:sc= -1.29 (180deg=-1.53) USER MOD Single : A 18 HIS : no HD1:sc= -1.29 K(o=-1.3,f=-2.9!) USER MOD Single : A 22 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 28 HIS : no HD1:sc= -0.612 X(o=-0.61,f=-0.15) USER MOD Single : A 29 TYR OH : rot 180:sc= -0.195 USER MOD Single : A 33 GLN : amide:sc= -5.63! K(o=-5.6!,f=-1.9) USER MOD Single : A 34 THR OG1 : rot -79:sc= 0.898 USER MOD Single : A 37 LYS NZ :NH3+ -123:sc= 0.206 (180deg=0) USER MOD Single : A 39 MET CE :methyl -123:sc= -1.56 (180deg=-3.09!) USER MOD Single : A 45 THR OG1 : rot 30:sc= 0.0995 USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 85:sc= 0.0217 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 ASN : amide:sc= -2.19! C(o=-2.2!,f=-2.3!) USER MOD Single : A 64 HIS : no HD1:sc= -0.073 X(o=-0.073,f=-0.32) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 GLN : amide:sc= -0.124 K(o=-0.12,f=-1.8!) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 HIS : no HE2:sc= -4.67! C(o=-4.7!,f=-11!) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 GLN : amide:sc= -1.8 K(o=-1.8,f=-1.2) USER MOD Single : A 101 GLN : amide:sc= -1.32 K(o=-1.3,f=-0.21) USER MOD Single : A 104 THR OG1 : rot 180:sc= -0.995 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= -0.0582 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 SER OG : rot 38:sc= 0.857 USER MOD Single : A 126 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 MET CE :methyl -140:sc= -5.4! (180deg=-9.06!) USER MOD Single : A 132 ASN : amide:sc= -0.258 X(o=-0.26,f=0) USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0.0376 USER MOD Single : A 148 ASN : amide:sc= -1.06 K(o=-1.1,f=-3.7!) USER MOD Single : A 152 THR OG1 : rot 100:sc= 0.435 USER MOD Single : A 154 THR OG1 : rot 180:sc= -0.533 USER MOD Single : A 159 GLN : amide:sc= -0.143 K(o=-0.14,f=-3.2!) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 168 NDP O2D : rot -126:sc= 1.02 USER MOD Single : A 168 NDP O3B : rot 100:sc= 0.0964 USER MOD Single : A 168 NDP O3D : rot -170:sc= -1.86! USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -5.662 9.816 3.840 1.00 0.00 N ATOM 2 CA THR A 1 -5.160 9.021 2.683 1.00 0.00 C ATOM 3 C THR A 1 -3.639 8.889 2.774 1.00 0.00 C ATOM 4 O THR A 1 -2.918 9.863 2.723 1.00 0.00 O ATOM 5 CB THR A 1 -5.537 9.718 1.374 1.00 0.00 C ATOM 6 OG1 THR A 1 -6.683 10.528 1.584 1.00 0.00 O ATOM 7 CG2 THR A 1 -5.845 8.669 0.307 1.00 0.00 C ATOM 0 H1 THR A 1 -6.273 9.219 4.433 1.00 0.00 H new ATOM 0 H2 THR A 1 -4.857 10.154 4.404 1.00 0.00 H new ATOM 0 H3 THR A 1 -6.207 10.630 3.491 1.00 0.00 H new ATOM 0 HA THR A 1 -5.612 8.029 2.705 1.00 0.00 H new ATOM 0 HB THR A 1 -4.706 10.340 1.042 1.00 0.00 H new ATOM 0 HG1 THR A 1 -6.465 11.462 1.384 1.00 0.00 H new ATOM 0 HG21 THR A 1 -6.113 9.166 -0.625 1.00 0.00 H new ATOM 0 HG22 THR A 1 -4.966 8.045 0.145 1.00 0.00 H new ATOM 0 HG23 THR A 1 -6.676 8.046 0.638 1.00 0.00 H new ATOM 17 N ALA A 2 -3.149 7.686 2.898 1.00 0.00 N ATOM 18 CA ALA A 2 -1.674 7.487 2.987 1.00 0.00 C ATOM 19 C ALA A 2 -1.256 6.371 2.031 1.00 0.00 C ATOM 20 O ALA A 2 -2.035 5.503 1.704 1.00 0.00 O ATOM 21 CB ALA A 2 -1.295 7.102 4.418 1.00 0.00 C ATOM 0 H ALA A 2 -3.706 6.832 2.942 1.00 0.00 H new ATOM 0 HA ALA A 2 -1.164 8.411 2.715 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -0.217 6.957 4.482 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -1.595 7.897 5.100 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -1.803 6.177 4.693 1.00 0.00 H new ATOM 27 N PHE A 3 -0.028 6.374 1.592 1.00 0.00 N ATOM 28 CA PHE A 3 0.433 5.300 0.667 1.00 0.00 C ATOM 29 C PHE A 3 1.298 4.317 1.453 1.00 0.00 C ATOM 30 O PHE A 3 2.152 4.715 2.220 1.00 0.00 O ATOM 31 CB PHE A 3 1.259 5.920 -0.464 1.00 0.00 C ATOM 32 CG PHE A 3 0.342 6.446 -1.546 1.00 0.00 C ATOM 33 CD1 PHE A 3 -0.767 7.229 -1.213 1.00 0.00 C ATOM 34 CD2 PHE A 3 0.607 6.148 -2.884 1.00 0.00 C ATOM 35 CE1 PHE A 3 -1.609 7.711 -2.218 1.00 0.00 C ATOM 36 CE2 PHE A 3 -0.235 6.631 -3.889 1.00 0.00 C ATOM 37 CZ PHE A 3 -1.342 7.412 -3.556 1.00 0.00 C ATOM 0 H PHE A 3 0.675 7.072 1.833 1.00 0.00 H new ATOM 0 HA PHE A 3 -0.425 4.781 0.240 1.00 0.00 H new ATOM 0 HB2 PHE A 3 1.876 6.729 -0.073 1.00 0.00 H new ATOM 0 HB3 PHE A 3 1.937 5.175 -0.881 1.00 0.00 H new ATOM 0 HD1 PHE A 3 -0.973 7.461 -0.179 1.00 0.00 H new ATOM 0 HD2 PHE A 3 1.464 5.543 -3.142 1.00 0.00 H new ATOM 0 HE1 PHE A 3 -2.467 8.315 -1.960 1.00 0.00 H new ATOM 0 HE2 PHE A 3 -0.029 6.400 -4.924 1.00 0.00 H new ATOM 0 HZ PHE A 3 -1.993 7.785 -4.333 1.00 0.00 H new ATOM 47 N LEU A 4 1.092 3.037 1.279 1.00 0.00 N ATOM 48 CA LEU A 4 1.915 2.052 2.033 1.00 0.00 C ATOM 49 C LEU A 4 2.427 0.969 1.074 1.00 0.00 C ATOM 50 O LEU A 4 1.788 -0.040 0.875 1.00 0.00 O ATOM 51 CB LEU A 4 1.045 1.417 3.125 1.00 0.00 C ATOM 52 CG LEU A 4 1.821 0.311 3.846 1.00 0.00 C ATOM 53 CD1 LEU A 4 3.134 0.874 4.399 1.00 0.00 C ATOM 54 CD2 LEU A 4 0.974 -0.226 5.003 1.00 0.00 C ATOM 0 H LEU A 4 0.395 2.636 0.652 1.00 0.00 H new ATOM 0 HA LEU A 4 2.770 2.550 2.489 1.00 0.00 H new ATOM 0 HB2 LEU A 4 0.734 2.178 3.840 1.00 0.00 H new ATOM 0 HB3 LEU A 4 0.138 1.005 2.683 1.00 0.00 H new ATOM 0 HG LEU A 4 2.042 -0.493 3.144 1.00 0.00 H new ATOM 0 HD11 LEU A 4 3.682 0.083 4.911 1.00 0.00 H new ATOM 0 HD12 LEU A 4 3.738 1.261 3.578 1.00 0.00 H new ATOM 0 HD13 LEU A 4 2.918 1.679 5.102 1.00 0.00 H new ATOM 0 HD21 LEU A 4 1.522 -1.014 5.520 1.00 0.00 H new ATOM 0 HD22 LEU A 4 0.757 0.583 5.701 1.00 0.00 H new ATOM 0 HD23 LEU A 4 0.040 -0.630 4.613 1.00 0.00 H new ATOM 66 N TRP A 5 3.576 1.170 0.478 1.00 0.00 N ATOM 67 CA TRP A 5 4.113 0.144 -0.464 1.00 0.00 C ATOM 68 C TRP A 5 5.606 -0.087 -0.198 1.00 0.00 C ATOM 69 O TRP A 5 6.342 0.833 0.104 1.00 0.00 O ATOM 70 CB TRP A 5 3.910 0.619 -1.910 1.00 0.00 C ATOM 71 CG TRP A 5 4.941 1.643 -2.273 1.00 0.00 C ATOM 72 CD1 TRP A 5 6.057 1.396 -2.998 1.00 0.00 C ATOM 73 CD2 TRP A 5 4.970 3.063 -1.948 1.00 0.00 C ATOM 74 NE1 TRP A 5 6.768 2.575 -3.141 1.00 0.00 N ATOM 75 CE2 TRP A 5 6.139 3.630 -2.512 1.00 0.00 C ATOM 76 CE3 TRP A 5 4.105 3.905 -1.227 1.00 0.00 C ATOM 77 CZ2 TRP A 5 6.436 4.985 -2.367 1.00 0.00 C ATOM 78 CZ3 TRP A 5 4.402 5.270 -1.080 1.00 0.00 C ATOM 79 CH2 TRP A 5 5.564 5.808 -1.649 1.00 0.00 C ATOM 0 H TRP A 5 4.162 1.996 0.603 1.00 0.00 H new ATOM 0 HA TRP A 5 3.579 -0.794 -0.312 1.00 0.00 H new ATOM 0 HB2 TRP A 5 3.976 -0.230 -2.591 1.00 0.00 H new ATOM 0 HB3 TRP A 5 2.912 1.042 -2.024 1.00 0.00 H new ATOM 0 HD1 TRP A 5 6.346 0.436 -3.399 1.00 0.00 H new ATOM 0 HE1 TRP A 5 7.649 2.654 -3.649 1.00 0.00 H new ATOM 0 HE3 TRP A 5 3.207 3.500 -0.784 1.00 0.00 H new ATOM 0 HZ2 TRP A 5 7.333 5.395 -2.806 1.00 0.00 H new ATOM 0 HZ3 TRP A 5 3.731 5.909 -0.525 1.00 0.00 H new ATOM 0 HH2 TRP A 5 5.786 6.859 -1.533 1.00 0.00 H new ATOM 90 N ALA A 6 6.057 -1.307 -0.317 1.00 0.00 N ATOM 91 CA ALA A 6 7.499 -1.598 -0.089 1.00 0.00 C ATOM 92 C ALA A 6 8.192 -1.720 -1.448 1.00 0.00 C ATOM 93 O ALA A 6 7.738 -2.435 -2.320 1.00 0.00 O ATOM 94 CB ALA A 6 7.646 -2.911 0.683 1.00 0.00 C ATOM 0 H ALA A 6 5.486 -2.116 -0.563 1.00 0.00 H new ATOM 0 HA ALA A 6 7.953 -0.795 0.492 1.00 0.00 H new ATOM 0 HB1 ALA A 6 8.703 -3.120 0.848 1.00 0.00 H new ATOM 0 HB2 ALA A 6 7.139 -2.827 1.644 1.00 0.00 H new ATOM 0 HB3 ALA A 6 7.201 -3.723 0.108 1.00 0.00 H new ATOM 100 N GLN A 7 9.273 -1.017 -1.645 1.00 0.00 N ATOM 101 CA GLN A 7 9.972 -1.089 -2.961 1.00 0.00 C ATOM 102 C GLN A 7 11.465 -1.340 -2.751 1.00 0.00 C ATOM 103 O GLN A 7 12.001 -1.115 -1.684 1.00 0.00 O ATOM 104 CB GLN A 7 9.778 0.227 -3.715 1.00 0.00 C ATOM 105 CG GLN A 7 10.221 1.393 -2.830 1.00 0.00 C ATOM 106 CD GLN A 7 10.842 2.490 -3.697 1.00 0.00 C ATOM 107 OE1 GLN A 7 10.145 3.343 -4.209 1.00 0.00 O ATOM 108 NE2 GLN A 7 12.134 2.503 -3.885 1.00 0.00 N ATOM 0 H GLN A 7 9.702 -0.399 -0.956 1.00 0.00 H new ATOM 0 HA GLN A 7 9.551 -1.910 -3.541 1.00 0.00 H new ATOM 0 HB2 GLN A 7 10.357 0.218 -4.639 1.00 0.00 H new ATOM 0 HB3 GLN A 7 8.732 0.347 -3.995 1.00 0.00 H new ATOM 0 HG2 GLN A 7 9.368 1.790 -2.280 1.00 0.00 H new ATOM 0 HG3 GLN A 7 10.944 1.047 -2.091 1.00 0.00 H new ATOM 0 HE21 GLN A 7 12.719 1.787 -3.455 1.00 0.00 H new ATOM 0 HE22 GLN A 7 12.558 3.229 -4.462 1.00 0.00 H new ATOM 117 N ASP A 8 12.139 -1.808 -3.770 1.00 0.00 N ATOM 118 CA ASP A 8 13.598 -2.081 -3.641 1.00 0.00 C ATOM 119 C ASP A 8 14.390 -0.821 -3.996 1.00 0.00 C ATOM 120 O ASP A 8 13.857 0.271 -4.020 1.00 0.00 O ATOM 121 CB ASP A 8 13.990 -3.227 -4.582 1.00 0.00 C ATOM 122 CG ASP A 8 13.849 -2.778 -6.040 1.00 0.00 C ATOM 123 OD1 ASP A 8 12.738 -2.482 -6.442 1.00 0.00 O ATOM 124 OD2 ASP A 8 14.856 -2.738 -6.727 1.00 0.00 O ATOM 0 H ASP A 8 11.740 -2.012 -4.686 1.00 0.00 H new ATOM 0 HA ASP A 8 13.825 -2.367 -2.614 1.00 0.00 H new ATOM 0 HB2 ASP A 8 15.017 -3.535 -4.385 1.00 0.00 H new ATOM 0 HB3 ASP A 8 13.356 -4.094 -4.397 1.00 0.00 H new ATOM 129 N ARG A 9 15.661 -0.963 -4.258 1.00 0.00 N ATOM 130 CA ARG A 9 16.490 0.230 -4.596 1.00 0.00 C ATOM 131 C ARG A 9 15.960 0.915 -5.864 1.00 0.00 C ATOM 132 O ARG A 9 15.840 2.124 -5.912 1.00 0.00 O ATOM 133 CB ARG A 9 17.947 -0.196 -4.811 1.00 0.00 C ATOM 134 CG ARG A 9 18.015 -1.375 -5.789 1.00 0.00 C ATOM 135 CD ARG A 9 18.469 -0.882 -7.167 1.00 0.00 C ATOM 136 NE ARG A 9 19.762 -1.538 -7.530 1.00 0.00 N ATOM 137 CZ ARG A 9 20.911 -1.016 -7.167 1.00 0.00 C ATOM 138 NH1 ARG A 9 20.960 0.094 -6.475 1.00 0.00 N ATOM 139 NH2 ARG A 9 22.022 -1.612 -7.502 1.00 0.00 N ATOM 0 H ARG A 9 16.161 -1.852 -4.253 1.00 0.00 H new ATOM 0 HA ARG A 9 16.435 0.937 -3.768 1.00 0.00 H new ATOM 0 HB2 ARG A 9 18.525 0.642 -5.200 1.00 0.00 H new ATOM 0 HB3 ARG A 9 18.396 -0.478 -3.858 1.00 0.00 H new ATOM 0 HG2 ARG A 9 18.708 -2.129 -5.416 1.00 0.00 H new ATOM 0 HG3 ARG A 9 17.038 -1.851 -5.867 1.00 0.00 H new ATOM 0 HD2 ARG A 9 17.710 -1.111 -7.915 1.00 0.00 H new ATOM 0 HD3 ARG A 9 18.589 0.201 -7.156 1.00 0.00 H new ATOM 0 HE ARG A 9 19.752 -2.405 -8.068 1.00 0.00 H new ATOM 0 HH11 ARG A 9 20.097 0.568 -6.209 1.00 0.00 H new ATOM 0 HH12 ARG A 9 21.861 0.485 -6.202 1.00 0.00 H new ATOM 0 HH21 ARG A 9 21.994 -2.477 -8.042 1.00 0.00 H new ATOM 0 HH22 ARG A 9 22.919 -1.213 -7.224 1.00 0.00 H new ATOM 153 N ASP A 10 15.656 0.168 -6.896 1.00 0.00 N ATOM 154 CA ASP A 10 15.154 0.799 -8.155 1.00 0.00 C ATOM 155 C ASP A 10 13.735 1.339 -7.952 1.00 0.00 C ATOM 156 O ASP A 10 13.349 2.325 -8.550 1.00 0.00 O ATOM 157 CB ASP A 10 15.143 -0.245 -9.274 1.00 0.00 C ATOM 158 CG ASP A 10 16.527 -0.316 -9.921 1.00 0.00 C ATOM 159 OD1 ASP A 10 17.077 0.732 -10.217 1.00 0.00 O ATOM 160 OD2 ASP A 10 17.015 -1.419 -10.109 1.00 0.00 O ATOM 0 H ASP A 10 15.733 -0.849 -6.921 1.00 0.00 H new ATOM 0 HA ASP A 10 15.812 1.626 -8.423 1.00 0.00 H new ATOM 0 HB2 ASP A 10 14.867 -1.220 -8.873 1.00 0.00 H new ATOM 0 HB3 ASP A 10 14.394 0.016 -10.021 1.00 0.00 H new ATOM 165 N GLY A 11 12.958 0.709 -7.113 1.00 0.00 N ATOM 166 CA GLY A 11 11.568 1.199 -6.875 1.00 0.00 C ATOM 167 C GLY A 11 10.553 0.220 -7.473 1.00 0.00 C ATOM 168 O GLY A 11 9.570 0.618 -8.067 1.00 0.00 O ATOM 0 H GLY A 11 13.223 -0.121 -6.583 1.00 0.00 H new ATOM 0 HA2 GLY A 11 11.391 1.309 -5.805 1.00 0.00 H new ATOM 0 HA3 GLY A 11 11.440 2.185 -7.322 1.00 0.00 H new ATOM 172 N LEU A 12 10.776 -1.057 -7.311 1.00 0.00 N ATOM 173 CA LEU A 12 9.821 -2.066 -7.859 1.00 0.00 C ATOM 174 C LEU A 12 8.781 -2.397 -6.783 1.00 0.00 C ATOM 175 O LEU A 12 9.024 -2.211 -5.609 1.00 0.00 O ATOM 176 CB LEU A 12 10.602 -3.332 -8.241 1.00 0.00 C ATOM 177 CG LEU A 12 9.646 -4.433 -8.707 1.00 0.00 C ATOM 178 CD1 LEU A 12 9.126 -4.106 -10.108 1.00 0.00 C ATOM 179 CD2 LEU A 12 10.395 -5.765 -8.737 1.00 0.00 C ATOM 0 H LEU A 12 11.581 -1.447 -6.821 1.00 0.00 H new ATOM 0 HA LEU A 12 9.316 -1.674 -8.742 1.00 0.00 H new ATOM 0 HB2 LEU A 12 11.314 -3.102 -9.033 1.00 0.00 H new ATOM 0 HB3 LEU A 12 11.179 -3.682 -7.385 1.00 0.00 H new ATOM 0 HG LEU A 12 8.803 -4.500 -8.020 1.00 0.00 H new ATOM 0 HD11 LEU A 12 8.446 -4.892 -10.436 1.00 0.00 H new ATOM 0 HD12 LEU A 12 8.596 -3.154 -10.086 1.00 0.00 H new ATOM 0 HD13 LEU A 12 9.965 -4.039 -10.801 1.00 0.00 H new ATOM 0 HD21 LEU A 12 9.720 -6.554 -9.068 1.00 0.00 H new ATOM 0 HD22 LEU A 12 11.236 -5.694 -9.426 1.00 0.00 H new ATOM 0 HD23 LEU A 12 10.763 -5.998 -7.738 1.00 0.00 H new ATOM 191 N ILE A 13 7.629 -2.889 -7.167 1.00 0.00 N ATOM 192 CA ILE A 13 6.597 -3.238 -6.145 1.00 0.00 C ATOM 193 C ILE A 13 6.237 -4.724 -6.259 1.00 0.00 C ATOM 194 O ILE A 13 6.504 -5.496 -5.358 1.00 0.00 O ATOM 195 CB ILE A 13 5.333 -2.378 -6.310 1.00 0.00 C ATOM 196 CG1 ILE A 13 5.042 -2.108 -7.790 1.00 0.00 C ATOM 197 CG2 ILE A 13 5.530 -1.049 -5.579 1.00 0.00 C ATOM 198 CD1 ILE A 13 3.578 -2.445 -8.086 1.00 0.00 C ATOM 0 H ILE A 13 7.361 -3.063 -8.136 1.00 0.00 H new ATOM 0 HA ILE A 13 7.014 -3.037 -5.158 1.00 0.00 H new ATOM 0 HB ILE A 13 4.486 -2.919 -5.887 1.00 0.00 H new ATOM 0 HG12 ILE A 13 5.242 -1.063 -8.027 1.00 0.00 H new ATOM 0 HG13 ILE A 13 5.700 -2.709 -8.418 1.00 0.00 H new ATOM 0 HG21 ILE A 13 4.636 -0.435 -5.693 1.00 0.00 H new ATOM 0 HG22 ILE A 13 5.707 -1.239 -4.520 1.00 0.00 H new ATOM 0 HG23 ILE A 13 6.387 -0.525 -6.002 1.00 0.00 H new ATOM 0 HD11 ILE A 13 3.366 -2.254 -9.138 1.00 0.00 H new ATOM 0 HD12 ILE A 13 3.394 -3.496 -7.864 1.00 0.00 H new ATOM 0 HD13 ILE A 13 2.930 -1.825 -7.467 1.00 0.00 H new ATOM 210 N GLY A 14 5.620 -5.141 -7.339 1.00 0.00 N ATOM 211 CA GLY A 14 5.247 -6.585 -7.461 1.00 0.00 C ATOM 212 C GLY A 14 5.080 -6.966 -8.932 1.00 0.00 C ATOM 213 O GLY A 14 4.725 -6.148 -9.757 1.00 0.00 O ATOM 0 H GLY A 14 5.362 -4.553 -8.131 1.00 0.00 H new ATOM 0 HA2 GLY A 14 6.016 -7.207 -7.002 1.00 0.00 H new ATOM 0 HA3 GLY A 14 4.319 -6.775 -6.921 1.00 0.00 H new ATOM 217 N LYS A 15 5.347 -8.203 -9.272 1.00 0.00 N ATOM 218 CA LYS A 15 5.213 -8.629 -10.695 1.00 0.00 C ATOM 219 C LYS A 15 4.371 -9.905 -10.789 1.00 0.00 C ATOM 220 O LYS A 15 4.562 -10.845 -10.041 1.00 0.00 O ATOM 221 CB LYS A 15 6.604 -8.897 -11.275 1.00 0.00 C ATOM 222 CG LYS A 15 6.513 -9.006 -12.801 1.00 0.00 C ATOM 223 CD LYS A 15 7.253 -10.262 -13.277 1.00 0.00 C ATOM 224 CE LYS A 15 8.522 -9.862 -14.036 1.00 0.00 C ATOM 225 NZ LYS A 15 9.715 -10.129 -13.184 1.00 0.00 N ATOM 0 H LYS A 15 5.651 -8.932 -8.627 1.00 0.00 H new ATOM 0 HA LYS A 15 4.721 -7.836 -11.259 1.00 0.00 H new ATOM 0 HB2 LYS A 15 7.286 -8.093 -10.998 1.00 0.00 H new ATOM 0 HB3 LYS A 15 7.011 -9.818 -10.858 1.00 0.00 H new ATOM 0 HG2 LYS A 15 5.469 -9.049 -13.110 1.00 0.00 H new ATOM 0 HG3 LYS A 15 6.946 -8.120 -13.265 1.00 0.00 H new ATOM 0 HD2 LYS A 15 7.511 -10.888 -12.423 1.00 0.00 H new ATOM 0 HD3 LYS A 15 6.604 -10.855 -13.922 1.00 0.00 H new ATOM 0 HE2 LYS A 15 8.594 -10.424 -14.967 1.00 0.00 H new ATOM 0 HE3 LYS A 15 8.481 -8.806 -14.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 10.548 -9.663 -13.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 9.549 -9.757 -12.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 9.882 -11.154 -13.133 1.00 0.00 H new ATOM 239 N ASP A 16 3.443 -9.941 -11.709 1.00 0.00 N ATOM 240 CA ASP A 16 2.580 -11.149 -11.876 1.00 0.00 C ATOM 241 C ASP A 16 1.801 -11.425 -10.585 1.00 0.00 C ATOM 242 O ASP A 16 1.382 -12.536 -10.326 1.00 0.00 O ATOM 243 CB ASP A 16 3.451 -12.357 -12.227 1.00 0.00 C ATOM 244 CG ASP A 16 3.789 -12.319 -13.719 1.00 0.00 C ATOM 245 OD1 ASP A 16 2.866 -12.240 -14.513 1.00 0.00 O ATOM 246 OD2 ASP A 16 4.964 -12.369 -14.041 1.00 0.00 O ATOM 0 H ASP A 16 3.244 -9.179 -12.357 1.00 0.00 H new ATOM 0 HA ASP A 16 1.869 -10.970 -12.683 1.00 0.00 H new ATOM 0 HB2 ASP A 16 4.366 -12.345 -11.635 1.00 0.00 H new ATOM 0 HB3 ASP A 16 2.926 -13.281 -11.984 1.00 0.00 H new ATOM 251 N GLY A 17 1.586 -10.414 -9.787 1.00 0.00 N ATOM 252 CA GLY A 17 0.813 -10.605 -8.526 1.00 0.00 C ATOM 253 C GLY A 17 1.746 -10.969 -7.367 1.00 0.00 C ATOM 254 O GLY A 17 1.904 -10.212 -6.430 1.00 0.00 O ATOM 0 H GLY A 17 1.913 -9.462 -9.954 1.00 0.00 H new ATOM 0 HA2 GLY A 17 0.267 -9.692 -8.287 1.00 0.00 H new ATOM 0 HA3 GLY A 17 0.072 -11.393 -8.664 1.00 0.00 H new ATOM 258 N HIS A 18 2.350 -12.126 -7.411 1.00 0.00 N ATOM 259 CA HIS A 18 3.254 -12.539 -6.296 1.00 0.00 C ATOM 260 C HIS A 18 4.475 -11.618 -6.234 1.00 0.00 C ATOM 261 O HIS A 18 5.133 -11.368 -7.228 1.00 0.00 O ATOM 262 CB HIS A 18 3.712 -13.985 -6.513 1.00 0.00 C ATOM 263 CG HIS A 18 4.297 -14.134 -7.890 1.00 0.00 C ATOM 264 ND1 HIS A 18 5.610 -13.792 -8.176 1.00 0.00 N ATOM 265 CD2 HIS A 18 3.764 -14.593 -9.068 1.00 0.00 C ATOM 266 CE1 HIS A 18 5.820 -14.049 -9.480 1.00 0.00 C ATOM 267 NE2 HIS A 18 4.727 -14.539 -10.071 1.00 0.00 N ATOM 0 H HIS A 18 2.258 -12.803 -8.169 1.00 0.00 H new ATOM 0 HA HIS A 18 2.709 -12.466 -5.355 1.00 0.00 H new ATOM 0 HB2 HIS A 18 4.453 -14.258 -5.762 1.00 0.00 H new ATOM 0 HB3 HIS A 18 2.869 -14.665 -6.391 1.00 0.00 H new ATOM 0 HD2 HIS A 18 2.751 -14.943 -9.197 1.00 0.00 H new ATOM 0 HE1 HIS A 18 6.758 -13.880 -9.987 1.00 0.00 H new ATOM 0 HE2 HIS A 18 4.621 -14.814 -11.047 1.00 0.00 H new ATOM 275 N LEU A 19 4.779 -11.109 -5.067 1.00 0.00 N ATOM 276 CA LEU A 19 5.956 -10.202 -4.919 1.00 0.00 C ATOM 277 C LEU A 19 7.209 -10.904 -5.453 1.00 0.00 C ATOM 278 O LEU A 19 7.245 -12.115 -5.539 1.00 0.00 O ATOM 279 CB LEU A 19 6.160 -9.864 -3.441 1.00 0.00 C ATOM 280 CG LEU A 19 5.313 -8.648 -3.072 1.00 0.00 C ATOM 281 CD1 LEU A 19 4.887 -8.751 -1.608 1.00 0.00 C ATOM 282 CD2 LEU A 19 6.133 -7.373 -3.275 1.00 0.00 C ATOM 0 H LEU A 19 4.260 -11.284 -4.207 1.00 0.00 H new ATOM 0 HA LEU A 19 5.779 -9.285 -5.482 1.00 0.00 H new ATOM 0 HB2 LEU A 19 5.881 -10.716 -2.821 1.00 0.00 H new ATOM 0 HB3 LEU A 19 7.213 -9.659 -3.246 1.00 0.00 H new ATOM 0 HG LEU A 19 4.428 -8.615 -3.708 1.00 0.00 H new ATOM 0 HD11 LEU A 19 4.282 -7.884 -1.343 1.00 0.00 H new ATOM 0 HD12 LEU A 19 4.302 -9.659 -1.462 1.00 0.00 H new ATOM 0 HD13 LEU A 19 5.772 -8.784 -0.973 1.00 0.00 H new ATOM 0 HD21 LEU A 19 5.528 -6.505 -3.012 1.00 0.00 H new ATOM 0 HD22 LEU A 19 7.018 -7.405 -2.640 1.00 0.00 H new ATOM 0 HD23 LEU A 19 6.438 -7.299 -4.319 1.00 0.00 H new ATOM 294 N PRO A 20 8.202 -10.122 -5.799 1.00 0.00 N ATOM 295 CA PRO A 20 9.518 -10.584 -6.350 1.00 0.00 C ATOM 296 C PRO A 20 10.454 -11.005 -5.213 1.00 0.00 C ATOM 297 O PRO A 20 11.260 -11.902 -5.363 1.00 0.00 O ATOM 298 CB PRO A 20 10.106 -9.393 -7.103 1.00 0.00 C ATOM 299 CG PRO A 20 9.266 -8.178 -6.756 1.00 0.00 C ATOM 300 CD PRO A 20 8.237 -8.620 -5.721 1.00 0.00 C ATOM 0 HA PRO A 20 9.392 -11.447 -7.004 1.00 0.00 H new ATOM 0 HB2 PRO A 20 11.146 -9.235 -6.819 1.00 0.00 H new ATOM 0 HB3 PRO A 20 10.094 -9.574 -8.178 1.00 0.00 H new ATOM 0 HG2 PRO A 20 9.892 -7.379 -6.359 1.00 0.00 H new ATOM 0 HG3 PRO A 20 8.773 -7.785 -7.645 1.00 0.00 H new ATOM 0 HD2 PRO A 20 8.518 -8.286 -4.722 1.00 0.00 H new ATOM 0 HD3 PRO A 20 7.257 -8.194 -5.936 1.00 0.00 H new ATOM 308 N TRP A 21 10.365 -10.355 -4.083 1.00 0.00 N ATOM 309 CA TRP A 21 11.261 -10.707 -2.944 1.00 0.00 C ATOM 310 C TRP A 21 10.444 -11.312 -1.798 1.00 0.00 C ATOM 311 O TRP A 21 9.365 -10.853 -1.479 1.00 0.00 O ATOM 312 CB TRP A 21 11.955 -9.436 -2.447 1.00 0.00 C ATOM 313 CG TRP A 21 10.919 -8.403 -2.131 1.00 0.00 C ATOM 314 CD1 TRP A 21 10.175 -8.369 -1.001 1.00 0.00 C ATOM 315 CD2 TRP A 21 10.495 -7.265 -2.936 1.00 0.00 C ATOM 316 NE1 TRP A 21 9.316 -7.286 -1.063 1.00 0.00 N ATOM 317 CE2 TRP A 21 9.476 -6.573 -2.234 1.00 0.00 C ATOM 318 CE3 TRP A 21 10.888 -6.770 -4.193 1.00 0.00 C ATOM 319 CZ2 TRP A 21 8.870 -5.432 -2.762 1.00 0.00 C ATOM 320 CZ3 TRP A 21 10.279 -5.621 -4.727 1.00 0.00 C ATOM 321 CH2 TRP A 21 9.272 -4.954 -4.012 1.00 0.00 C ATOM 0 H TRP A 21 9.710 -9.595 -3.900 1.00 0.00 H new ATOM 0 HA TRP A 21 12.000 -11.435 -3.279 1.00 0.00 H new ATOM 0 HB2 TRP A 21 12.550 -9.655 -1.560 1.00 0.00 H new ATOM 0 HB3 TRP A 21 12.641 -9.061 -3.207 1.00 0.00 H new ATOM 0 HD1 TRP A 21 10.241 -9.072 -0.184 1.00 0.00 H new ATOM 0 HE1 TRP A 21 8.646 -7.044 -0.333 1.00 0.00 H new ATOM 0 HE3 TRP A 21 11.662 -7.276 -4.751 1.00 0.00 H new ATOM 0 HZ2 TRP A 21 8.096 -4.922 -2.208 1.00 0.00 H new ATOM 0 HZ3 TRP A 21 10.588 -5.249 -5.693 1.00 0.00 H new ATOM 0 HH2 TRP A 21 8.808 -4.072 -4.428 1.00 0.00 H new ATOM 332 N HIS A 22 10.955 -12.338 -1.176 1.00 0.00 N ATOM 333 CA HIS A 22 10.218 -12.970 -0.045 1.00 0.00 C ATOM 334 C HIS A 22 10.690 -12.344 1.272 1.00 0.00 C ATOM 335 O HIS A 22 11.684 -12.752 1.839 1.00 0.00 O ATOM 336 CB HIS A 22 10.497 -14.474 -0.027 1.00 0.00 C ATOM 337 CG HIS A 22 9.371 -15.185 0.671 1.00 0.00 C ATOM 338 ND1 HIS A 22 8.347 -15.810 -0.023 1.00 0.00 N ATOM 339 CD2 HIS A 22 9.092 -15.376 2.002 1.00 0.00 C ATOM 340 CE1 HIS A 22 7.509 -16.343 0.884 1.00 0.00 C ATOM 341 NE2 HIS A 22 7.916 -16.108 2.134 1.00 0.00 N ATOM 0 H HIS A 22 11.852 -12.767 -1.402 1.00 0.00 H new ATOM 0 HA HIS A 22 9.147 -12.806 -0.167 1.00 0.00 H new ATOM 0 HB2 HIS A 22 10.601 -14.847 -1.046 1.00 0.00 H new ATOM 0 HB3 HIS A 22 11.439 -14.674 0.483 1.00 0.00 H new ATOM 0 HD2 HIS A 22 9.694 -15.013 2.822 1.00 0.00 H new ATOM 0 HE1 HIS A 22 6.615 -16.894 0.632 1.00 0.00 H new ATOM 0 HE2 HIS A 22 7.463 -16.402 2.999 1.00 0.00 H new ATOM 349 N LEU A 23 9.988 -11.354 1.758 1.00 0.00 N ATOM 350 CA LEU A 23 10.398 -10.698 3.035 1.00 0.00 C ATOM 351 C LEU A 23 9.225 -10.724 4.025 1.00 0.00 C ATOM 352 O LEU A 23 8.274 -9.982 3.870 1.00 0.00 O ATOM 353 CB LEU A 23 10.797 -9.243 2.757 1.00 0.00 C ATOM 354 CG LEU A 23 11.268 -8.578 4.054 1.00 0.00 C ATOM 355 CD1 LEU A 23 12.549 -9.254 4.538 1.00 0.00 C ATOM 356 CD2 LEU A 23 11.542 -7.090 3.803 1.00 0.00 C ATOM 0 H LEU A 23 9.148 -10.971 1.325 1.00 0.00 H new ATOM 0 HA LEU A 23 11.246 -11.234 3.461 1.00 0.00 H new ATOM 0 HB2 LEU A 23 11.591 -9.210 2.011 1.00 0.00 H new ATOM 0 HB3 LEU A 23 9.949 -8.696 2.344 1.00 0.00 H new ATOM 0 HG LEU A 23 10.492 -8.680 4.812 1.00 0.00 H new ATOM 0 HD11 LEU A 23 12.884 -8.781 5.461 1.00 0.00 H new ATOM 0 HD12 LEU A 23 12.356 -10.311 4.722 1.00 0.00 H new ATOM 0 HD13 LEU A 23 13.323 -9.154 3.777 1.00 0.00 H new ATOM 0 HD21 LEU A 23 11.877 -6.621 4.728 1.00 0.00 H new ATOM 0 HD22 LEU A 23 12.316 -6.986 3.042 1.00 0.00 H new ATOM 0 HD23 LEU A 23 10.628 -6.605 3.460 1.00 0.00 H new ATOM 368 N PRO A 24 9.326 -11.575 5.018 1.00 0.00 N ATOM 369 CA PRO A 24 8.298 -11.763 6.100 1.00 0.00 C ATOM 370 C PRO A 24 8.257 -10.524 6.999 1.00 0.00 C ATOM 371 O PRO A 24 7.212 -10.127 7.477 1.00 0.00 O ATOM 372 CB PRO A 24 8.713 -12.989 6.910 1.00 0.00 C ATOM 373 CG PRO A 24 10.036 -13.480 6.365 1.00 0.00 C ATOM 374 CD PRO A 24 10.474 -12.518 5.267 1.00 0.00 C ATOM 0 HA PRO A 24 7.305 -11.903 5.674 1.00 0.00 H new ATOM 0 HB2 PRO A 24 8.806 -12.735 7.966 1.00 0.00 H new ATOM 0 HB3 PRO A 24 7.956 -13.770 6.835 1.00 0.00 H new ATOM 0 HG2 PRO A 24 10.784 -13.521 7.157 1.00 0.00 H new ATOM 0 HG3 PRO A 24 9.935 -14.491 5.969 1.00 0.00 H new ATOM 0 HD2 PRO A 24 11.365 -11.968 5.570 1.00 0.00 H new ATOM 0 HD3 PRO A 24 10.729 -13.062 4.358 1.00 0.00 H new ATOM 382 N ASP A 25 9.387 -9.912 7.232 1.00 0.00 N ATOM 383 CA ASP A 25 9.420 -8.699 8.100 1.00 0.00 C ATOM 384 C ASP A 25 8.657 -7.553 7.426 1.00 0.00 C ATOM 385 O ASP A 25 8.187 -6.641 8.079 1.00 0.00 O ATOM 386 CB ASP A 25 10.874 -8.278 8.325 1.00 0.00 C ATOM 387 CG ASP A 25 11.004 -7.590 9.685 1.00 0.00 C ATOM 388 OD1 ASP A 25 11.101 -8.295 10.676 1.00 0.00 O ATOM 389 OD2 ASP A 25 11.005 -6.370 9.711 1.00 0.00 O ATOM 0 H ASP A 25 10.291 -10.200 6.858 1.00 0.00 H new ATOM 0 HA ASP A 25 8.950 -8.928 9.056 1.00 0.00 H new ATOM 0 HB2 ASP A 25 11.526 -9.150 8.283 1.00 0.00 H new ATOM 0 HB3 ASP A 25 11.194 -7.602 7.532 1.00 0.00 H new ATOM 394 N ASP A 26 8.530 -7.589 6.125 1.00 0.00 N ATOM 395 CA ASP A 26 7.799 -6.499 5.418 1.00 0.00 C ATOM 396 C ASP A 26 6.295 -6.760 5.525 1.00 0.00 C ATOM 397 O ASP A 26 5.523 -5.865 5.807 1.00 0.00 O ATOM 398 CB ASP A 26 8.229 -6.462 3.947 1.00 0.00 C ATOM 399 CG ASP A 26 7.351 -5.479 3.164 1.00 0.00 C ATOM 400 OD1 ASP A 26 7.316 -4.311 3.530 1.00 0.00 O ATOM 401 OD2 ASP A 26 6.720 -5.917 2.218 1.00 0.00 O ATOM 0 H ASP A 26 8.900 -8.325 5.524 1.00 0.00 H new ATOM 0 HA ASP A 26 8.032 -5.536 5.874 1.00 0.00 H new ATOM 0 HB2 ASP A 26 9.275 -6.165 3.874 1.00 0.00 H new ATOM 0 HB3 ASP A 26 8.149 -7.458 3.512 1.00 0.00 H new ATOM 406 N LEU A 27 5.871 -7.981 5.311 1.00 0.00 N ATOM 407 CA LEU A 27 4.415 -8.292 5.413 1.00 0.00 C ATOM 408 C LEU A 27 3.902 -7.837 6.781 1.00 0.00 C ATOM 409 O LEU A 27 2.825 -7.288 6.901 1.00 0.00 O ATOM 410 CB LEU A 27 4.201 -9.800 5.261 1.00 0.00 C ATOM 411 CG LEU A 27 4.600 -10.235 3.850 1.00 0.00 C ATOM 412 CD1 LEU A 27 4.983 -11.715 3.862 1.00 0.00 C ATOM 413 CD2 LEU A 27 3.421 -10.023 2.897 1.00 0.00 C ATOM 0 H LEU A 27 6.469 -8.772 5.071 1.00 0.00 H new ATOM 0 HA LEU A 27 3.872 -7.771 4.624 1.00 0.00 H new ATOM 0 HB2 LEU A 27 4.795 -10.338 6.000 1.00 0.00 H new ATOM 0 HB3 LEU A 27 3.157 -10.050 5.448 1.00 0.00 H new ATOM 0 HG LEU A 27 5.450 -9.641 3.515 1.00 0.00 H new ATOM 0 HD11 LEU A 27 5.267 -12.025 2.857 1.00 0.00 H new ATOM 0 HD12 LEU A 27 5.823 -11.868 4.540 1.00 0.00 H new ATOM 0 HD13 LEU A 27 4.132 -12.308 4.198 1.00 0.00 H new ATOM 0 HD21 LEU A 27 3.706 -10.333 1.892 1.00 0.00 H new ATOM 0 HD22 LEU A 27 2.571 -10.616 3.233 1.00 0.00 H new ATOM 0 HD23 LEU A 27 3.146 -8.968 2.887 1.00 0.00 H new ATOM 425 N HIS A 28 4.678 -8.049 7.812 1.00 0.00 N ATOM 426 CA HIS A 28 4.250 -7.617 9.171 1.00 0.00 C ATOM 427 C HIS A 28 4.164 -6.090 9.201 1.00 0.00 C ATOM 428 O HIS A 28 3.271 -5.519 9.795 1.00 0.00 O ATOM 429 CB HIS A 28 5.273 -8.090 10.206 1.00 0.00 C ATOM 430 CG HIS A 28 5.343 -9.592 10.196 1.00 0.00 C ATOM 431 ND1 HIS A 28 4.206 -10.385 10.172 1.00 0.00 N ATOM 432 CD2 HIS A 28 6.406 -10.461 10.208 1.00 0.00 C ATOM 433 CE1 HIS A 28 4.608 -11.669 10.170 1.00 0.00 C ATOM 434 NE2 HIS A 28 5.939 -11.772 10.191 1.00 0.00 N ATOM 0 H HIS A 28 5.590 -8.503 7.769 1.00 0.00 H new ATOM 0 HA HIS A 28 3.277 -8.048 9.405 1.00 0.00 H new ATOM 0 HB2 HIS A 28 6.253 -7.669 9.982 1.00 0.00 H new ATOM 0 HB3 HIS A 28 4.992 -7.736 11.198 1.00 0.00 H new ATOM 0 HD2 HIS A 28 7.446 -10.171 10.228 1.00 0.00 H new ATOM 0 HE1 HIS A 28 3.936 -12.514 10.153 1.00 0.00 H new ATOM 0 HE2 HIS A 28 6.494 -12.628 10.194 1.00 0.00 H new ATOM 442 N TYR A 29 5.083 -5.427 8.549 1.00 0.00 N ATOM 443 CA TYR A 29 5.054 -3.937 8.519 1.00 0.00 C ATOM 444 C TYR A 29 3.794 -3.473 7.786 1.00 0.00 C ATOM 445 O TYR A 29 3.170 -2.497 8.154 1.00 0.00 O ATOM 446 CB TYR A 29 6.291 -3.419 7.782 1.00 0.00 C ATOM 447 CG TYR A 29 6.394 -1.923 7.957 1.00 0.00 C ATOM 448 CD1 TYR A 29 6.787 -1.388 9.189 1.00 0.00 C ATOM 449 CD2 TYR A 29 6.100 -1.071 6.885 1.00 0.00 C ATOM 450 CE1 TYR A 29 6.887 -0.001 9.350 1.00 0.00 C ATOM 451 CE2 TYR A 29 6.199 0.316 7.047 1.00 0.00 C ATOM 452 CZ TYR A 29 6.592 0.851 8.279 1.00 0.00 C ATOM 453 OH TYR A 29 6.691 2.218 8.438 1.00 0.00 O ATOM 0 H TYR A 29 5.853 -5.855 8.035 1.00 0.00 H new ATOM 0 HA TYR A 29 5.049 -3.549 9.538 1.00 0.00 H new ATOM 0 HB2 TYR A 29 7.187 -3.903 8.170 1.00 0.00 H new ATOM 0 HB3 TYR A 29 6.227 -3.668 6.723 1.00 0.00 H new ATOM 0 HD1 TYR A 29 7.013 -2.045 10.016 1.00 0.00 H new ATOM 0 HD2 TYR A 29 5.797 -1.484 5.934 1.00 0.00 H new ATOM 0 HE1 TYR A 29 7.192 0.412 10.300 1.00 0.00 H new ATOM 0 HE2 TYR A 29 5.972 0.973 6.221 1.00 0.00 H new ATOM 0 HH TYR A 29 6.453 2.663 7.598 1.00 0.00 H new ATOM 463 N PHE A 30 3.419 -4.172 6.748 1.00 0.00 N ATOM 464 CA PHE A 30 2.203 -3.788 5.976 1.00 0.00 C ATOM 465 C PHE A 30 0.962 -3.961 6.857 1.00 0.00 C ATOM 466 O PHE A 30 0.123 -3.086 6.944 1.00 0.00 O ATOM 467 CB PHE A 30 2.088 -4.686 4.739 1.00 0.00 C ATOM 468 CG PHE A 30 0.805 -4.383 4.002 1.00 0.00 C ATOM 469 CD1 PHE A 30 0.543 -3.081 3.562 1.00 0.00 C ATOM 470 CD2 PHE A 30 -0.122 -5.404 3.763 1.00 0.00 C ATOM 471 CE1 PHE A 30 -0.647 -2.800 2.881 1.00 0.00 C ATOM 472 CE2 PHE A 30 -1.311 -5.123 3.081 1.00 0.00 C ATOM 473 CZ PHE A 30 -1.574 -3.820 2.640 1.00 0.00 C ATOM 0 H PHE A 30 3.907 -4.998 6.400 1.00 0.00 H new ATOM 0 HA PHE A 30 2.279 -2.746 5.664 1.00 0.00 H new ATOM 0 HB2 PHE A 30 2.942 -4.525 4.081 1.00 0.00 H new ATOM 0 HB3 PHE A 30 2.108 -5.734 5.037 1.00 0.00 H new ATOM 0 HD1 PHE A 30 1.258 -2.293 3.748 1.00 0.00 H new ATOM 0 HD2 PHE A 30 0.080 -6.408 4.105 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -0.850 -1.795 2.541 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -2.026 -5.911 2.895 1.00 0.00 H new ATOM 0 HZ PHE A 30 -2.492 -3.603 2.114 1.00 0.00 H new ATOM 483 N ARG A 31 0.844 -5.083 7.512 1.00 0.00 N ATOM 484 CA ARG A 31 -0.338 -5.317 8.389 1.00 0.00 C ATOM 485 C ARG A 31 -0.321 -4.312 9.542 1.00 0.00 C ATOM 486 O ARG A 31 -1.234 -3.528 9.710 1.00 0.00 O ATOM 487 CB ARG A 31 -0.272 -6.741 8.946 1.00 0.00 C ATOM 488 CG ARG A 31 -1.600 -7.098 9.614 1.00 0.00 C ATOM 489 CD ARG A 31 -1.399 -8.317 10.516 1.00 0.00 C ATOM 490 NE ARG A 31 -0.603 -7.918 11.715 1.00 0.00 N ATOM 491 CZ ARG A 31 0.401 -8.651 12.139 1.00 0.00 C ATOM 492 NH1 ARG A 31 0.727 -9.768 11.537 1.00 0.00 N ATOM 493 NH2 ARG A 31 1.081 -8.266 13.185 1.00 0.00 N ATOM 0 H ARG A 31 1.516 -5.849 7.478 1.00 0.00 H new ATOM 0 HA ARG A 31 -1.256 -5.191 7.815 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -0.057 -7.446 8.143 1.00 0.00 H new ATOM 0 HB3 ARG A 31 0.542 -6.822 9.667 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -1.965 -6.254 10.199 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -2.355 -7.311 8.858 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -2.364 -8.719 10.823 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -0.884 -9.107 9.970 1.00 0.00 H new ATOM 0 HE ARG A 31 -0.843 -7.061 12.213 1.00 0.00 H new ATOM 0 HH11 ARG A 31 0.198 -10.082 10.724 1.00 0.00 H new ATOM 0 HH12 ARG A 31 1.510 -10.323 11.882 1.00 0.00 H new ATOM 0 HH21 ARG A 31 0.831 -7.402 13.666 1.00 0.00 H new ATOM 0 HH22 ARG A 31 1.862 -8.829 13.521 1.00 0.00 H new ATOM 507 N ALA A 32 0.713 -4.339 10.341 1.00 0.00 N ATOM 508 CA ALA A 32 0.808 -3.399 11.498 1.00 0.00 C ATOM 509 C ALA A 32 0.540 -1.958 11.042 1.00 0.00 C ATOM 510 O ALA A 32 -0.079 -1.183 11.743 1.00 0.00 O ATOM 511 CB ALA A 32 2.210 -3.487 12.104 1.00 0.00 C ATOM 0 H ALA A 32 1.502 -4.977 10.241 1.00 0.00 H new ATOM 0 HA ALA A 32 0.061 -3.676 12.242 1.00 0.00 H new ATOM 0 HB1 ALA A 32 2.285 -2.803 12.949 1.00 0.00 H new ATOM 0 HB2 ALA A 32 2.396 -4.506 12.444 1.00 0.00 H new ATOM 0 HB3 ALA A 32 2.950 -3.215 11.351 1.00 0.00 H new ATOM 517 N GLN A 33 1.020 -1.587 9.886 1.00 0.00 N ATOM 518 CA GLN A 33 0.811 -0.191 9.399 1.00 0.00 C ATOM 519 C GLN A 33 -0.652 0.030 8.985 1.00 0.00 C ATOM 520 O GLN A 33 -1.099 1.153 8.855 1.00 0.00 O ATOM 521 CB GLN A 33 1.718 0.055 8.192 1.00 0.00 C ATOM 522 CG GLN A 33 3.136 0.372 8.671 1.00 0.00 C ATOM 523 CD GLN A 33 3.180 1.794 9.232 1.00 0.00 C ATOM 524 OE1 GLN A 33 3.650 2.012 10.331 1.00 0.00 O ATOM 525 NE2 GLN A 33 2.708 2.779 8.517 1.00 0.00 N ATOM 0 H GLN A 33 1.549 -2.190 9.256 1.00 0.00 H new ATOM 0 HA GLN A 33 1.052 0.502 10.205 1.00 0.00 H new ATOM 0 HB2 GLN A 33 1.729 -0.824 7.548 1.00 0.00 H new ATOM 0 HB3 GLN A 33 1.331 0.882 7.596 1.00 0.00 H new ATOM 0 HG2 GLN A 33 3.441 -0.342 9.436 1.00 0.00 H new ATOM 0 HG3 GLN A 33 3.841 0.274 7.845 1.00 0.00 H new ATOM 0 HE21 GLN A 33 2.313 2.596 7.594 1.00 0.00 H new ATOM 0 HE22 GLN A 33 2.734 3.731 8.881 1.00 0.00 H new ATOM 534 N THR A 34 -1.393 -1.022 8.751 1.00 0.00 N ATOM 535 CA THR A 34 -2.815 -0.842 8.319 1.00 0.00 C ATOM 536 C THR A 34 -3.782 -1.488 9.318 1.00 0.00 C ATOM 537 O THR A 34 -4.833 -1.968 8.941 1.00 0.00 O ATOM 538 CB THR A 34 -3.010 -1.487 6.944 1.00 0.00 C ATOM 539 OG1 THR A 34 -2.722 -2.875 7.030 1.00 0.00 O ATOM 540 CG2 THR A 34 -2.071 -0.832 5.930 1.00 0.00 C ATOM 0 H THR A 34 -1.081 -1.989 8.839 1.00 0.00 H new ATOM 0 HA THR A 34 -3.028 0.226 8.272 1.00 0.00 H new ATOM 0 HB THR A 34 -4.042 -1.347 6.621 1.00 0.00 H new ATOM 0 HG1 THR A 34 -1.751 -3.009 7.020 1.00 0.00 H new ATOM 0 HG21 THR A 34 -2.212 -1.293 4.953 1.00 0.00 H new ATOM 0 HG22 THR A 34 -2.293 0.233 5.864 1.00 0.00 H new ATOM 0 HG23 THR A 34 -1.038 -0.968 6.250 1.00 0.00 H new ATOM 548 N VAL A 35 -3.452 -1.504 10.582 1.00 0.00 N ATOM 549 CA VAL A 35 -4.378 -2.124 11.577 1.00 0.00 C ATOM 550 C VAL A 35 -5.421 -1.100 12.040 1.00 0.00 C ATOM 551 O VAL A 35 -5.092 -0.039 12.533 1.00 0.00 O ATOM 552 CB VAL A 35 -3.584 -2.626 12.786 1.00 0.00 C ATOM 553 CG1 VAL A 35 -2.678 -3.780 12.356 1.00 0.00 C ATOM 554 CG2 VAL A 35 -2.727 -1.490 13.356 1.00 0.00 C ATOM 0 H VAL A 35 -2.590 -1.119 10.967 1.00 0.00 H new ATOM 0 HA VAL A 35 -4.887 -2.963 11.104 1.00 0.00 H new ATOM 0 HB VAL A 35 -4.278 -2.970 13.553 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -2.112 -4.138 13.216 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -3.287 -4.592 11.958 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -1.988 -3.434 11.586 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -2.165 -1.854 14.216 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -2.034 -1.139 12.592 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -3.372 -0.668 13.666 1.00 0.00 H new ATOM 564 N GLY A 36 -6.681 -1.422 11.897 1.00 0.00 N ATOM 565 CA GLY A 36 -7.757 -0.487 12.341 1.00 0.00 C ATOM 566 C GLY A 36 -7.916 0.676 11.354 1.00 0.00 C ATOM 567 O GLY A 36 -8.572 1.655 11.650 1.00 0.00 O ATOM 0 H GLY A 36 -7.012 -2.297 11.490 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -8.700 -1.027 12.427 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -7.520 -0.098 13.331 1.00 0.00 H new ATOM 571 N LYS A 37 -7.326 0.588 10.190 1.00 0.00 N ATOM 572 CA LYS A 37 -7.459 1.707 9.209 1.00 0.00 C ATOM 573 C LYS A 37 -8.048 1.180 7.896 1.00 0.00 C ATOM 574 O LYS A 37 -8.100 -0.011 7.664 1.00 0.00 O ATOM 575 CB LYS A 37 -6.084 2.324 8.948 1.00 0.00 C ATOM 576 CG LYS A 37 -5.436 2.716 10.279 1.00 0.00 C ATOM 577 CD LYS A 37 -3.916 2.577 10.169 1.00 0.00 C ATOM 578 CE LYS A 37 -3.241 3.710 10.944 1.00 0.00 C ATOM 579 NZ LYS A 37 -1.768 3.654 10.724 1.00 0.00 N ATOM 0 H LYS A 37 -6.762 -0.203 9.878 1.00 0.00 H new ATOM 0 HA LYS A 37 -8.125 2.467 9.618 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -5.450 1.613 8.419 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -6.183 3.201 8.308 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -5.700 3.742 10.536 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -5.813 2.080 11.080 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -3.599 1.612 10.565 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -3.612 2.607 9.123 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -3.632 4.673 10.616 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -3.464 3.621 12.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -1.283 3.574 11.640 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -1.536 2.828 10.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -1.456 4.521 10.242 1.00 0.00 H new ATOM 593 N ILE A 38 -8.502 2.062 7.040 1.00 0.00 N ATOM 594 CA ILE A 38 -9.097 1.617 5.745 1.00 0.00 C ATOM 595 C ILE A 38 -7.982 1.233 4.766 1.00 0.00 C ATOM 596 O ILE A 38 -7.128 2.032 4.439 1.00 0.00 O ATOM 597 CB ILE A 38 -9.929 2.759 5.152 1.00 0.00 C ATOM 598 CG1 ILE A 38 -11.055 3.126 6.123 1.00 0.00 C ATOM 599 CG2 ILE A 38 -10.535 2.326 3.813 1.00 0.00 C ATOM 600 CD1 ILE A 38 -11.842 4.312 5.564 1.00 0.00 C ATOM 0 H ILE A 38 -8.486 3.072 7.184 1.00 0.00 H new ATOM 0 HA ILE A 38 -9.735 0.750 5.918 1.00 0.00 H new ATOM 0 HB ILE A 38 -9.285 3.623 4.991 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -11.717 2.272 6.269 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -10.641 3.378 7.099 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -11.125 3.144 3.399 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -9.736 2.067 3.119 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -11.176 1.458 3.968 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -12.644 4.574 6.254 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -11.175 5.166 5.441 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -12.269 4.043 4.598 1.00 0.00 H new ATOM 612 N MET A 39 -7.986 0.012 4.302 1.00 0.00 N ATOM 613 CA MET A 39 -6.933 -0.438 3.346 1.00 0.00 C ATOM 614 C MET A 39 -7.502 -0.453 1.923 1.00 0.00 C ATOM 615 O MET A 39 -8.331 -1.278 1.590 1.00 0.00 O ATOM 616 CB MET A 39 -6.488 -1.849 3.732 1.00 0.00 C ATOM 617 CG MET A 39 -5.191 -2.203 3.006 1.00 0.00 C ATOM 618 SD MET A 39 -4.742 -3.913 3.392 1.00 0.00 S ATOM 619 CE MET A 39 -5.975 -4.713 2.338 1.00 0.00 C ATOM 0 H MET A 39 -8.678 -0.697 4.546 1.00 0.00 H new ATOM 0 HA MET A 39 -6.083 0.244 3.384 1.00 0.00 H new ATOM 0 HB2 MET A 39 -6.340 -1.911 4.810 1.00 0.00 H new ATOM 0 HB3 MET A 39 -7.266 -2.568 3.476 1.00 0.00 H new ATOM 0 HG2 MET A 39 -5.317 -2.081 1.930 1.00 0.00 H new ATOM 0 HG3 MET A 39 -4.393 -1.527 3.312 1.00 0.00 H new ATOM 0 HE1 MET A 39 -6.595 -5.375 2.942 1.00 0.00 H new ATOM 0 HE2 MET A 39 -6.602 -3.954 1.871 1.00 0.00 H new ATOM 0 HE3 MET A 39 -5.471 -5.293 1.565 1.00 0.00 H new ATOM 629 N VAL A 40 -7.076 0.458 1.083 1.00 0.00 N ATOM 630 CA VAL A 40 -7.611 0.496 -0.312 1.00 0.00 C ATOM 631 C VAL A 40 -6.734 -0.355 -1.239 1.00 0.00 C ATOM 632 O VAL A 40 -5.564 -0.073 -1.456 1.00 0.00 O ATOM 633 CB VAL A 40 -7.630 1.940 -0.816 1.00 0.00 C ATOM 634 CG1 VAL A 40 -8.365 2.003 -2.158 1.00 0.00 C ATOM 635 CG2 VAL A 40 -8.353 2.824 0.203 1.00 0.00 C ATOM 0 H VAL A 40 -6.384 1.174 1.302 1.00 0.00 H new ATOM 0 HA VAL A 40 -8.624 0.094 -0.311 1.00 0.00 H new ATOM 0 HB VAL A 40 -6.607 2.294 -0.945 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -8.379 3.032 -2.517 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -7.852 1.372 -2.884 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -9.388 1.650 -2.029 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -8.368 3.854 -0.154 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -9.376 2.470 0.331 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -7.831 2.779 1.159 1.00 0.00 H new ATOM 645 N VAL A 41 -7.307 -1.393 -1.791 1.00 0.00 N ATOM 646 CA VAL A 41 -6.547 -2.281 -2.714 1.00 0.00 C ATOM 647 C VAL A 41 -7.371 -2.513 -3.984 1.00 0.00 C ATOM 648 O VAL A 41 -8.538 -2.847 -3.923 1.00 0.00 O ATOM 649 CB VAL A 41 -6.280 -3.622 -2.028 1.00 0.00 C ATOM 650 CG1 VAL A 41 -5.241 -3.429 -0.926 1.00 0.00 C ATOM 651 CG2 VAL A 41 -7.580 -4.152 -1.415 1.00 0.00 C ATOM 0 H VAL A 41 -8.278 -1.664 -1.639 1.00 0.00 H new ATOM 0 HA VAL A 41 -5.598 -1.812 -2.974 1.00 0.00 H new ATOM 0 HB VAL A 41 -5.907 -4.337 -2.761 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -5.049 -4.383 -0.436 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -4.315 -3.052 -1.361 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -5.616 -2.714 -0.194 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -7.389 -5.107 -0.926 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -7.954 -3.438 -0.681 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -8.323 -4.288 -2.200 1.00 0.00 H new ATOM 661 N GLY A 42 -6.778 -2.332 -5.134 1.00 0.00 N ATOM 662 CA GLY A 42 -7.533 -2.531 -6.406 1.00 0.00 C ATOM 663 C GLY A 42 -7.915 -4.004 -6.570 1.00 0.00 C ATOM 664 O GLY A 42 -7.293 -4.887 -6.013 1.00 0.00 O ATOM 0 H GLY A 42 -5.803 -2.055 -5.248 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -8.431 -1.913 -6.405 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -6.926 -2.209 -7.252 1.00 0.00 H new ATOM 668 N ARG A 43 -8.949 -4.269 -7.327 1.00 0.00 N ATOM 669 CA ARG A 43 -9.406 -5.676 -7.536 1.00 0.00 C ATOM 670 C ARG A 43 -8.247 -6.567 -8.000 1.00 0.00 C ATOM 671 O ARG A 43 -8.315 -7.777 -7.892 1.00 0.00 O ATOM 672 CB ARG A 43 -10.509 -5.691 -8.598 1.00 0.00 C ATOM 673 CG ARG A 43 -11.019 -7.122 -8.796 1.00 0.00 C ATOM 674 CD ARG A 43 -10.410 -7.711 -10.071 1.00 0.00 C ATOM 675 NE ARG A 43 -10.828 -6.889 -11.245 1.00 0.00 N ATOM 676 CZ ARG A 43 -10.733 -7.363 -12.465 1.00 0.00 C ATOM 677 NH1 ARG A 43 -10.261 -8.564 -12.683 1.00 0.00 N ATOM 678 NH2 ARG A 43 -11.110 -6.626 -13.473 1.00 0.00 N ATOM 0 H ARG A 43 -9.502 -3.563 -7.814 1.00 0.00 H new ATOM 0 HA ARG A 43 -9.783 -6.064 -6.590 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -11.329 -5.042 -8.293 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -10.125 -5.298 -9.540 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -10.753 -7.736 -7.936 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -12.107 -7.125 -8.865 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -9.323 -7.728 -9.994 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -10.737 -8.743 -10.200 1.00 0.00 H new ATOM 0 HE ARG A 43 -11.192 -5.948 -11.097 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -9.961 -9.144 -11.899 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -10.193 -8.920 -13.636 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -11.476 -5.688 -13.310 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -11.039 -6.988 -14.424 1.00 0.00 H new ATOM 692 N ARG A 44 -7.186 -6.000 -8.513 1.00 0.00 N ATOM 693 CA ARG A 44 -6.047 -6.846 -8.970 1.00 0.00 C ATOM 694 C ARG A 44 -5.262 -7.337 -7.751 1.00 0.00 C ATOM 695 O ARG A 44 -4.928 -8.502 -7.644 1.00 0.00 O ATOM 696 CB ARG A 44 -5.128 -6.021 -9.874 1.00 0.00 C ATOM 697 CG ARG A 44 -5.514 -6.240 -11.341 1.00 0.00 C ATOM 698 CD ARG A 44 -4.498 -7.172 -12.005 1.00 0.00 C ATOM 699 NE ARG A 44 -5.174 -7.961 -13.080 1.00 0.00 N ATOM 700 CZ ARG A 44 -4.941 -7.721 -14.351 1.00 0.00 C ATOM 701 NH1 ARG A 44 -4.112 -6.777 -14.723 1.00 0.00 N ATOM 702 NH2 ARG A 44 -5.547 -8.435 -15.259 1.00 0.00 N ATOM 0 H ARG A 44 -7.060 -4.995 -8.634 1.00 0.00 H new ATOM 0 HA ARG A 44 -6.427 -7.702 -9.528 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -5.207 -4.964 -9.621 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -4.089 -6.310 -9.714 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -6.513 -6.671 -11.404 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -5.544 -5.285 -11.866 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -3.677 -6.592 -12.426 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -4.066 -7.844 -11.263 1.00 0.00 H new ATOM 0 HE ARG A 44 -5.828 -8.700 -12.822 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -3.634 -6.212 -14.021 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -3.945 -6.607 -15.715 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -6.195 -9.172 -14.980 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -5.373 -8.257 -16.248 1.00 0.00 H new ATOM 716 N THR A 45 -4.970 -6.459 -6.828 1.00 0.00 N ATOM 717 CA THR A 45 -4.212 -6.879 -5.615 1.00 0.00 C ATOM 718 C THR A 45 -5.110 -7.752 -4.737 1.00 0.00 C ATOM 719 O THR A 45 -4.716 -8.815 -4.297 1.00 0.00 O ATOM 720 CB THR A 45 -3.773 -5.643 -4.826 1.00 0.00 C ATOM 721 OG1 THR A 45 -3.161 -4.712 -5.708 1.00 0.00 O ATOM 722 CG2 THR A 45 -2.775 -6.056 -3.742 1.00 0.00 C ATOM 0 H THR A 45 -5.223 -5.472 -6.862 1.00 0.00 H new ATOM 0 HA THR A 45 -3.330 -7.444 -5.916 1.00 0.00 H new ATOM 0 HB THR A 45 -4.643 -5.182 -4.359 1.00 0.00 H new ATOM 0 HG1 THR A 45 -3.551 -4.804 -6.602 1.00 0.00 H new ATOM 0 HG21 THR A 45 -2.463 -5.176 -3.180 1.00 0.00 H new ATOM 0 HG22 THR A 45 -3.247 -6.769 -3.066 1.00 0.00 H new ATOM 0 HG23 THR A 45 -1.904 -6.518 -4.206 1.00 0.00 H new ATOM 730 N TYR A 46 -6.317 -7.317 -4.481 1.00 0.00 N ATOM 731 CA TYR A 46 -7.245 -8.125 -3.635 1.00 0.00 C ATOM 732 C TYR A 46 -7.371 -9.536 -4.217 1.00 0.00 C ATOM 733 O TYR A 46 -7.583 -10.496 -3.502 1.00 0.00 O ATOM 734 CB TYR A 46 -8.622 -7.453 -3.618 1.00 0.00 C ATOM 735 CG TYR A 46 -9.447 -8.007 -2.481 1.00 0.00 C ATOM 736 CD1 TYR A 46 -9.310 -7.477 -1.192 1.00 0.00 C ATOM 737 CD2 TYR A 46 -10.351 -9.049 -2.716 1.00 0.00 C ATOM 738 CE1 TYR A 46 -10.077 -7.989 -0.139 1.00 0.00 C ATOM 739 CE2 TYR A 46 -11.119 -9.561 -1.663 1.00 0.00 C ATOM 740 CZ TYR A 46 -10.981 -9.032 -0.373 1.00 0.00 C ATOM 741 OH TYR A 46 -11.737 -9.536 0.668 1.00 0.00 O ATOM 0 H TYR A 46 -6.700 -6.435 -4.822 1.00 0.00 H new ATOM 0 HA TYR A 46 -6.855 -8.188 -2.619 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -8.509 -6.375 -3.506 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -9.132 -7.623 -4.566 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -8.612 -6.673 -1.010 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -10.456 -9.458 -3.710 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -9.971 -7.579 0.855 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -11.818 -10.364 -1.845 1.00 0.00 H new ATOM 0 HH TYR A 46 -12.314 -10.255 0.335 1.00 0.00 H new ATOM 751 N GLU A 47 -7.236 -9.667 -5.510 1.00 0.00 N ATOM 752 CA GLU A 47 -7.341 -11.014 -6.144 1.00 0.00 C ATOM 753 C GLU A 47 -6.000 -11.745 -6.022 1.00 0.00 C ATOM 754 O GLU A 47 -5.930 -12.953 -6.138 1.00 0.00 O ATOM 755 CB GLU A 47 -7.706 -10.854 -7.621 1.00 0.00 C ATOM 756 CG GLU A 47 -9.228 -10.877 -7.775 1.00 0.00 C ATOM 757 CD GLU A 47 -9.713 -12.326 -7.850 1.00 0.00 C ATOM 758 OE1 GLU A 47 -9.462 -12.962 -8.860 1.00 0.00 O ATOM 759 OE2 GLU A 47 -10.326 -12.775 -6.895 1.00 0.00 O ATOM 0 H GLU A 47 -7.057 -8.898 -6.156 1.00 0.00 H new ATOM 0 HA GLU A 47 -8.114 -11.594 -5.640 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -7.305 -9.917 -8.006 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -7.258 -11.657 -8.206 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -9.697 -10.369 -6.932 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -9.521 -10.337 -8.676 1.00 0.00 H new ATOM 766 N SER A 48 -4.937 -11.024 -5.778 1.00 0.00 N ATOM 767 CA SER A 48 -3.602 -11.676 -5.635 1.00 0.00 C ATOM 768 C SER A 48 -3.273 -11.841 -4.146 1.00 0.00 C ATOM 769 O SER A 48 -2.403 -12.604 -3.774 1.00 0.00 O ATOM 770 CB SER A 48 -2.536 -10.806 -6.302 1.00 0.00 C ATOM 771 OG SER A 48 -2.705 -10.855 -7.713 1.00 0.00 O ATOM 0 H SER A 48 -4.936 -10.010 -5.671 1.00 0.00 H new ATOM 0 HA SER A 48 -3.621 -12.655 -6.113 1.00 0.00 H new ATOM 0 HB2 SER A 48 -2.617 -9.778 -5.950 1.00 0.00 H new ATOM 0 HB3 SER A 48 -1.541 -11.158 -6.031 1.00 0.00 H new ATOM 0 HG SER A 48 -3.376 -10.195 -7.985 1.00 0.00 H new ATOM 777 N PHE A 49 -3.962 -11.119 -3.297 1.00 0.00 N ATOM 778 CA PHE A 49 -3.709 -11.203 -1.823 1.00 0.00 C ATOM 779 C PHE A 49 -3.557 -12.667 -1.379 1.00 0.00 C ATOM 780 O PHE A 49 -4.223 -13.539 -1.901 1.00 0.00 O ATOM 781 CB PHE A 49 -4.905 -10.589 -1.088 1.00 0.00 C ATOM 782 CG PHE A 49 -4.475 -9.352 -0.340 1.00 0.00 C ATOM 783 CD1 PHE A 49 -4.512 -8.109 -0.969 1.00 0.00 C ATOM 784 CD2 PHE A 49 -4.043 -9.452 0.983 1.00 0.00 C ATOM 785 CE1 PHE A 49 -4.116 -6.963 -0.274 1.00 0.00 C ATOM 786 CE2 PHE A 49 -3.645 -8.307 1.677 1.00 0.00 C ATOM 787 CZ PHE A 49 -3.682 -7.062 1.048 1.00 0.00 C ATOM 0 H PHE A 49 -4.699 -10.466 -3.565 1.00 0.00 H new ATOM 0 HA PHE A 49 -2.789 -10.667 -1.590 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -5.690 -10.338 -1.801 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -5.327 -11.315 -0.393 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -4.847 -8.031 -1.993 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -4.016 -10.415 1.471 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -4.146 -6.000 -0.761 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -3.309 -8.385 2.700 1.00 0.00 H new ATOM 0 HZ PHE A 49 -3.375 -6.176 1.584 1.00 0.00 H new ATOM 797 N PRO A 50 -2.699 -12.890 -0.409 1.00 0.00 N ATOM 798 CA PRO A 50 -2.406 -14.230 0.200 1.00 0.00 C ATOM 799 C PRO A 50 -3.473 -14.546 1.251 1.00 0.00 C ATOM 800 O PRO A 50 -4.244 -15.475 1.110 1.00 0.00 O ATOM 801 CB PRO A 50 -1.040 -14.113 0.863 1.00 0.00 C ATOM 802 CG PRO A 50 -0.742 -12.637 1.017 1.00 0.00 C ATOM 803 CD PRO A 50 -1.838 -11.866 0.283 1.00 0.00 C ATOM 0 HA PRO A 50 -2.411 -15.025 -0.546 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -1.040 -14.609 1.834 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -0.275 -14.599 0.257 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -0.718 -12.359 2.071 1.00 0.00 H new ATOM 0 HG3 PRO A 50 0.237 -12.399 0.602 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -2.428 -11.273 0.982 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -1.406 -11.172 -0.438 1.00 0.00 H new ATOM 811 N LYS A 51 -3.525 -13.767 2.299 1.00 0.00 N ATOM 812 CA LYS A 51 -4.543 -14.001 3.361 1.00 0.00 C ATOM 813 C LYS A 51 -5.536 -12.836 3.366 1.00 0.00 C ATOM 814 O LYS A 51 -5.178 -11.704 3.626 1.00 0.00 O ATOM 815 CB LYS A 51 -3.851 -14.095 4.725 1.00 0.00 C ATOM 816 CG LYS A 51 -3.864 -15.548 5.208 1.00 0.00 C ATOM 817 CD LYS A 51 -5.016 -15.752 6.196 1.00 0.00 C ATOM 818 CE LYS A 51 -5.688 -17.101 5.930 1.00 0.00 C ATOM 819 NZ LYS A 51 -6.820 -17.289 6.880 1.00 0.00 N ATOM 0 H LYS A 51 -2.903 -12.976 2.464 1.00 0.00 H new ATOM 0 HA LYS A 51 -5.072 -14.933 3.165 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -2.825 -13.736 4.649 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -4.360 -13.456 5.447 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -3.976 -16.223 4.359 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -2.915 -15.791 5.686 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -4.642 -15.716 7.219 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -5.743 -14.946 6.094 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -6.051 -17.142 4.903 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -4.965 -17.908 6.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -7.276 -18.206 6.699 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -6.461 -17.267 7.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -7.514 -16.525 6.749 1.00 0.00 H new ATOM 833 N ARG A 52 -6.778 -13.107 3.074 1.00 0.00 N ATOM 834 CA ARG A 52 -7.798 -12.019 3.058 1.00 0.00 C ATOM 835 C ARG A 52 -9.135 -12.565 3.574 1.00 0.00 C ATOM 836 O ARG A 52 -9.500 -13.684 3.270 1.00 0.00 O ATOM 837 CB ARG A 52 -7.972 -11.489 1.629 1.00 0.00 C ATOM 838 CG ARG A 52 -8.061 -12.657 0.641 1.00 0.00 C ATOM 839 CD ARG A 52 -7.694 -12.170 -0.764 1.00 0.00 C ATOM 840 NE ARG A 52 -8.925 -12.096 -1.606 1.00 0.00 N ATOM 841 CZ ARG A 52 -9.118 -12.925 -2.608 1.00 0.00 C ATOM 842 NH1 ARG A 52 -8.246 -13.859 -2.894 1.00 0.00 N ATOM 843 NH2 ARG A 52 -10.197 -12.812 -3.333 1.00 0.00 N ATOM 0 H ARG A 52 -7.132 -14.036 2.845 1.00 0.00 H new ATOM 0 HA ARG A 52 -7.466 -11.204 3.701 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -8.874 -10.880 1.566 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -7.133 -10.844 1.367 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -7.387 -13.458 0.947 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -9.069 -13.071 0.642 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -7.220 -11.190 -0.708 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -6.971 -12.848 -1.218 1.00 0.00 H new ATOM 0 HE ARG A 52 -9.630 -11.388 -1.400 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -7.398 -13.953 -2.335 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -8.415 -14.492 -3.676 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -10.881 -12.086 -3.120 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -10.357 -13.450 -4.113 1.00 0.00 H new ATOM 857 N PRO A 53 -9.831 -11.757 4.338 1.00 0.00 N ATOM 858 CA PRO A 53 -9.445 -10.364 4.755 1.00 0.00 C ATOM 859 C PRO A 53 -8.496 -10.417 5.957 1.00 0.00 C ATOM 860 O PRO A 53 -8.271 -11.461 6.538 1.00 0.00 O ATOM 861 CB PRO A 53 -10.743 -9.660 5.142 1.00 0.00 C ATOM 862 CG PRO A 53 -11.812 -10.726 5.279 1.00 0.00 C ATOM 863 CD PRO A 53 -11.166 -12.069 4.947 1.00 0.00 C ATOM 0 HA PRO A 53 -8.930 -9.837 3.952 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -10.620 -9.116 6.079 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -11.024 -8.929 4.384 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -12.217 -10.735 6.291 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -12.644 -10.524 4.605 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -11.051 -12.677 5.844 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -11.786 -12.638 4.254 1.00 0.00 H new ATOM 871 N LEU A 54 -7.937 -9.296 6.329 1.00 0.00 N ATOM 872 CA LEU A 54 -6.999 -9.272 7.488 1.00 0.00 C ATOM 873 C LEU A 54 -7.790 -9.343 8.800 1.00 0.00 C ATOM 874 O LEU A 54 -8.946 -8.972 8.847 1.00 0.00 O ATOM 875 CB LEU A 54 -6.191 -7.974 7.454 1.00 0.00 C ATOM 876 CG LEU A 54 -5.225 -8.006 6.270 1.00 0.00 C ATOM 877 CD1 LEU A 54 -4.995 -6.580 5.760 1.00 0.00 C ATOM 878 CD2 LEU A 54 -3.891 -8.614 6.717 1.00 0.00 C ATOM 0 H LEU A 54 -8.090 -8.394 5.878 1.00 0.00 H new ATOM 0 HA LEU A 54 -6.328 -10.128 7.427 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -6.861 -7.118 7.368 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -5.638 -7.853 8.385 1.00 0.00 H new ATOM 0 HG LEU A 54 -5.649 -8.612 5.469 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -4.306 -6.602 4.916 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -5.945 -6.150 5.442 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -4.570 -5.972 6.559 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -3.201 -8.637 5.873 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -3.465 -8.009 7.517 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -4.057 -9.629 7.079 1.00 0.00 H new ATOM 890 N PRO A 55 -7.133 -9.817 9.831 1.00 0.00 N ATOM 891 CA PRO A 55 -7.693 -9.979 11.219 1.00 0.00 C ATOM 892 C PRO A 55 -7.975 -8.607 11.842 1.00 0.00 C ATOM 893 O PRO A 55 -7.076 -7.828 12.087 1.00 0.00 O ATOM 894 CB PRO A 55 -6.647 -10.721 12.046 1.00 0.00 C ATOM 895 CG PRO A 55 -5.412 -10.893 11.188 1.00 0.00 C ATOM 896 CD PRO A 55 -5.702 -10.287 9.820 1.00 0.00 C ATOM 0 HA PRO A 55 -8.631 -10.533 11.191 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -6.408 -10.161 12.950 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -7.029 -11.691 12.363 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -4.556 -10.401 11.649 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -5.159 -11.949 11.091 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -5.026 -9.456 9.617 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -5.546 -11.024 9.032 1.00 0.00 H new ATOM 904 N GLU A 56 -9.221 -8.317 12.115 1.00 0.00 N ATOM 905 CA GLU A 56 -9.578 -7.006 12.740 1.00 0.00 C ATOM 906 C GLU A 56 -8.964 -5.850 11.940 1.00 0.00 C ATOM 907 O GLU A 56 -8.331 -4.968 12.489 1.00 0.00 O ATOM 908 CB GLU A 56 -9.050 -6.970 14.176 1.00 0.00 C ATOM 909 CG GLU A 56 -9.834 -7.967 15.036 1.00 0.00 C ATOM 910 CD GLU A 56 -8.872 -8.992 15.641 1.00 0.00 C ATOM 911 OE1 GLU A 56 -8.244 -8.671 16.637 1.00 0.00 O ATOM 912 OE2 GLU A 56 -8.779 -10.081 15.098 1.00 0.00 O ATOM 0 H GLU A 56 -10.012 -8.935 11.931 1.00 0.00 H new ATOM 0 HA GLU A 56 -10.662 -6.896 12.741 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -7.989 -7.218 14.190 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -9.148 -5.965 14.585 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -10.365 -7.440 15.829 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -10.586 -8.473 14.430 1.00 0.00 H new ATOM 919 N ARG A 57 -9.149 -5.847 10.648 1.00 0.00 N ATOM 920 CA ARG A 57 -8.581 -4.751 9.812 1.00 0.00 C ATOM 921 C ARG A 57 -9.623 -4.279 8.797 1.00 0.00 C ATOM 922 O ARG A 57 -10.306 -5.073 8.181 1.00 0.00 O ATOM 923 CB ARG A 57 -7.355 -5.266 9.058 1.00 0.00 C ATOM 924 CG ARG A 57 -6.082 -4.904 9.826 1.00 0.00 C ATOM 925 CD ARG A 57 -5.445 -6.172 10.393 1.00 0.00 C ATOM 926 NE ARG A 57 -5.118 -5.947 11.827 1.00 0.00 N ATOM 927 CZ ARG A 57 -4.559 -6.891 12.545 1.00 0.00 C ATOM 928 NH1 ARG A 57 -4.289 -8.059 12.021 1.00 0.00 N ATOM 929 NH2 ARG A 57 -4.268 -6.663 13.796 1.00 0.00 N ATOM 0 H ARG A 57 -9.670 -6.558 10.134 1.00 0.00 H new ATOM 0 HA ARG A 57 -8.298 -3.921 10.460 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -7.421 -6.347 8.934 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -7.323 -4.832 8.059 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -5.379 -4.396 9.165 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -6.318 -4.211 10.634 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -6.128 -7.015 10.290 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -4.543 -6.422 9.835 1.00 0.00 H new ATOM 0 HE ARG A 57 -5.331 -5.047 12.257 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -4.513 -8.244 11.043 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -3.854 -8.785 12.590 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -4.475 -5.754 14.210 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -3.833 -7.393 14.360 1.00 0.00 H new ATOM 943 N THR A 58 -9.736 -2.992 8.605 1.00 0.00 N ATOM 944 CA THR A 58 -10.718 -2.472 7.615 1.00 0.00 C ATOM 945 C THR A 58 -10.099 -2.568 6.221 1.00 0.00 C ATOM 946 O THR A 58 -9.100 -1.938 5.933 1.00 0.00 O ATOM 947 CB THR A 58 -11.047 -1.010 7.931 1.00 0.00 C ATOM 948 OG1 THR A 58 -11.137 -0.841 9.339 1.00 0.00 O ATOM 949 CG2 THR A 58 -12.379 -0.631 7.283 1.00 0.00 C ATOM 0 H THR A 58 -9.191 -2.280 9.091 1.00 0.00 H new ATOM 0 HA THR A 58 -11.636 -3.058 7.659 1.00 0.00 H new ATOM 0 HB THR A 58 -10.260 -0.367 7.537 1.00 0.00 H new ATOM 0 HG1 THR A 58 -10.374 -0.313 9.655 1.00 0.00 H new ATOM 0 HG21 THR A 58 -12.611 0.410 7.509 1.00 0.00 H new ATOM 0 HG22 THR A 58 -12.308 -0.760 6.203 1.00 0.00 H new ATOM 0 HG23 THR A 58 -13.169 -1.272 7.674 1.00 0.00 H new ATOM 957 N ASN A 59 -10.679 -3.353 5.354 1.00 0.00 N ATOM 958 CA ASN A 59 -10.115 -3.490 3.981 1.00 0.00 C ATOM 959 C ASN A 59 -11.167 -3.067 2.956 1.00 0.00 C ATOM 960 O ASN A 59 -12.302 -3.501 3.006 1.00 0.00 O ATOM 961 CB ASN A 59 -9.722 -4.951 3.731 1.00 0.00 C ATOM 962 CG ASN A 59 -8.959 -5.502 4.940 1.00 0.00 C ATOM 963 OD1 ASN A 59 -9.131 -6.647 5.310 1.00 0.00 O ATOM 964 ND2 ASN A 59 -8.114 -4.735 5.573 1.00 0.00 N ATOM 0 H ASN A 59 -11.517 -3.904 5.537 1.00 0.00 H new ATOM 0 HA ASN A 59 -9.234 -2.855 3.886 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -10.614 -5.550 3.550 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -9.103 -5.022 2.837 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -7.600 -5.097 6.376 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -7.968 -3.774 5.265 1.00 0.00 H new ATOM 971 N VAL A 60 -10.804 -2.225 2.025 1.00 0.00 N ATOM 972 CA VAL A 60 -11.781 -1.777 0.994 1.00 0.00 C ATOM 973 C VAL A 60 -11.218 -2.115 -0.389 1.00 0.00 C ATOM 974 O VAL A 60 -10.058 -1.880 -0.667 1.00 0.00 O ATOM 975 CB VAL A 60 -11.983 -0.265 1.117 1.00 0.00 C ATOM 976 CG1 VAL A 60 -13.108 0.183 0.182 1.00 0.00 C ATOM 977 CG2 VAL A 60 -12.350 0.079 2.562 1.00 0.00 C ATOM 0 H VAL A 60 -9.869 -1.828 1.935 1.00 0.00 H new ATOM 0 HA VAL A 60 -12.739 -2.278 1.134 1.00 0.00 H new ATOM 0 HB VAL A 60 -11.062 0.249 0.841 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -13.249 1.260 0.272 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -12.846 -0.064 -0.847 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -14.032 -0.328 0.453 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -12.495 1.155 2.654 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -13.271 -0.436 2.836 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -11.546 -0.237 3.227 1.00 0.00 H new ATOM 987 N VAL A 61 -12.016 -2.686 -1.249 1.00 0.00 N ATOM 988 CA VAL A 61 -11.506 -3.058 -2.601 1.00 0.00 C ATOM 989 C VAL A 61 -11.975 -2.042 -3.645 1.00 0.00 C ATOM 990 O VAL A 61 -13.001 -1.406 -3.498 1.00 0.00 O ATOM 991 CB VAL A 61 -12.029 -4.446 -2.979 1.00 0.00 C ATOM 992 CG1 VAL A 61 -11.281 -4.954 -4.212 1.00 0.00 C ATOM 993 CG2 VAL A 61 -11.804 -5.413 -1.814 1.00 0.00 C ATOM 0 H VAL A 61 -12.996 -2.911 -1.076 1.00 0.00 H new ATOM 0 HA VAL A 61 -10.416 -3.065 -2.576 1.00 0.00 H new ATOM 0 HB VAL A 61 -13.095 -4.384 -3.199 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -11.653 -5.942 -4.482 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -11.441 -4.267 -5.043 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -10.215 -5.015 -3.991 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -12.177 -6.401 -2.084 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -10.738 -5.475 -1.593 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -12.336 -5.052 -0.934 1.00 0.00 H new ATOM 1003 N LEU A 62 -11.224 -1.895 -4.704 1.00 0.00 N ATOM 1004 CA LEU A 62 -11.604 -0.932 -5.777 1.00 0.00 C ATOM 1005 C LEU A 62 -11.816 -1.708 -7.079 1.00 0.00 C ATOM 1006 O LEU A 62 -10.923 -2.377 -7.562 1.00 0.00 O ATOM 1007 CB LEU A 62 -10.476 0.093 -5.961 1.00 0.00 C ATOM 1008 CG LEU A 62 -11.051 1.513 -5.937 1.00 0.00 C ATOM 1009 CD1 LEU A 62 -11.658 1.802 -4.563 1.00 0.00 C ATOM 1010 CD2 LEU A 62 -9.932 2.522 -6.214 1.00 0.00 C ATOM 0 H LEU A 62 -10.357 -2.405 -4.872 1.00 0.00 H new ATOM 0 HA LEU A 62 -12.521 -0.409 -5.507 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -9.736 -0.022 -5.169 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -9.962 -0.085 -6.906 1.00 0.00 H new ATOM 0 HG LEU A 62 -11.823 1.599 -6.701 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -12.066 2.813 -4.551 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -12.455 1.087 -4.360 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -10.886 1.713 -3.798 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -10.341 3.532 -6.197 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -9.161 2.429 -5.449 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -9.497 2.323 -7.193 1.00 0.00 H new ATOM 1022 N THR A 63 -12.991 -1.635 -7.645 1.00 0.00 N ATOM 1023 CA THR A 63 -13.256 -2.381 -8.909 1.00 0.00 C ATOM 1024 C THR A 63 -14.252 -1.604 -9.771 1.00 0.00 C ATOM 1025 O THR A 63 -15.006 -0.786 -9.282 1.00 0.00 O ATOM 1026 CB THR A 63 -13.843 -3.755 -8.572 1.00 0.00 C ATOM 1027 OG1 THR A 63 -14.160 -4.443 -9.774 1.00 0.00 O ATOM 1028 CG2 THR A 63 -15.112 -3.578 -7.736 1.00 0.00 C ATOM 0 H THR A 63 -13.777 -1.092 -7.288 1.00 0.00 H new ATOM 0 HA THR A 63 -12.322 -2.502 -9.458 1.00 0.00 H new ATOM 0 HB THR A 63 -13.112 -4.332 -8.005 1.00 0.00 H new ATOM 0 HG1 THR A 63 -14.806 -5.155 -9.583 1.00 0.00 H new ATOM 0 HG21 THR A 63 -15.529 -4.556 -7.497 1.00 0.00 H new ATOM 0 HG22 THR A 63 -14.869 -3.051 -6.813 1.00 0.00 H new ATOM 0 HG23 THR A 63 -15.843 -3.000 -8.302 1.00 0.00 H new ATOM 1036 N HIS A 64 -14.264 -1.861 -11.053 1.00 0.00 N ATOM 1037 CA HIS A 64 -15.214 -1.147 -11.952 1.00 0.00 C ATOM 1038 C HIS A 64 -16.447 -2.023 -12.205 1.00 0.00 C ATOM 1039 O HIS A 64 -17.283 -1.702 -13.026 1.00 0.00 O ATOM 1040 CB HIS A 64 -14.525 -0.845 -13.286 1.00 0.00 C ATOM 1041 CG HIS A 64 -14.058 0.585 -13.301 1.00 0.00 C ATOM 1042 ND1 HIS A 64 -14.932 1.650 -13.150 1.00 0.00 N ATOM 1043 CD2 HIS A 64 -12.812 1.141 -13.454 1.00 0.00 C ATOM 1044 CE1 HIS A 64 -14.207 2.782 -13.214 1.00 0.00 C ATOM 1045 NE2 HIS A 64 -12.909 2.528 -13.399 1.00 0.00 N ATOM 0 H HIS A 64 -13.655 -2.536 -11.515 1.00 0.00 H new ATOM 0 HA HIS A 64 -15.524 -0.215 -11.479 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -13.678 -1.516 -13.429 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -15.215 -1.021 -14.111 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -11.896 0.586 -13.595 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -14.624 3.774 -13.126 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -12.151 3.206 -13.482 1.00 0.00 H new ATOM 1053 N GLN A 65 -16.568 -3.130 -11.514 1.00 0.00 N ATOM 1054 CA GLN A 65 -17.746 -4.017 -11.728 1.00 0.00 C ATOM 1055 C GLN A 65 -18.937 -3.483 -10.930 1.00 0.00 C ATOM 1056 O GLN A 65 -18.806 -2.565 -10.144 1.00 0.00 O ATOM 1057 CB GLN A 65 -17.409 -5.434 -11.260 1.00 0.00 C ATOM 1058 CG GLN A 65 -16.606 -6.155 -12.345 1.00 0.00 C ATOM 1059 CD GLN A 65 -15.233 -5.496 -12.490 1.00 0.00 C ATOM 1060 OE1 GLN A 65 -15.085 -4.524 -13.203 1.00 0.00 O ATOM 1061 NE2 GLN A 65 -14.214 -5.990 -11.841 1.00 0.00 N ATOM 0 H GLN A 65 -15.902 -3.454 -10.813 1.00 0.00 H new ATOM 0 HA GLN A 65 -18.000 -4.037 -12.788 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -16.835 -5.395 -10.334 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -18.325 -5.984 -11.045 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -16.490 -7.208 -12.087 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -17.141 -6.117 -13.294 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -14.338 -6.806 -11.242 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -13.294 -5.560 -11.933 1.00 0.00 H new ATOM 1070 N GLU A 66 -20.097 -4.049 -11.127 1.00 0.00 N ATOM 1071 CA GLU A 66 -21.297 -3.570 -10.383 1.00 0.00 C ATOM 1072 C GLU A 66 -21.815 -4.675 -9.455 1.00 0.00 C ATOM 1073 O GLU A 66 -22.524 -4.411 -8.504 1.00 0.00 O ATOM 1074 CB GLU A 66 -22.394 -3.193 -11.382 1.00 0.00 C ATOM 1075 CG GLU A 66 -22.437 -1.672 -11.549 1.00 0.00 C ATOM 1076 CD GLU A 66 -23.754 -1.269 -12.215 1.00 0.00 C ATOM 1077 OE1 GLU A 66 -23.890 -1.507 -13.404 1.00 0.00 O ATOM 1078 OE2 GLU A 66 -24.604 -0.731 -11.525 1.00 0.00 O ATOM 0 H GLU A 66 -20.265 -4.822 -11.771 1.00 0.00 H new ATOM 0 HA GLU A 66 -21.024 -2.700 -9.786 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -22.203 -3.669 -12.344 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -23.360 -3.558 -11.032 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -22.345 -1.186 -10.578 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -21.594 -1.338 -12.154 1.00 0.00 H new ATOM 1085 N ASP A 67 -21.482 -5.909 -9.728 1.00 0.00 N ATOM 1086 CA ASP A 67 -21.975 -7.020 -8.864 1.00 0.00 C ATOM 1087 C ASP A 67 -20.827 -7.600 -8.034 1.00 0.00 C ATOM 1088 O ASP A 67 -20.819 -8.773 -7.717 1.00 0.00 O ATOM 1089 CB ASP A 67 -22.571 -8.121 -9.743 1.00 0.00 C ATOM 1090 CG ASP A 67 -24.026 -7.782 -10.071 1.00 0.00 C ATOM 1091 OD1 ASP A 67 -24.240 -6.839 -10.816 1.00 0.00 O ATOM 1092 OD2 ASP A 67 -24.901 -8.470 -9.573 1.00 0.00 O ATOM 0 H ASP A 67 -20.892 -6.194 -10.509 1.00 0.00 H new ATOM 0 HA ASP A 67 -22.737 -6.630 -8.189 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -21.994 -8.219 -10.662 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -22.517 -9.080 -9.229 1.00 0.00 H new ATOM 1097 N TYR A 68 -19.861 -6.796 -7.669 1.00 0.00 N ATOM 1098 CA TYR A 68 -18.732 -7.325 -6.848 1.00 0.00 C ATOM 1099 C TYR A 68 -19.278 -7.824 -5.508 1.00 0.00 C ATOM 1100 O TYR A 68 -19.769 -7.056 -4.704 1.00 0.00 O ATOM 1101 CB TYR A 68 -17.700 -6.222 -6.604 1.00 0.00 C ATOM 1102 CG TYR A 68 -16.339 -6.852 -6.422 1.00 0.00 C ATOM 1103 CD1 TYR A 68 -15.572 -7.192 -7.542 1.00 0.00 C ATOM 1104 CD2 TYR A 68 -15.850 -7.105 -5.135 1.00 0.00 C ATOM 1105 CE1 TYR A 68 -14.315 -7.785 -7.376 1.00 0.00 C ATOM 1106 CE2 TYR A 68 -14.592 -7.697 -4.969 1.00 0.00 C ATOM 1107 CZ TYR A 68 -13.825 -8.037 -6.089 1.00 0.00 C ATOM 1108 OH TYR A 68 -12.585 -8.621 -5.926 1.00 0.00 O ATOM 0 H TYR A 68 -19.805 -5.804 -7.902 1.00 0.00 H new ATOM 0 HA TYR A 68 -18.251 -8.146 -7.380 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -17.684 -5.529 -7.445 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -17.969 -5.644 -5.720 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -15.950 -6.997 -8.535 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -16.443 -6.844 -4.271 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -13.723 -8.048 -8.240 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -14.214 -7.891 -3.976 1.00 0.00 H new ATOM 0 HH TYR A 68 -12.396 -8.725 -4.970 1.00 0.00 H new ATOM 1118 N GLN A 69 -19.200 -9.105 -5.263 1.00 0.00 N ATOM 1119 CA GLN A 69 -19.721 -9.651 -3.976 1.00 0.00 C ATOM 1120 C GLN A 69 -18.567 -9.867 -2.995 1.00 0.00 C ATOM 1121 O GLN A 69 -17.800 -10.801 -3.120 1.00 0.00 O ATOM 1122 CB GLN A 69 -20.427 -10.983 -4.234 1.00 0.00 C ATOM 1123 CG GLN A 69 -21.572 -10.771 -5.226 1.00 0.00 C ATOM 1124 CD GLN A 69 -22.803 -10.249 -4.483 1.00 0.00 C ATOM 1125 OE1 GLN A 69 -23.020 -10.582 -3.335 1.00 0.00 O ATOM 1126 NE2 GLN A 69 -23.625 -9.440 -5.095 1.00 0.00 N ATOM 0 H GLN A 69 -18.799 -9.796 -5.897 1.00 0.00 H new ATOM 0 HA GLN A 69 -20.427 -8.940 -3.547 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -19.719 -11.711 -4.630 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -20.813 -11.389 -3.299 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -21.272 -10.062 -5.997 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -21.809 -11.708 -5.730 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -23.442 -9.161 -6.059 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -24.450 -9.087 -4.609 1.00 0.00 H new ATOM 1135 N ALA A 70 -18.449 -9.016 -2.012 1.00 0.00 N ATOM 1136 CA ALA A 70 -17.355 -9.172 -1.012 1.00 0.00 C ATOM 1137 C ALA A 70 -17.921 -8.948 0.391 1.00 0.00 C ATOM 1138 O ALA A 70 -17.848 -7.863 0.934 1.00 0.00 O ATOM 1139 CB ALA A 70 -16.255 -8.145 -1.290 1.00 0.00 C ATOM 0 H ALA A 70 -19.065 -8.218 -1.858 1.00 0.00 H new ATOM 0 HA ALA A 70 -16.936 -10.176 -1.082 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -15.456 -8.261 -0.558 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -15.855 -8.302 -2.292 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -16.670 -7.139 -1.219 1.00 0.00 H new ATOM 1145 N GLN A 71 -18.491 -9.967 0.979 1.00 0.00 N ATOM 1146 CA GLN A 71 -19.068 -9.816 2.345 1.00 0.00 C ATOM 1147 C GLN A 71 -17.939 -9.765 3.373 1.00 0.00 C ATOM 1148 O GLN A 71 -17.050 -10.593 3.375 1.00 0.00 O ATOM 1149 CB GLN A 71 -19.979 -11.006 2.651 1.00 0.00 C ATOM 1150 CG GLN A 71 -21.355 -10.769 2.028 1.00 0.00 C ATOM 1151 CD GLN A 71 -22.102 -12.099 1.920 1.00 0.00 C ATOM 1152 OE1 GLN A 71 -22.409 -12.720 2.918 1.00 0.00 O ATOM 1153 NE2 GLN A 71 -22.408 -12.566 0.741 1.00 0.00 N ATOM 0 H GLN A 71 -18.581 -10.897 0.571 1.00 0.00 H new ATOM 0 HA GLN A 71 -19.647 -8.893 2.392 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -19.542 -11.923 2.256 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -20.074 -11.137 3.729 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -21.926 -10.068 2.637 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -21.247 -10.319 1.041 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -22.150 -12.044 -0.097 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -22.905 -13.453 0.657 1.00 0.00 H new ATOM 1162 N GLY A 72 -17.967 -8.796 4.246 1.00 0.00 N ATOM 1163 CA GLY A 72 -16.896 -8.687 5.274 1.00 0.00 C ATOM 1164 C GLY A 72 -15.951 -7.548 4.898 1.00 0.00 C ATOM 1165 O GLY A 72 -15.448 -6.842 5.750 1.00 0.00 O ATOM 0 H GLY A 72 -18.687 -8.074 4.291 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -17.335 -8.503 6.255 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -16.345 -9.625 5.343 1.00 0.00 H new ATOM 1169 N ALA A 73 -15.702 -7.364 3.628 1.00 0.00 N ATOM 1170 CA ALA A 73 -14.786 -6.272 3.200 1.00 0.00 C ATOM 1171 C ALA A 73 -15.581 -5.184 2.475 1.00 0.00 C ATOM 1172 O ALA A 73 -16.497 -5.459 1.725 1.00 0.00 O ATOM 1173 CB ALA A 73 -13.723 -6.840 2.256 1.00 0.00 C ATOM 0 H ALA A 73 -16.094 -7.924 2.871 1.00 0.00 H new ATOM 0 HA ALA A 73 -14.304 -5.841 4.078 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -13.051 -6.041 1.942 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -13.152 -7.612 2.773 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -14.207 -7.272 1.380 1.00 0.00 H new ATOM 1179 N VAL A 74 -15.223 -3.949 2.692 1.00 0.00 N ATOM 1180 CA VAL A 74 -15.942 -2.826 2.020 1.00 0.00 C ATOM 1181 C VAL A 74 -15.834 -2.999 0.503 1.00 0.00 C ATOM 1182 O VAL A 74 -14.964 -3.693 0.013 1.00 0.00 O ATOM 1183 CB VAL A 74 -15.306 -1.497 2.424 1.00 0.00 C ATOM 1184 CG1 VAL A 74 -16.183 -0.340 1.942 1.00 0.00 C ATOM 1185 CG2 VAL A 74 -15.172 -1.436 3.947 1.00 0.00 C ATOM 0 H VAL A 74 -14.461 -3.666 3.308 1.00 0.00 H new ATOM 0 HA VAL A 74 -16.990 -2.831 2.319 1.00 0.00 H new ATOM 0 HB VAL A 74 -14.319 -1.416 1.969 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -15.727 0.607 2.231 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -16.276 -0.381 0.857 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -17.172 -0.420 2.394 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -14.718 -0.488 4.235 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -16.159 -1.519 4.403 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -14.544 -2.258 4.290 1.00 0.00 H new ATOM 1195 N VAL A 75 -16.702 -2.371 -0.247 1.00 0.00 N ATOM 1196 CA VAL A 75 -16.641 -2.495 -1.731 1.00 0.00 C ATOM 1197 C VAL A 75 -17.016 -1.146 -2.348 1.00 0.00 C ATOM 1198 O VAL A 75 -18.036 -0.571 -2.020 1.00 0.00 O ATOM 1199 CB VAL A 75 -17.635 -3.562 -2.199 1.00 0.00 C ATOM 1200 CG1 VAL A 75 -17.499 -3.763 -3.709 1.00 0.00 C ATOM 1201 CG2 VAL A 75 -17.341 -4.882 -1.484 1.00 0.00 C ATOM 0 H VAL A 75 -17.452 -1.777 0.107 1.00 0.00 H new ATOM 0 HA VAL A 75 -15.636 -2.783 -2.039 1.00 0.00 H new ATOM 0 HB VAL A 75 -18.649 -3.238 -1.965 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -18.207 -4.523 -4.040 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -17.708 -2.824 -4.221 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -16.485 -4.086 -3.943 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -18.048 -5.642 -1.817 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -16.326 -5.204 -1.717 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -17.439 -4.742 -0.407 1.00 0.00 H new ATOM 1211 N VAL A 76 -16.203 -0.629 -3.230 1.00 0.00 N ATOM 1212 CA VAL A 76 -16.523 0.688 -3.851 1.00 0.00 C ATOM 1213 C VAL A 76 -16.038 0.706 -5.302 1.00 0.00 C ATOM 1214 O VAL A 76 -15.224 -0.101 -5.706 1.00 0.00 O ATOM 1215 CB VAL A 76 -15.818 1.797 -3.069 1.00 0.00 C ATOM 1216 CG1 VAL A 76 -16.425 1.900 -1.668 1.00 0.00 C ATOM 1217 CG2 VAL A 76 -14.325 1.472 -2.957 1.00 0.00 C ATOM 0 H VAL A 76 -15.334 -1.060 -3.546 1.00 0.00 H new ATOM 0 HA VAL A 76 -17.601 0.847 -3.829 1.00 0.00 H new ATOM 0 HB VAL A 76 -15.945 2.746 -3.590 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -15.922 2.691 -1.111 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -17.487 2.131 -1.748 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -16.299 0.951 -1.146 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -13.821 2.262 -2.400 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -14.197 0.523 -2.437 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -13.893 1.400 -3.955 1.00 0.00 H new ATOM 1227 N HIS A 77 -16.544 1.617 -6.090 1.00 0.00 N ATOM 1228 CA HIS A 77 -16.124 1.692 -7.519 1.00 0.00 C ATOM 1229 C HIS A 77 -15.900 3.156 -7.896 1.00 0.00 C ATOM 1230 O HIS A 77 -16.126 3.556 -9.022 1.00 0.00 O ATOM 1231 CB HIS A 77 -17.222 1.108 -8.414 1.00 0.00 C ATOM 1232 CG HIS A 77 -17.769 -0.149 -7.797 1.00 0.00 C ATOM 1233 ND1 HIS A 77 -17.061 -1.337 -7.799 1.00 0.00 N ATOM 1234 CD2 HIS A 77 -18.952 -0.417 -7.153 1.00 0.00 C ATOM 1235 CE1 HIS A 77 -17.814 -2.260 -7.173 1.00 0.00 C ATOM 1236 NE2 HIS A 77 -18.978 -1.751 -6.760 1.00 0.00 N ATOM 0 H HIS A 77 -17.232 2.314 -5.804 1.00 0.00 H new ATOM 0 HA HIS A 77 -15.204 1.123 -7.657 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -18.022 1.837 -8.546 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -16.820 0.893 -9.404 1.00 0.00 H new ATOM 0 HD1 HIS A 77 -16.136 -1.486 -8.202 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -19.742 0.299 -6.978 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -17.514 -3.287 -7.023 1.00 0.00 H new ATOM 1244 N ASP A 78 -15.450 3.957 -6.968 1.00 0.00 N ATOM 1245 CA ASP A 78 -15.204 5.392 -7.279 1.00 0.00 C ATOM 1246 C ASP A 78 -14.427 6.040 -6.130 1.00 0.00 C ATOM 1247 O ASP A 78 -14.937 6.196 -5.038 1.00 0.00 O ATOM 1248 CB ASP A 78 -16.541 6.113 -7.468 1.00 0.00 C ATOM 1249 CG ASP A 78 -16.794 6.337 -8.960 1.00 0.00 C ATOM 1250 OD1 ASP A 78 -16.127 7.183 -9.534 1.00 0.00 O ATOM 1251 OD2 ASP A 78 -17.650 5.659 -9.504 1.00 0.00 O ATOM 0 H ASP A 78 -15.243 3.679 -6.009 1.00 0.00 H new ATOM 0 HA ASP A 78 -14.621 5.468 -8.197 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -17.349 5.522 -7.036 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -16.529 7.068 -6.943 1.00 0.00 H new ATOM 1256 N VAL A 79 -13.191 6.401 -6.365 1.00 0.00 N ATOM 1257 CA VAL A 79 -12.360 7.033 -5.293 1.00 0.00 C ATOM 1258 C VAL A 79 -13.181 8.082 -4.528 1.00 0.00 C ATOM 1259 O VAL A 79 -12.979 8.298 -3.348 1.00 0.00 O ATOM 1260 CB VAL A 79 -11.146 7.711 -5.935 1.00 0.00 C ATOM 1261 CG1 VAL A 79 -10.338 8.445 -4.864 1.00 0.00 C ATOM 1262 CG2 VAL A 79 -10.263 6.655 -6.601 1.00 0.00 C ATOM 0 H VAL A 79 -12.717 6.284 -7.261 1.00 0.00 H new ATOM 0 HA VAL A 79 -12.034 6.262 -4.594 1.00 0.00 H new ATOM 0 HB VAL A 79 -11.489 8.426 -6.683 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -9.475 8.926 -5.325 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -10.964 9.201 -4.390 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -9.998 7.732 -4.113 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -9.399 7.138 -7.058 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -9.924 5.939 -5.852 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -10.835 6.134 -7.369 1.00 0.00 H new ATOM 1272 N ALA A 80 -14.104 8.728 -5.188 1.00 0.00 N ATOM 1273 CA ALA A 80 -14.938 9.755 -4.498 1.00 0.00 C ATOM 1274 C ALA A 80 -15.682 9.106 -3.326 1.00 0.00 C ATOM 1275 O ALA A 80 -15.798 9.675 -2.258 1.00 0.00 O ATOM 1276 CB ALA A 80 -15.950 10.336 -5.488 1.00 0.00 C ATOM 0 H ALA A 80 -14.317 8.589 -6.176 1.00 0.00 H new ATOM 0 HA ALA A 80 -14.297 10.553 -4.122 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -16.560 11.087 -4.986 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -15.420 10.797 -6.321 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -16.591 9.538 -5.863 1.00 0.00 H new ATOM 1282 N ALA A 81 -16.186 7.917 -3.525 1.00 0.00 N ATOM 1283 CA ALA A 81 -16.925 7.221 -2.433 1.00 0.00 C ATOM 1284 C ALA A 81 -15.961 6.877 -1.298 1.00 0.00 C ATOM 1285 O ALA A 81 -16.259 7.078 -0.136 1.00 0.00 O ATOM 1286 CB ALA A 81 -17.547 5.937 -2.978 1.00 0.00 C ATOM 0 H ALA A 81 -16.117 7.397 -4.400 1.00 0.00 H new ATOM 0 HA ALA A 81 -17.710 7.875 -2.054 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -18.087 5.427 -2.180 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -18.237 6.181 -3.785 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -16.761 5.285 -3.358 1.00 0.00 H new ATOM 1292 N VAL A 82 -14.809 6.351 -1.621 1.00 0.00 N ATOM 1293 CA VAL A 82 -13.829 5.989 -0.553 1.00 0.00 C ATOM 1294 C VAL A 82 -13.438 7.238 0.235 1.00 0.00 C ATOM 1295 O VAL A 82 -13.313 7.201 1.440 1.00 0.00 O ATOM 1296 CB VAL A 82 -12.571 5.370 -1.168 1.00 0.00 C ATOM 1297 CG1 VAL A 82 -11.844 4.542 -0.106 1.00 0.00 C ATOM 1298 CG2 VAL A 82 -12.956 4.469 -2.340 1.00 0.00 C ATOM 0 H VAL A 82 -14.504 6.157 -2.575 1.00 0.00 H new ATOM 0 HA VAL A 82 -14.296 5.263 0.112 1.00 0.00 H new ATOM 0 HB VAL A 82 -11.917 6.164 -1.527 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -10.948 4.100 -0.540 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -11.564 5.185 0.728 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -12.502 3.750 0.252 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -12.057 4.032 -2.773 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -13.613 3.674 -1.987 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -13.474 5.058 -3.097 1.00 0.00 H new ATOM 1308 N PHE A 83 -13.238 8.344 -0.427 1.00 0.00 N ATOM 1309 CA PHE A 83 -12.857 9.584 0.309 1.00 0.00 C ATOM 1310 C PHE A 83 -13.992 9.986 1.260 1.00 0.00 C ATOM 1311 O PHE A 83 -13.776 10.643 2.261 1.00 0.00 O ATOM 1312 CB PHE A 83 -12.618 10.707 -0.700 1.00 0.00 C ATOM 1313 CG PHE A 83 -11.163 10.747 -1.101 1.00 0.00 C ATOM 1314 CD1 PHE A 83 -10.200 11.130 -0.167 1.00 0.00 C ATOM 1315 CD2 PHE A 83 -10.780 10.430 -2.410 1.00 0.00 C ATOM 1316 CE1 PHE A 83 -8.853 11.193 -0.534 1.00 0.00 C ATOM 1317 CE2 PHE A 83 -9.431 10.497 -2.779 1.00 0.00 C ATOM 1318 CZ PHE A 83 -8.468 10.878 -1.840 1.00 0.00 C ATOM 0 H PHE A 83 -13.321 8.444 -1.439 1.00 0.00 H new ATOM 0 HA PHE A 83 -11.950 9.405 0.886 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -13.241 10.553 -1.581 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -12.910 11.664 -0.266 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -10.496 11.378 0.842 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -11.524 10.134 -3.134 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -8.109 11.485 0.192 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -9.135 10.254 -3.789 1.00 0.00 H new ATOM 0 HZ PHE A 83 -7.427 10.929 -2.124 1.00 0.00 H new ATOM 1328 N ALA A 84 -15.199 9.600 0.949 1.00 0.00 N ATOM 1329 CA ALA A 84 -16.352 9.961 1.817 1.00 0.00 C ATOM 1330 C ALA A 84 -16.378 9.069 3.065 1.00 0.00 C ATOM 1331 O ALA A 84 -16.890 9.459 4.099 1.00 0.00 O ATOM 1332 CB ALA A 84 -17.650 9.769 1.028 1.00 0.00 C ATOM 0 H ALA A 84 -15.436 9.047 0.126 1.00 0.00 H new ATOM 0 HA ALA A 84 -16.254 11.001 2.129 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -18.500 10.032 1.657 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -17.639 10.411 0.147 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -17.736 8.728 0.717 1.00 0.00 H new ATOM 1338 N TYR A 85 -15.832 7.880 2.996 1.00 0.00 N ATOM 1339 CA TYR A 85 -15.847 6.993 4.196 1.00 0.00 C ATOM 1340 C TYR A 85 -14.824 7.495 5.216 1.00 0.00 C ATOM 1341 O TYR A 85 -15.141 7.703 6.372 1.00 0.00 O ATOM 1342 CB TYR A 85 -15.497 5.562 3.781 1.00 0.00 C ATOM 1343 CG TYR A 85 -16.118 4.589 4.756 1.00 0.00 C ATOM 1344 CD1 TYR A 85 -17.511 4.504 4.871 1.00 0.00 C ATOM 1345 CD2 TYR A 85 -15.300 3.771 5.545 1.00 0.00 C ATOM 1346 CE1 TYR A 85 -18.085 3.603 5.776 1.00 0.00 C ATOM 1347 CE2 TYR A 85 -15.874 2.869 6.449 1.00 0.00 C ATOM 1348 CZ TYR A 85 -17.266 2.785 6.565 1.00 0.00 C ATOM 1349 OH TYR A 85 -17.832 1.897 7.458 1.00 0.00 O ATOM 0 H TYR A 85 -15.381 7.490 2.169 1.00 0.00 H new ATOM 0 HA TYR A 85 -16.841 7.007 4.643 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -15.861 5.365 2.773 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -14.415 5.432 3.760 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -18.143 5.133 4.262 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -14.226 3.836 5.456 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -19.159 3.539 5.866 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -15.242 2.238 7.057 1.00 0.00 H new ATOM 0 HH TYR A 85 -17.710 2.230 8.372 1.00 0.00 H new ATOM 1359 N ALA A 86 -13.602 7.699 4.798 1.00 0.00 N ATOM 1360 CA ALA A 86 -12.559 8.196 5.744 1.00 0.00 C ATOM 1361 C ALA A 86 -13.058 9.471 6.423 1.00 0.00 C ATOM 1362 O ALA A 86 -12.905 9.652 7.615 1.00 0.00 O ATOM 1363 CB ALA A 86 -11.275 8.504 4.975 1.00 0.00 C ATOM 0 H ALA A 86 -13.281 7.543 3.842 1.00 0.00 H new ATOM 0 HA ALA A 86 -12.358 7.433 6.496 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -10.515 8.867 5.667 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -10.918 7.598 4.486 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -11.475 9.267 4.223 1.00 0.00 H new ATOM 1369 N LYS A 87 -13.673 10.347 5.675 1.00 0.00 N ATOM 1370 CA LYS A 87 -14.200 11.601 6.279 1.00 0.00 C ATOM 1371 C LYS A 87 -15.286 11.246 7.297 1.00 0.00 C ATOM 1372 O LYS A 87 -15.534 11.979 8.234 1.00 0.00 O ATOM 1373 CB LYS A 87 -14.794 12.488 5.180 1.00 0.00 C ATOM 1374 CG LYS A 87 -13.924 13.735 5.000 1.00 0.00 C ATOM 1375 CD LYS A 87 -14.464 14.866 5.876 1.00 0.00 C ATOM 1376 CE LYS A 87 -13.315 15.791 6.283 1.00 0.00 C ATOM 1377 NZ LYS A 87 -13.711 16.578 7.486 1.00 0.00 N ATOM 0 H LYS A 87 -13.832 10.247 4.672 1.00 0.00 H new ATOM 0 HA LYS A 87 -13.393 12.139 6.776 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -14.851 11.934 4.243 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -15.812 12.777 5.442 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -12.892 13.513 5.270 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -13.921 14.041 3.954 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -15.223 15.429 5.334 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -14.945 14.455 6.763 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -12.421 15.205 6.497 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -13.067 16.463 5.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -12.930 17.207 7.762 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -14.553 17.148 7.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -13.927 15.929 8.270 1.00 0.00 H new ATOM 1391 N GLN A 88 -15.943 10.129 7.113 1.00 0.00 N ATOM 1392 CA GLN A 88 -17.019 9.733 8.065 1.00 0.00 C ATOM 1393 C GLN A 88 -16.430 8.964 9.258 1.00 0.00 C ATOM 1394 O GLN A 88 -16.934 9.054 10.360 1.00 0.00 O ATOM 1395 CB GLN A 88 -18.039 8.850 7.342 1.00 0.00 C ATOM 1396 CG GLN A 88 -19.251 9.694 6.930 1.00 0.00 C ATOM 1397 CD GLN A 88 -19.365 9.721 5.405 1.00 0.00 C ATOM 1398 OE1 GLN A 88 -19.778 8.754 4.798 1.00 0.00 O ATOM 1399 NE2 GLN A 88 -19.014 10.798 4.756 1.00 0.00 N ATOM 0 H GLN A 88 -15.780 9.477 6.346 1.00 0.00 H new ATOM 0 HA GLN A 88 -17.506 10.634 8.437 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -17.583 8.397 6.462 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -18.355 8.035 7.993 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -20.160 9.279 7.365 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -19.148 10.709 7.315 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -18.667 11.610 5.266 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -19.087 10.827 3.739 1.00 0.00 H new ATOM 1408 N HIS A 89 -15.384 8.198 9.059 1.00 0.00 N ATOM 1409 CA HIS A 89 -14.800 7.424 10.198 1.00 0.00 C ATOM 1410 C HIS A 89 -13.737 8.269 10.918 1.00 0.00 C ATOM 1411 O HIS A 89 -12.796 8.728 10.301 1.00 0.00 O ATOM 1412 CB HIS A 89 -14.145 6.150 9.657 1.00 0.00 C ATOM 1413 CG HIS A 89 -15.123 5.010 9.729 1.00 0.00 C ATOM 1414 ND1 HIS A 89 -15.016 4.004 10.676 1.00 0.00 N ATOM 1415 CD2 HIS A 89 -16.230 4.702 8.978 1.00 0.00 C ATOM 1416 CE1 HIS A 89 -16.033 3.146 10.473 1.00 0.00 C ATOM 1417 NE2 HIS A 89 -16.804 3.525 9.450 1.00 0.00 N ATOM 0 H HIS A 89 -14.912 8.076 8.163 1.00 0.00 H new ATOM 0 HA HIS A 89 -15.593 7.168 10.901 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -13.825 6.303 8.626 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -13.252 5.914 10.236 1.00 0.00 H new ATOM 0 HD1 HIS A 89 -14.297 3.928 11.396 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -16.600 5.284 8.147 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -16.205 2.259 11.065 1.00 0.00 H new ATOM 1425 N PRO A 90 -13.914 8.448 12.208 1.00 0.00 N ATOM 1426 CA PRO A 90 -13.003 9.238 13.108 1.00 0.00 C ATOM 1427 C PRO A 90 -11.713 8.459 13.388 1.00 0.00 C ATOM 1428 O PRO A 90 -10.624 8.959 13.187 1.00 0.00 O ATOM 1429 CB PRO A 90 -13.761 9.477 14.410 1.00 0.00 C ATOM 1430 CG PRO A 90 -15.018 8.635 14.373 1.00 0.00 C ATOM 1431 CD PRO A 90 -15.048 7.903 13.036 1.00 0.00 C ATOM 0 HA PRO A 90 -12.723 10.180 12.637 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -13.144 9.206 15.267 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -14.011 10.532 14.519 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -15.026 7.923 15.199 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -15.902 9.263 14.485 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -14.937 6.829 13.182 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -16.002 8.059 12.533 1.00 0.00 H new ATOM 1439 N ASP A 91 -11.822 7.244 13.860 1.00 0.00 N ATOM 1440 CA ASP A 91 -10.600 6.443 14.164 1.00 0.00 C ATOM 1441 C ASP A 91 -10.262 5.538 12.977 1.00 0.00 C ATOM 1442 O ASP A 91 -9.537 4.571 13.112 1.00 0.00 O ATOM 1443 CB ASP A 91 -10.852 5.582 15.406 1.00 0.00 C ATOM 1444 CG ASP A 91 -10.107 6.177 16.603 1.00 0.00 C ATOM 1445 OD1 ASP A 91 -10.392 7.311 16.948 1.00 0.00 O ATOM 1446 OD2 ASP A 91 -9.264 5.487 17.153 1.00 0.00 O ATOM 0 H ASP A 91 -12.706 6.772 14.048 1.00 0.00 H new ATOM 0 HA ASP A 91 -9.765 7.118 14.349 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -11.920 5.534 15.617 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -10.516 4.561 15.227 1.00 0.00 H new ATOM 1451 N GLN A 92 -10.768 5.848 11.814 1.00 0.00 N ATOM 1452 CA GLN A 92 -10.460 5.012 10.620 1.00 0.00 C ATOM 1453 C GLN A 92 -10.275 5.937 9.420 1.00 0.00 C ATOM 1454 O GLN A 92 -11.233 6.385 8.821 1.00 0.00 O ATOM 1455 CB GLN A 92 -11.622 4.047 10.356 1.00 0.00 C ATOM 1456 CG GLN A 92 -11.077 2.645 10.063 1.00 0.00 C ATOM 1457 CD GLN A 92 -11.748 1.629 10.991 1.00 0.00 C ATOM 1458 OE1 GLN A 92 -11.240 1.332 12.054 1.00 0.00 O ATOM 1459 NE2 GLN A 92 -12.876 1.080 10.632 1.00 0.00 N ATOM 0 H GLN A 92 -11.381 6.644 11.640 1.00 0.00 H new ATOM 0 HA GLN A 92 -9.552 4.433 10.789 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -12.285 4.016 11.221 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -12.215 4.400 9.513 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -11.264 2.381 9.022 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -9.997 2.626 10.207 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -13.303 1.329 9.740 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -13.331 0.402 11.244 1.00 0.00 H new ATOM 1468 N GLU A 93 -9.054 6.240 9.067 1.00 0.00 N ATOM 1469 CA GLU A 93 -8.817 7.151 7.915 1.00 0.00 C ATOM 1470 C GLU A 93 -8.694 6.335 6.623 1.00 0.00 C ATOM 1471 O GLU A 93 -9.163 5.216 6.539 1.00 0.00 O ATOM 1472 CB GLU A 93 -7.528 7.942 8.166 1.00 0.00 C ATOM 1473 CG GLU A 93 -7.786 9.015 9.228 1.00 0.00 C ATOM 1474 CD GLU A 93 -6.885 8.769 10.440 1.00 0.00 C ATOM 1475 OE1 GLU A 93 -5.677 8.793 10.270 1.00 0.00 O ATOM 1476 OE2 GLU A 93 -7.418 8.561 11.517 1.00 0.00 O ATOM 0 H GLU A 93 -8.212 5.895 9.528 1.00 0.00 H new ATOM 0 HA GLU A 93 -9.654 7.842 7.810 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -6.735 7.271 8.497 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -7.187 8.406 7.240 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -7.592 10.004 8.814 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -8.833 8.996 9.531 1.00 0.00 H new ATOM 1483 N LEU A 94 -8.070 6.891 5.618 1.00 0.00 N ATOM 1484 CA LEU A 94 -7.916 6.160 4.331 1.00 0.00 C ATOM 1485 C LEU A 94 -6.455 5.746 4.143 1.00 0.00 C ATOM 1486 O LEU A 94 -5.569 6.576 4.107 1.00 0.00 O ATOM 1487 CB LEU A 94 -8.338 7.078 3.182 1.00 0.00 C ATOM 1488 CG LEU A 94 -9.084 6.268 2.121 1.00 0.00 C ATOM 1489 CD1 LEU A 94 -10.555 6.143 2.518 1.00 0.00 C ATOM 1490 CD2 LEU A 94 -8.977 6.982 0.771 1.00 0.00 C ATOM 0 H LEU A 94 -7.659 7.825 5.636 1.00 0.00 H new ATOM 0 HA LEU A 94 -8.542 5.268 4.341 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -8.976 7.877 3.558 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -7.461 7.552 2.741 1.00 0.00 H new ATOM 0 HG LEU A 94 -8.644 5.274 2.043 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -11.088 5.566 1.762 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -10.630 5.638 3.481 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -10.997 7.136 2.594 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -9.508 6.407 0.012 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -9.419 7.975 0.849 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -7.928 7.073 0.489 1.00 0.00 H new ATOM 1502 N VAL A 95 -6.192 4.472 4.022 1.00 0.00 N ATOM 1503 CA VAL A 95 -4.786 4.017 3.823 1.00 0.00 C ATOM 1504 C VAL A 95 -4.697 3.292 2.482 1.00 0.00 C ATOM 1505 O VAL A 95 -5.463 2.390 2.204 1.00 0.00 O ATOM 1506 CB VAL A 95 -4.374 3.067 4.951 1.00 0.00 C ATOM 1507 CG1 VAL A 95 -2.906 2.668 4.778 1.00 0.00 C ATOM 1508 CG2 VAL A 95 -4.554 3.775 6.295 1.00 0.00 C ATOM 0 H VAL A 95 -6.889 3.728 4.052 1.00 0.00 H new ATOM 0 HA VAL A 95 -4.116 4.877 3.832 1.00 0.00 H new ATOM 0 HB VAL A 95 -4.996 2.172 4.920 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -2.616 1.992 5.582 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -2.776 2.168 3.818 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -2.280 3.560 4.810 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -4.262 3.103 7.102 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -3.929 4.668 6.322 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -5.599 4.059 6.419 1.00 0.00 H new ATOM 1518 N ILE A 96 -3.791 3.696 1.636 1.00 0.00 N ATOM 1519 CA ILE A 96 -3.673 3.041 0.304 1.00 0.00 C ATOM 1520 C ILE A 96 -2.779 1.804 0.407 1.00 0.00 C ATOM 1521 O ILE A 96 -1.799 1.782 1.133 1.00 0.00 O ATOM 1522 CB ILE A 96 -3.071 4.021 -0.708 1.00 0.00 C ATOM 1523 CG1 ILE A 96 -3.735 5.398 -0.564 1.00 0.00 C ATOM 1524 CG2 ILE A 96 -3.298 3.486 -2.124 1.00 0.00 C ATOM 1525 CD1 ILE A 96 -5.222 5.299 -0.897 1.00 0.00 C ATOM 0 H ILE A 96 -3.128 4.451 1.809 1.00 0.00 H new ATOM 0 HA ILE A 96 -4.667 2.741 -0.029 1.00 0.00 H new ATOM 0 HB ILE A 96 -2.002 4.122 -0.521 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -3.606 5.769 0.453 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -3.252 6.115 -1.228 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -2.871 4.180 -2.848 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -2.817 2.513 -2.227 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.368 3.383 -2.307 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -5.684 6.280 -0.792 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -5.343 4.949 -1.922 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -5.702 4.597 -0.215 1.00 0.00 H new ATOM 1537 N ALA A 97 -3.091 0.792 -0.358 1.00 0.00 N ATOM 1538 CA ALA A 97 -2.266 -0.446 -0.358 1.00 0.00 C ATOM 1539 C ALA A 97 -1.891 -0.793 -1.805 1.00 0.00 C ATOM 1540 O ALA A 97 -1.147 -1.720 -2.059 1.00 0.00 O ATOM 1541 CB ALA A 97 -3.068 -1.594 0.257 1.00 0.00 C ATOM 0 H ALA A 97 -3.892 0.773 -0.989 1.00 0.00 H new ATOM 0 HA ALA A 97 -1.361 -0.289 0.229 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -2.464 -2.501 0.257 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -3.341 -1.340 1.281 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -3.972 -1.761 -0.328 1.00 0.00 H new ATOM 1547 N GLY A 98 -2.375 -0.028 -2.755 1.00 0.00 N ATOM 1548 CA GLY A 98 -2.022 -0.283 -4.183 1.00 0.00 C ATOM 1549 C GLY A 98 -3.100 -1.137 -4.865 1.00 0.00 C ATOM 1550 O GLY A 98 -4.238 -1.153 -4.449 1.00 0.00 O ATOM 0 H GLY A 98 -3.000 0.763 -2.600 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -1.914 0.665 -4.711 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -1.059 -0.791 -4.240 1.00 0.00 H new ATOM 1554 N GLY A 99 -2.758 -1.838 -5.926 1.00 0.00 N ATOM 1555 CA GLY A 99 -1.356 -1.825 -6.447 1.00 0.00 C ATOM 1556 C GLY A 99 -1.016 -0.480 -7.105 1.00 0.00 C ATOM 1557 O GLY A 99 -1.377 0.576 -6.628 1.00 0.00 O ATOM 0 H GLY A 99 -3.402 -2.424 -6.456 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -0.661 -2.018 -5.630 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -1.228 -2.629 -7.172 1.00 0.00 H new ATOM 1561 N ALA A 100 -0.314 -0.522 -8.206 1.00 0.00 N ATOM 1562 CA ALA A 100 0.080 0.739 -8.900 1.00 0.00 C ATOM 1563 C ALA A 100 -1.162 1.512 -9.343 1.00 0.00 C ATOM 1564 O ALA A 100 -1.220 2.721 -9.230 1.00 0.00 O ATOM 1565 CB ALA A 100 0.927 0.395 -10.128 1.00 0.00 C ATOM 0 H ALA A 100 0.005 -1.380 -8.657 1.00 0.00 H new ATOM 0 HA ALA A 100 0.655 1.358 -8.211 1.00 0.00 H new ATOM 0 HB1 ALA A 100 1.217 1.313 -10.639 1.00 0.00 H new ATOM 0 HB2 ALA A 100 1.821 -0.144 -9.814 1.00 0.00 H new ATOM 0 HB3 ALA A 100 0.347 -0.230 -10.807 1.00 0.00 H new ATOM 1571 N GLN A 101 -2.143 0.834 -9.868 1.00 0.00 N ATOM 1572 CA GLN A 101 -3.367 1.541 -10.341 1.00 0.00 C ATOM 1573 C GLN A 101 -3.969 2.374 -9.203 1.00 0.00 C ATOM 1574 O GLN A 101 -4.470 3.462 -9.428 1.00 0.00 O ATOM 1575 CB GLN A 101 -4.397 0.513 -10.821 1.00 0.00 C ATOM 1576 CG GLN A 101 -4.413 0.477 -12.351 1.00 0.00 C ATOM 1577 CD GLN A 101 -5.564 1.339 -12.873 1.00 0.00 C ATOM 1578 OE1 GLN A 101 -5.478 2.551 -12.876 1.00 0.00 O ATOM 1579 NE2 GLN A 101 -6.646 0.761 -13.320 1.00 0.00 N ATOM 0 H GLN A 101 -2.151 -0.179 -9.990 1.00 0.00 H new ATOM 0 HA GLN A 101 -3.099 2.204 -11.163 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -4.152 -0.473 -10.427 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -5.386 0.771 -10.443 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -3.464 0.843 -12.743 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -4.527 -0.549 -12.699 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -6.719 -0.256 -13.318 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -7.418 1.327 -13.671 1.00 0.00 H new ATOM 1588 N ILE A 102 -3.950 1.882 -7.990 1.00 0.00 N ATOM 1589 CA ILE A 102 -4.554 2.662 -6.872 1.00 0.00 C ATOM 1590 C ILE A 102 -3.614 3.786 -6.431 1.00 0.00 C ATOM 1591 O ILE A 102 -4.054 4.782 -5.891 1.00 0.00 O ATOM 1592 CB ILE A 102 -4.829 1.729 -5.689 1.00 0.00 C ATOM 1593 CG1 ILE A 102 -5.687 0.545 -6.155 1.00 0.00 C ATOM 1594 CG2 ILE A 102 -5.572 2.495 -4.591 1.00 0.00 C ATOM 1595 CD1 ILE A 102 -6.983 1.059 -6.788 1.00 0.00 C ATOM 0 H ILE A 102 -3.546 0.983 -7.729 1.00 0.00 H new ATOM 0 HA ILE A 102 -5.488 3.104 -7.218 1.00 0.00 H new ATOM 0 HB ILE A 102 -3.882 1.359 -5.296 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -5.133 -0.056 -6.876 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -5.917 -0.104 -5.310 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -5.766 1.829 -3.750 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -4.962 3.334 -4.256 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -6.518 2.869 -4.984 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -7.588 0.214 -7.117 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -7.541 1.640 -6.054 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -6.744 1.689 -7.645 1.00 0.00 H new ATOM 1607 N PHE A 103 -2.332 3.656 -6.648 1.00 0.00 N ATOM 1608 CA PHE A 103 -1.404 4.746 -6.228 1.00 0.00 C ATOM 1609 C PHE A 103 -1.532 5.923 -7.199 1.00 0.00 C ATOM 1610 O PHE A 103 -1.189 7.044 -6.878 1.00 0.00 O ATOM 1611 CB PHE A 103 0.045 4.235 -6.256 1.00 0.00 C ATOM 1612 CG PHE A 103 0.249 3.158 -5.212 1.00 0.00 C ATOM 1613 CD1 PHE A 103 -0.330 3.282 -3.944 1.00 0.00 C ATOM 1614 CD2 PHE A 103 1.026 2.034 -5.516 1.00 0.00 C ATOM 1615 CE1 PHE A 103 -0.135 2.282 -2.983 1.00 0.00 C ATOM 1616 CE2 PHE A 103 1.222 1.035 -4.555 1.00 0.00 C ATOM 1617 CZ PHE A 103 0.641 1.159 -3.288 1.00 0.00 C ATOM 0 H PHE A 103 -1.891 2.851 -7.093 1.00 0.00 H new ATOM 0 HA PHE A 103 -1.661 5.065 -5.218 1.00 0.00 H new ATOM 0 HB2 PHE A 103 0.278 3.840 -7.245 1.00 0.00 H new ATOM 0 HB3 PHE A 103 0.732 5.062 -6.073 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -0.928 4.150 -3.706 1.00 0.00 H new ATOM 0 HD2 PHE A 103 1.475 1.937 -6.493 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -0.584 2.378 -2.006 1.00 0.00 H new ATOM 0 HE2 PHE A 103 1.822 0.169 -4.792 1.00 0.00 H new ATOM 0 HZ PHE A 103 0.792 0.388 -2.546 1.00 0.00 H new ATOM 1627 N THR A 104 -2.014 5.675 -8.389 1.00 0.00 N ATOM 1628 CA THR A 104 -2.150 6.774 -9.387 1.00 0.00 C ATOM 1629 C THR A 104 -3.421 7.583 -9.115 1.00 0.00 C ATOM 1630 O THR A 104 -3.382 8.790 -9.006 1.00 0.00 O ATOM 1631 CB THR A 104 -2.220 6.174 -10.793 1.00 0.00 C ATOM 1632 OG1 THR A 104 -1.307 5.089 -10.888 1.00 0.00 O ATOM 1633 CG2 THR A 104 -1.855 7.242 -11.825 1.00 0.00 C ATOM 0 H THR A 104 -2.319 4.757 -8.712 1.00 0.00 H new ATOM 0 HA THR A 104 -1.287 7.435 -9.308 1.00 0.00 H new ATOM 0 HB THR A 104 -3.232 5.817 -10.986 1.00 0.00 H new ATOM 0 HG1 THR A 104 -1.351 4.702 -11.787 1.00 0.00 H new ATOM 0 HG21 THR A 104 -1.905 6.813 -12.826 1.00 0.00 H new ATOM 0 HG22 THR A 104 -2.555 8.074 -11.751 1.00 0.00 H new ATOM 0 HG23 THR A 104 -0.844 7.601 -11.635 1.00 0.00 H new ATOM 1641 N ALA A 105 -4.550 6.936 -9.019 1.00 0.00 N ATOM 1642 CA ALA A 105 -5.814 7.692 -8.771 1.00 0.00 C ATOM 1643 C ALA A 105 -5.729 8.442 -7.436 1.00 0.00 C ATOM 1644 O ALA A 105 -6.387 9.445 -7.238 1.00 0.00 O ATOM 1645 CB ALA A 105 -6.995 6.718 -8.729 1.00 0.00 C ATOM 0 H ALA A 105 -4.654 5.925 -9.101 1.00 0.00 H new ATOM 0 HA ALA A 105 -5.958 8.411 -9.577 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -7.917 7.271 -8.548 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -7.068 6.193 -9.682 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -6.842 5.995 -7.927 1.00 0.00 H new ATOM 1651 N PHE A 106 -4.949 7.951 -6.510 1.00 0.00 N ATOM 1652 CA PHE A 106 -4.852 8.625 -5.179 1.00 0.00 C ATOM 1653 C PHE A 106 -3.582 9.487 -5.083 1.00 0.00 C ATOM 1654 O PHE A 106 -3.363 10.158 -4.092 1.00 0.00 O ATOM 1655 CB PHE A 106 -4.807 7.557 -4.085 1.00 0.00 C ATOM 1656 CG PHE A 106 -6.190 6.993 -3.859 1.00 0.00 C ATOM 1657 CD1 PHE A 106 -6.662 5.948 -4.660 1.00 0.00 C ATOM 1658 CD2 PHE A 106 -6.994 7.507 -2.838 1.00 0.00 C ATOM 1659 CE1 PHE A 106 -7.938 5.420 -4.441 1.00 0.00 C ATOM 1660 CE2 PHE A 106 -8.268 6.977 -2.617 1.00 0.00 C ATOM 1661 CZ PHE A 106 -8.740 5.934 -3.419 1.00 0.00 C ATOM 0 H PHE A 106 -4.375 7.114 -6.616 1.00 0.00 H new ATOM 0 HA PHE A 106 -5.721 9.272 -5.055 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -4.122 6.759 -4.372 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -4.425 7.988 -3.160 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -6.041 5.549 -5.448 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -6.631 8.314 -2.219 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -8.303 4.615 -5.062 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -8.888 7.373 -1.826 1.00 0.00 H new ATOM 0 HZ PHE A 106 -9.725 5.525 -3.249 1.00 0.00 H new ATOM 1671 N LYS A 107 -2.729 9.461 -6.074 1.00 0.00 N ATOM 1672 CA LYS A 107 -1.473 10.269 -5.989 1.00 0.00 C ATOM 1673 C LYS A 107 -1.791 11.759 -5.776 1.00 0.00 C ATOM 1674 O LYS A 107 -1.085 12.447 -5.069 1.00 0.00 O ATOM 1675 CB LYS A 107 -0.630 10.082 -7.265 1.00 0.00 C ATOM 1676 CG LYS A 107 -1.220 10.870 -8.440 1.00 0.00 C ATOM 1677 CD LYS A 107 -0.142 11.075 -9.505 1.00 0.00 C ATOM 1678 CE LYS A 107 -0.600 12.153 -10.489 1.00 0.00 C ATOM 1679 NZ LYS A 107 0.546 12.555 -11.353 1.00 0.00 N ATOM 0 H LYS A 107 -2.845 8.921 -6.932 1.00 0.00 H new ATOM 0 HA LYS A 107 -0.900 9.916 -5.132 1.00 0.00 H new ATOM 0 HB2 LYS A 107 0.392 10.411 -7.080 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -0.583 9.024 -7.521 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -2.068 10.332 -8.864 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -1.594 11.834 -8.095 1.00 0.00 H new ATOM 0 HD2 LYS A 107 0.797 11.370 -9.036 1.00 0.00 H new ATOM 0 HD3 LYS A 107 0.045 10.140 -10.033 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -1.418 11.776 -11.103 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -0.981 13.018 -9.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 0.236 13.288 -12.022 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 1.313 12.930 -10.760 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 0.890 11.727 -11.881 1.00 0.00 H new ATOM 1693 N ASP A 108 -2.832 12.270 -6.380 1.00 0.00 N ATOM 1694 CA ASP A 108 -3.159 13.718 -6.207 1.00 0.00 C ATOM 1695 C ASP A 108 -3.554 14.010 -4.756 1.00 0.00 C ATOM 1696 O ASP A 108 -3.250 15.058 -4.220 1.00 0.00 O ATOM 1697 CB ASP A 108 -4.326 14.078 -7.129 1.00 0.00 C ATOM 1698 CG ASP A 108 -4.167 15.516 -7.623 1.00 0.00 C ATOM 1699 OD1 ASP A 108 -3.146 15.805 -8.226 1.00 0.00 O ATOM 1700 OD2 ASP A 108 -5.069 16.304 -7.393 1.00 0.00 O ATOM 0 H ASP A 108 -3.469 11.750 -6.984 1.00 0.00 H new ATOM 0 HA ASP A 108 -2.281 14.313 -6.458 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -4.357 13.393 -7.977 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -5.270 13.969 -6.596 1.00 0.00 H new ATOM 1705 N ASP A 109 -4.247 13.103 -4.127 1.00 0.00 N ATOM 1706 CA ASP A 109 -4.687 13.328 -2.719 1.00 0.00 C ATOM 1707 C ASP A 109 -3.897 12.420 -1.774 1.00 0.00 C ATOM 1708 O ASP A 109 -4.330 11.330 -1.454 1.00 0.00 O ATOM 1709 CB ASP A 109 -6.177 13.003 -2.603 1.00 0.00 C ATOM 1710 CG ASP A 109 -7.000 14.247 -2.942 1.00 0.00 C ATOM 1711 OD1 ASP A 109 -7.129 14.545 -4.117 1.00 0.00 O ATOM 1712 OD2 ASP A 109 -7.489 14.879 -2.020 1.00 0.00 O ATOM 0 H ASP A 109 -4.530 12.209 -4.529 1.00 0.00 H new ATOM 0 HA ASP A 109 -4.510 14.368 -2.447 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -6.436 12.188 -3.279 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -6.409 12.665 -1.593 1.00 0.00 H new ATOM 1717 N VAL A 110 -2.747 12.851 -1.318 1.00 0.00 N ATOM 1718 CA VAL A 110 -1.952 11.996 -0.387 1.00 0.00 C ATOM 1719 C VAL A 110 -1.711 12.747 0.927 1.00 0.00 C ATOM 1720 O VAL A 110 -1.416 13.926 0.937 1.00 0.00 O ATOM 1721 CB VAL A 110 -0.601 11.658 -1.018 1.00 0.00 C ATOM 1722 CG1 VAL A 110 0.076 10.559 -0.200 1.00 0.00 C ATOM 1723 CG2 VAL A 110 -0.806 11.174 -2.455 1.00 0.00 C ATOM 0 H VAL A 110 -2.328 13.752 -1.549 1.00 0.00 H new ATOM 0 HA VAL A 110 -2.507 11.078 -0.192 1.00 0.00 H new ATOM 0 HB VAL A 110 0.027 12.549 -1.028 1.00 0.00 H new ATOM 0 HG11 VAL A 110 1.040 10.315 -0.646 1.00 0.00 H new ATOM 0 HG12 VAL A 110 0.227 10.907 0.822 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -0.555 9.671 -0.191 1.00 0.00 H new ATOM 0 HG21 VAL A 110 0.160 10.935 -2.900 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.435 10.284 -2.453 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -1.289 11.958 -3.038 1.00 0.00 H new ATOM 1733 N ASP A 111 -1.843 12.068 2.036 1.00 0.00 N ATOM 1734 CA ASP A 111 -1.627 12.733 3.354 1.00 0.00 C ATOM 1735 C ASP A 111 -0.382 12.152 4.033 1.00 0.00 C ATOM 1736 O ASP A 111 0.326 12.843 4.740 1.00 0.00 O ATOM 1737 CB ASP A 111 -2.849 12.509 4.249 1.00 0.00 C ATOM 1738 CG ASP A 111 -3.776 13.723 4.163 1.00 0.00 C ATOM 1739 OD1 ASP A 111 -3.444 14.740 4.750 1.00 0.00 O ATOM 1740 OD2 ASP A 111 -4.802 13.616 3.512 1.00 0.00 O ATOM 0 H ASP A 111 -2.091 11.080 2.086 1.00 0.00 H new ATOM 0 HA ASP A 111 -1.483 13.802 3.195 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -3.381 11.610 3.938 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -2.533 12.352 5.280 1.00 0.00 H new ATOM 1745 N THR A 112 -0.113 10.888 3.835 1.00 0.00 N ATOM 1746 CA THR A 112 1.084 10.271 4.481 1.00 0.00 C ATOM 1747 C THR A 112 1.666 9.179 3.580 1.00 0.00 C ATOM 1748 O THR A 112 0.955 8.345 3.057 1.00 0.00 O ATOM 1749 CB THR A 112 0.677 9.655 5.822 1.00 0.00 C ATOM 1750 OG1 THR A 112 0.003 10.630 6.604 1.00 0.00 O ATOM 1751 CG2 THR A 112 1.925 9.174 6.565 1.00 0.00 C ATOM 0 H THR A 112 -0.668 10.258 3.256 1.00 0.00 H new ATOM 0 HA THR A 112 1.838 11.042 4.640 1.00 0.00 H new ATOM 0 HB THR A 112 0.014 8.808 5.647 1.00 0.00 H new ATOM 0 HG1 THR A 112 -0.260 10.237 7.462 1.00 0.00 H new ATOM 0 HG21 THR A 112 1.634 8.736 7.520 1.00 0.00 H new ATOM 0 HG22 THR A 112 2.440 8.425 5.964 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.591 10.018 6.742 1.00 0.00 H new ATOM 1759 N LEU A 113 2.960 9.182 3.395 1.00 0.00 N ATOM 1760 CA LEU A 113 3.593 8.145 2.529 1.00 0.00 C ATOM 1761 C LEU A 113 4.415 7.184 3.391 1.00 0.00 C ATOM 1762 O LEU A 113 5.224 7.595 4.200 1.00 0.00 O ATOM 1763 CB LEU A 113 4.508 8.818 1.505 1.00 0.00 C ATOM 1764 CG LEU A 113 3.679 9.730 0.601 1.00 0.00 C ATOM 1765 CD1 LEU A 113 4.584 10.792 -0.025 1.00 0.00 C ATOM 1766 CD2 LEU A 113 3.031 8.893 -0.503 1.00 0.00 C ATOM 0 H LEU A 113 3.605 9.857 3.806 1.00 0.00 H new ATOM 0 HA LEU A 113 2.813 7.589 2.009 1.00 0.00 H new ATOM 0 HB2 LEU A 113 5.278 9.397 2.015 1.00 0.00 H new ATOM 0 HB3 LEU A 113 5.019 8.063 0.907 1.00 0.00 H new ATOM 0 HG LEU A 113 2.904 10.220 1.190 1.00 0.00 H new ATOM 0 HD11 LEU A 113 3.991 11.441 -0.669 1.00 0.00 H new ATOM 0 HD12 LEU A 113 5.046 11.387 0.763 1.00 0.00 H new ATOM 0 HD13 LEU A 113 5.361 10.306 -0.616 1.00 0.00 H new ATOM 0 HD21 LEU A 113 2.439 9.540 -1.150 1.00 0.00 H new ATOM 0 HD22 LEU A 113 3.807 8.404 -1.092 1.00 0.00 H new ATOM 0 HD23 LEU A 113 2.385 8.138 -0.055 1.00 0.00 H new ATOM 1778 N LEU A 114 4.220 5.905 3.211 1.00 0.00 N ATOM 1779 CA LEU A 114 4.992 4.904 4.002 1.00 0.00 C ATOM 1780 C LEU A 114 5.677 3.947 3.024 1.00 0.00 C ATOM 1781 O LEU A 114 5.053 3.075 2.451 1.00 0.00 O ATOM 1782 CB LEU A 114 4.040 4.131 4.917 1.00 0.00 C ATOM 1783 CG LEU A 114 3.251 5.121 5.779 1.00 0.00 C ATOM 1784 CD1 LEU A 114 1.872 4.540 6.103 1.00 0.00 C ATOM 1785 CD2 LEU A 114 4.015 5.383 7.079 1.00 0.00 C ATOM 0 H LEU A 114 3.555 5.509 2.546 1.00 0.00 H new ATOM 0 HA LEU A 114 5.740 5.401 4.620 1.00 0.00 H new ATOM 0 HB2 LEU A 114 3.357 3.525 4.322 1.00 0.00 H new ATOM 0 HB3 LEU A 114 4.603 3.447 5.552 1.00 0.00 H new ATOM 0 HG LEU A 114 3.127 6.057 5.234 1.00 0.00 H new ATOM 0 HD11 LEU A 114 1.314 5.248 6.716 1.00 0.00 H new ATOM 0 HD12 LEU A 114 1.328 4.355 5.177 1.00 0.00 H new ATOM 0 HD13 LEU A 114 1.991 3.603 6.647 1.00 0.00 H new ATOM 0 HD21 LEU A 114 3.455 6.087 7.694 1.00 0.00 H new ATOM 0 HD22 LEU A 114 4.140 4.446 7.622 1.00 0.00 H new ATOM 0 HD23 LEU A 114 4.994 5.802 6.847 1.00 0.00 H new ATOM 1797 N VAL A 115 6.947 4.140 2.799 1.00 0.00 N ATOM 1798 CA VAL A 115 7.660 3.268 1.813 1.00 0.00 C ATOM 1799 C VAL A 115 8.803 2.489 2.467 1.00 0.00 C ATOM 1800 O VAL A 115 9.511 2.985 3.321 1.00 0.00 O ATOM 1801 CB VAL A 115 8.209 4.132 0.671 1.00 0.00 C ATOM 1802 CG1 VAL A 115 9.232 5.130 1.213 1.00 0.00 C ATOM 1803 CG2 VAL A 115 8.880 3.234 -0.372 1.00 0.00 C ATOM 0 H VAL A 115 7.520 4.855 3.248 1.00 0.00 H new ATOM 0 HA VAL A 115 6.944 2.543 1.424 1.00 0.00 H new ATOM 0 HB VAL A 115 7.385 4.678 0.212 1.00 0.00 H new ATOM 0 HG11 VAL A 115 9.616 5.739 0.394 1.00 0.00 H new ATOM 0 HG12 VAL A 115 8.756 5.774 1.952 1.00 0.00 H new ATOM 0 HG13 VAL A 115 10.055 4.590 1.680 1.00 0.00 H new ATOM 0 HG21 VAL A 115 9.270 3.848 -1.184 1.00 0.00 H new ATOM 0 HG22 VAL A 115 9.698 2.685 0.093 1.00 0.00 H new ATOM 0 HG23 VAL A 115 8.150 2.529 -0.769 1.00 0.00 H new ATOM 1813 N THR A 116 8.990 1.266 2.037 1.00 0.00 N ATOM 1814 CA THR A 116 10.090 0.424 2.587 1.00 0.00 C ATOM 1815 C THR A 116 11.172 0.273 1.515 1.00 0.00 C ATOM 1816 O THR A 116 10.928 -0.259 0.449 1.00 0.00 O ATOM 1817 CB THR A 116 9.556 -0.966 2.951 1.00 0.00 C ATOM 1818 OG1 THR A 116 8.227 -0.861 3.444 1.00 0.00 O ATOM 1819 CG2 THR A 116 10.451 -1.591 4.022 1.00 0.00 C ATOM 0 H THR A 116 8.421 0.813 1.322 1.00 0.00 H new ATOM 0 HA THR A 116 10.498 0.897 3.480 1.00 0.00 H new ATOM 0 HB THR A 116 9.558 -1.595 2.061 1.00 0.00 H new ATOM 0 HG1 THR A 116 7.892 -1.753 3.673 1.00 0.00 H new ATOM 0 HG21 THR A 116 10.072 -2.579 4.281 1.00 0.00 H new ATOM 0 HG22 THR A 116 11.468 -1.681 3.639 1.00 0.00 H new ATOM 0 HG23 THR A 116 10.452 -0.958 4.910 1.00 0.00 H new ATOM 1827 N ARG A 117 12.362 0.739 1.781 1.00 0.00 N ATOM 1828 CA ARG A 117 13.450 0.622 0.769 1.00 0.00 C ATOM 1829 C ARG A 117 14.286 -0.629 1.060 1.00 0.00 C ATOM 1830 O ARG A 117 14.975 -0.705 2.059 1.00 0.00 O ATOM 1831 CB ARG A 117 14.342 1.866 0.838 1.00 0.00 C ATOM 1832 CG ARG A 117 14.051 2.780 -0.358 1.00 0.00 C ATOM 1833 CD ARG A 117 15.136 3.857 -0.455 1.00 0.00 C ATOM 1834 NE ARG A 117 14.497 5.200 -0.598 1.00 0.00 N ATOM 1835 CZ ARG A 117 14.143 5.658 -1.776 1.00 0.00 C ATOM 1836 NH1 ARG A 117 14.326 4.945 -2.859 1.00 0.00 N ATOM 1837 NH2 ARG A 117 13.598 6.840 -1.870 1.00 0.00 N ATOM 0 H ARG A 117 12.627 1.195 2.654 1.00 0.00 H new ATOM 0 HA ARG A 117 13.016 0.541 -0.228 1.00 0.00 H new ATOM 0 HB2 ARG A 117 14.162 2.402 1.770 1.00 0.00 H new ATOM 0 HB3 ARG A 117 15.392 1.573 0.836 1.00 0.00 H new ATOM 0 HG2 ARG A 117 14.021 2.195 -1.277 1.00 0.00 H new ATOM 0 HG3 ARG A 117 13.072 3.245 -0.244 1.00 0.00 H new ATOM 0 HD2 ARG A 117 15.765 3.835 0.435 1.00 0.00 H new ATOM 0 HD3 ARG A 117 15.784 3.659 -1.308 1.00 0.00 H new ATOM 0 HE ARG A 117 14.333 5.769 0.232 1.00 0.00 H new ATOM 0 HH11 ARG A 117 14.749 4.019 -2.795 1.00 0.00 H new ATOM 0 HH12 ARG A 117 14.045 5.315 -3.767 1.00 0.00 H new ATOM 0 HH21 ARG A 117 13.450 7.401 -1.031 1.00 0.00 H new ATOM 0 HH22 ARG A 117 13.320 7.203 -2.782 1.00 0.00 H new ATOM 1851 N LEU A 118 14.231 -1.609 0.195 1.00 0.00 N ATOM 1852 CA LEU A 118 15.024 -2.853 0.424 1.00 0.00 C ATOM 1853 C LEU A 118 16.459 -2.629 -0.059 1.00 0.00 C ATOM 1854 O LEU A 118 16.715 -1.794 -0.906 1.00 0.00 O ATOM 1855 CB LEU A 118 14.397 -4.020 -0.348 1.00 0.00 C ATOM 1856 CG LEU A 118 13.124 -4.487 0.364 1.00 0.00 C ATOM 1857 CD1 LEU A 118 11.984 -3.511 0.064 1.00 0.00 C ATOM 1858 CD2 LEU A 118 12.741 -5.888 -0.130 1.00 0.00 C ATOM 0 H LEU A 118 13.672 -1.601 -0.658 1.00 0.00 H new ATOM 0 HA LEU A 118 15.027 -3.092 1.487 1.00 0.00 H new ATOM 0 HB2 LEU A 118 14.163 -3.710 -1.366 1.00 0.00 H new ATOM 0 HB3 LEU A 118 15.107 -4.844 -0.421 1.00 0.00 H new ATOM 0 HG LEU A 118 13.303 -4.519 1.439 1.00 0.00 H new ATOM 0 HD11 LEU A 118 11.078 -3.843 0.571 1.00 0.00 H new ATOM 0 HD12 LEU A 118 12.254 -2.516 0.418 1.00 0.00 H new ATOM 0 HD13 LEU A 118 11.807 -3.478 -1.011 1.00 0.00 H new ATOM 0 HD21 LEU A 118 11.835 -6.218 0.378 1.00 0.00 H new ATOM 0 HD22 LEU A 118 12.564 -5.859 -1.205 1.00 0.00 H new ATOM 0 HD23 LEU A 118 13.552 -6.584 0.085 1.00 0.00 H new ATOM 1870 N ALA A 119 17.398 -3.362 0.477 1.00 0.00 N ATOM 1871 CA ALA A 119 18.818 -3.185 0.057 1.00 0.00 C ATOM 1872 C ALA A 119 19.086 -3.974 -1.225 1.00 0.00 C ATOM 1873 O ALA A 119 19.916 -3.598 -2.030 1.00 0.00 O ATOM 1874 CB ALA A 119 19.744 -3.685 1.167 1.00 0.00 C ATOM 0 H ALA A 119 17.243 -4.076 1.188 1.00 0.00 H new ATOM 0 HA ALA A 119 19.007 -2.128 -0.129 1.00 0.00 H new ATOM 0 HB1 ALA A 119 20.782 -3.556 0.861 1.00 0.00 H new ATOM 0 HB2 ALA A 119 19.561 -3.115 2.078 1.00 0.00 H new ATOM 0 HB3 ALA A 119 19.550 -4.741 1.355 1.00 0.00 H new ATOM 1880 N GLY A 120 18.396 -5.064 -1.425 1.00 0.00 N ATOM 1881 CA GLY A 120 18.622 -5.870 -2.659 1.00 0.00 C ATOM 1882 C GLY A 120 17.941 -5.191 -3.849 1.00 0.00 C ATOM 1883 O GLY A 120 17.177 -4.256 -3.692 1.00 0.00 O ATOM 0 H GLY A 120 17.687 -5.431 -0.789 1.00 0.00 H new ATOM 0 HA2 GLY A 120 19.691 -5.971 -2.848 1.00 0.00 H new ATOM 0 HA3 GLY A 120 18.225 -6.876 -2.526 1.00 0.00 H new ATOM 1887 N SER A 121 18.215 -5.653 -5.039 1.00 0.00 N ATOM 1888 CA SER A 121 17.588 -5.040 -6.243 1.00 0.00 C ATOM 1889 C SER A 121 16.840 -6.119 -7.029 1.00 0.00 C ATOM 1890 O SER A 121 17.431 -7.056 -7.529 1.00 0.00 O ATOM 1891 CB SER A 121 18.675 -4.428 -7.128 1.00 0.00 C ATOM 1892 OG SER A 121 19.576 -5.449 -7.537 1.00 0.00 O ATOM 0 H SER A 121 18.848 -6.430 -5.229 1.00 0.00 H new ATOM 0 HA SER A 121 16.890 -4.262 -5.935 1.00 0.00 H new ATOM 0 HB2 SER A 121 18.226 -3.953 -8.000 1.00 0.00 H new ATOM 0 HB3 SER A 121 19.211 -3.651 -6.582 1.00 0.00 H new ATOM 0 HG SER A 121 19.078 -6.275 -7.709 1.00 0.00 H new ATOM 1898 N PHE A 122 15.544 -5.997 -7.138 1.00 0.00 N ATOM 1899 CA PHE A 122 14.754 -7.016 -7.887 1.00 0.00 C ATOM 1900 C PHE A 122 14.225 -6.393 -9.180 1.00 0.00 C ATOM 1901 O PHE A 122 14.178 -5.186 -9.322 1.00 0.00 O ATOM 1902 CB PHE A 122 13.580 -7.487 -7.024 1.00 0.00 C ATOM 1903 CG PHE A 122 14.086 -7.881 -5.656 1.00 0.00 C ATOM 1904 CD1 PHE A 122 14.246 -6.907 -4.663 1.00 0.00 C ATOM 1905 CD2 PHE A 122 14.397 -9.218 -5.381 1.00 0.00 C ATOM 1906 CE1 PHE A 122 14.717 -7.269 -3.395 1.00 0.00 C ATOM 1907 CE2 PHE A 122 14.867 -9.581 -4.113 1.00 0.00 C ATOM 1908 CZ PHE A 122 15.027 -8.606 -3.120 1.00 0.00 C ATOM 0 H PHE A 122 14.997 -5.234 -6.739 1.00 0.00 H new ATOM 0 HA PHE A 122 15.389 -7.869 -8.127 1.00 0.00 H new ATOM 0 HB2 PHE A 122 12.839 -6.693 -6.934 1.00 0.00 H new ATOM 0 HB3 PHE A 122 13.084 -8.334 -7.498 1.00 0.00 H new ATOM 0 HD1 PHE A 122 14.006 -5.876 -4.875 1.00 0.00 H new ATOM 0 HD2 PHE A 122 14.274 -9.969 -6.147 1.00 0.00 H new ATOM 0 HE1 PHE A 122 14.841 -6.517 -2.630 1.00 0.00 H new ATOM 0 HE2 PHE A 122 15.106 -10.613 -3.901 1.00 0.00 H new ATOM 0 HZ PHE A 122 15.390 -8.886 -2.142 1.00 0.00 H new ATOM 1918 N GLU A 123 13.824 -7.203 -10.123 1.00 0.00 N ATOM 1919 CA GLU A 123 13.298 -6.652 -11.406 1.00 0.00 C ATOM 1920 C GLU A 123 11.847 -7.098 -11.608 1.00 0.00 C ATOM 1921 O GLU A 123 11.390 -8.053 -11.011 1.00 0.00 O ATOM 1922 CB GLU A 123 14.157 -7.147 -12.573 1.00 0.00 C ATOM 1923 CG GLU A 123 14.281 -8.671 -12.515 1.00 0.00 C ATOM 1924 CD GLU A 123 15.266 -9.142 -13.585 1.00 0.00 C ATOM 1925 OE1 GLU A 123 14.903 -9.118 -14.749 1.00 0.00 O ATOM 1926 OE2 GLU A 123 16.369 -9.518 -13.222 1.00 0.00 O ATOM 0 H GLU A 123 13.838 -8.221 -10.061 1.00 0.00 H new ATOM 0 HA GLU A 123 13.336 -5.563 -11.368 1.00 0.00 H new ATOM 0 HB2 GLU A 123 13.709 -6.845 -13.520 1.00 0.00 H new ATOM 0 HB3 GLU A 123 15.146 -6.690 -12.528 1.00 0.00 H new ATOM 0 HG2 GLU A 123 14.623 -8.982 -11.528 1.00 0.00 H new ATOM 0 HG3 GLU A 123 13.306 -9.132 -12.674 1.00 0.00 H new ATOM 1933 N GLY A 124 11.124 -6.411 -12.453 1.00 0.00 N ATOM 1934 CA GLY A 124 9.700 -6.779 -12.710 1.00 0.00 C ATOM 1935 C GLY A 124 9.157 -5.889 -13.830 1.00 0.00 C ATOM 1936 O GLY A 124 9.905 -5.400 -14.653 1.00 0.00 O ATOM 0 H GLY A 124 11.461 -5.605 -12.980 1.00 0.00 H new ATOM 0 HA2 GLY A 124 9.626 -7.829 -12.993 1.00 0.00 H new ATOM 0 HA3 GLY A 124 9.107 -6.650 -11.804 1.00 0.00 H new ATOM 1940 N ASP A 125 7.869 -5.665 -13.873 1.00 0.00 N ATOM 1941 CA ASP A 125 7.293 -4.792 -14.940 1.00 0.00 C ATOM 1942 C ASP A 125 6.319 -3.788 -14.301 1.00 0.00 C ATOM 1943 O ASP A 125 5.892 -2.839 -14.927 1.00 0.00 O ATOM 1944 CB ASP A 125 6.543 -5.653 -15.957 1.00 0.00 C ATOM 1945 CG ASP A 125 7.544 -6.479 -16.766 1.00 0.00 C ATOM 1946 OD1 ASP A 125 8.153 -7.366 -16.190 1.00 0.00 O ATOM 1947 OD2 ASP A 125 7.686 -6.210 -17.948 1.00 0.00 O ATOM 0 H ASP A 125 7.191 -6.049 -13.215 1.00 0.00 H new ATOM 0 HA ASP A 125 8.096 -4.254 -15.445 1.00 0.00 H new ATOM 0 HB2 ASP A 125 5.842 -6.312 -15.444 1.00 0.00 H new ATOM 0 HB3 ASP A 125 5.956 -5.020 -16.623 1.00 0.00 H new ATOM 1952 N THR A 126 5.978 -3.992 -13.052 1.00 0.00 N ATOM 1953 CA THR A 126 5.049 -3.058 -12.357 1.00 0.00 C ATOM 1954 C THR A 126 5.824 -2.338 -11.258 1.00 0.00 C ATOM 1955 O THR A 126 6.361 -2.961 -10.360 1.00 0.00 O ATOM 1956 CB THR A 126 3.888 -3.842 -11.740 1.00 0.00 C ATOM 1957 OG1 THR A 126 3.469 -4.851 -12.647 1.00 0.00 O ATOM 1958 CG2 THR A 126 2.722 -2.891 -11.444 1.00 0.00 C ATOM 0 H THR A 126 6.308 -4.772 -12.483 1.00 0.00 H new ATOM 0 HA THR A 126 4.645 -2.337 -13.067 1.00 0.00 H new ATOM 0 HB THR A 126 4.214 -4.305 -10.809 1.00 0.00 H new ATOM 0 HG1 THR A 126 2.727 -5.356 -12.254 1.00 0.00 H new ATOM 0 HG21 THR A 126 1.897 -3.452 -11.005 1.00 0.00 H new ATOM 0 HG22 THR A 126 3.049 -2.121 -10.746 1.00 0.00 H new ATOM 0 HG23 THR A 126 2.390 -2.423 -12.371 1.00 0.00 H new ATOM 1966 N LYS A 127 5.892 -1.036 -11.324 1.00 0.00 N ATOM 1967 CA LYS A 127 6.642 -0.274 -10.288 1.00 0.00 C ATOM 1968 C LYS A 127 5.748 0.813 -9.698 1.00 0.00 C ATOM 1969 O LYS A 127 4.728 1.167 -10.258 1.00 0.00 O ATOM 1970 CB LYS A 127 7.877 0.370 -10.921 1.00 0.00 C ATOM 1971 CG LYS A 127 8.813 -0.723 -11.440 1.00 0.00 C ATOM 1972 CD LYS A 127 9.724 -0.144 -12.525 1.00 0.00 C ATOM 1973 CE LYS A 127 10.665 -1.235 -13.038 1.00 0.00 C ATOM 1974 NZ LYS A 127 11.677 -0.630 -13.948 1.00 0.00 N ATOM 0 H LYS A 127 5.460 -0.467 -12.052 1.00 0.00 H new ATOM 0 HA LYS A 127 6.952 -0.955 -9.495 1.00 0.00 H new ATOM 0 HB2 LYS A 127 7.579 1.027 -11.738 1.00 0.00 H new ATOM 0 HB3 LYS A 127 8.394 0.988 -10.187 1.00 0.00 H new ATOM 0 HG2 LYS A 127 9.413 -1.122 -10.622 1.00 0.00 H new ATOM 0 HG3 LYS A 127 8.232 -1.553 -11.843 1.00 0.00 H new ATOM 0 HD2 LYS A 127 9.125 0.249 -13.346 1.00 0.00 H new ATOM 0 HD3 LYS A 127 10.301 0.689 -12.124 1.00 0.00 H new ATOM 0 HE2 LYS A 127 11.161 -1.726 -12.201 1.00 0.00 H new ATOM 0 HE3 LYS A 127 10.097 -2.001 -13.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 12.317 -1.371 -14.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 11.196 -0.181 -14.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 12.226 0.086 -13.430 1.00 0.00 H new ATOM 1988 N MET A 128 6.128 1.348 -8.572 1.00 0.00 N ATOM 1989 CA MET A 128 5.307 2.412 -7.934 1.00 0.00 C ATOM 1990 C MET A 128 5.249 3.643 -8.840 1.00 0.00 C ATOM 1991 O MET A 128 6.116 3.868 -9.661 1.00 0.00 O ATOM 1992 CB MET A 128 5.931 2.796 -6.594 1.00 0.00 C ATOM 1993 CG MET A 128 4.829 3.255 -5.641 1.00 0.00 C ATOM 1994 SD MET A 128 4.677 5.054 -5.716 1.00 0.00 S ATOM 1995 CE MET A 128 3.436 5.213 -4.413 1.00 0.00 C ATOM 0 H MET A 128 6.975 1.093 -8.065 1.00 0.00 H new ATOM 0 HA MET A 128 4.295 2.038 -7.776 1.00 0.00 H new ATOM 0 HB2 MET A 128 6.464 1.945 -6.170 1.00 0.00 H new ATOM 0 HB3 MET A 128 6.662 3.592 -6.734 1.00 0.00 H new ATOM 0 HG2 MET A 128 3.882 2.788 -5.911 1.00 0.00 H new ATOM 0 HG3 MET A 128 5.060 2.941 -4.623 1.00 0.00 H new ATOM 0 HE1 MET A 128 2.702 5.967 -4.699 1.00 0.00 H new ATOM 0 HE2 MET A 128 2.935 4.256 -4.268 1.00 0.00 H new ATOM 0 HE3 MET A 128 3.920 5.513 -3.484 1.00 0.00 H new ATOM 2005 N ILE A 129 4.222 4.436 -8.693 1.00 0.00 N ATOM 2006 CA ILE A 129 4.080 5.657 -9.537 1.00 0.00 C ATOM 2007 C ILE A 129 5.061 6.734 -9.051 1.00 0.00 C ATOM 2008 O ILE A 129 5.644 6.602 -7.994 1.00 0.00 O ATOM 2009 CB ILE A 129 2.643 6.176 -9.424 1.00 0.00 C ATOM 2010 CG1 ILE A 129 2.315 6.461 -7.954 1.00 0.00 C ATOM 2011 CG2 ILE A 129 1.673 5.121 -9.967 1.00 0.00 C ATOM 2012 CD1 ILE A 129 1.485 7.741 -7.852 1.00 0.00 C ATOM 0 H ILE A 129 3.470 4.289 -8.020 1.00 0.00 H new ATOM 0 HA ILE A 129 4.302 5.416 -10.577 1.00 0.00 H new ATOM 0 HB ILE A 129 2.544 7.094 -10.003 1.00 0.00 H new ATOM 0 HG12 ILE A 129 1.765 5.624 -7.525 1.00 0.00 H new ATOM 0 HG13 ILE A 129 3.235 6.566 -7.379 1.00 0.00 H new ATOM 0 HG21 ILE A 129 0.651 5.491 -9.886 1.00 0.00 H new ATOM 0 HG22 ILE A 129 1.904 4.918 -11.013 1.00 0.00 H new ATOM 0 HG23 ILE A 129 1.773 4.203 -9.389 1.00 0.00 H new ATOM 0 HD11 ILE A 129 1.253 7.942 -6.806 1.00 0.00 H new ATOM 0 HD12 ILE A 129 2.051 8.576 -8.265 1.00 0.00 H new ATOM 0 HD13 ILE A 129 0.558 7.619 -8.412 1.00 0.00 H new ATOM 2024 N PRO A 130 5.214 7.771 -9.839 1.00 0.00 N ATOM 2025 CA PRO A 130 6.120 8.940 -9.566 1.00 0.00 C ATOM 2026 C PRO A 130 5.513 9.823 -8.472 1.00 0.00 C ATOM 2027 O PRO A 130 4.616 10.605 -8.720 1.00 0.00 O ATOM 2028 CB PRO A 130 6.242 9.723 -10.871 1.00 0.00 C ATOM 2029 CG PRO A 130 5.287 9.104 -11.871 1.00 0.00 C ATOM 2030 CD PRO A 130 4.524 7.996 -11.156 1.00 0.00 C ATOM 0 HA PRO A 130 7.100 8.607 -9.223 1.00 0.00 H new ATOM 0 HB2 PRO A 130 6.000 10.774 -10.711 1.00 0.00 H new ATOM 0 HB3 PRO A 130 7.265 9.685 -11.245 1.00 0.00 H new ATOM 0 HG2 PRO A 130 4.598 9.855 -12.258 1.00 0.00 H new ATOM 0 HG3 PRO A 130 5.834 8.703 -12.725 1.00 0.00 H new ATOM 0 HD2 PRO A 130 3.483 8.281 -11.003 1.00 0.00 H new ATOM 0 HD3 PRO A 130 4.521 7.083 -11.751 1.00 0.00 H new ATOM 2038 N LEU A 131 5.994 9.701 -7.263 1.00 0.00 N ATOM 2039 CA LEU A 131 5.443 10.530 -6.152 1.00 0.00 C ATOM 2040 C LEU A 131 6.257 11.820 -6.023 1.00 0.00 C ATOM 2041 O LEU A 131 7.385 11.900 -6.470 1.00 0.00 O ATOM 2042 CB LEU A 131 5.513 9.741 -4.842 1.00 0.00 C ATOM 2043 CG LEU A 131 4.177 9.037 -4.598 1.00 0.00 C ATOM 2044 CD1 LEU A 131 4.290 8.148 -3.359 1.00 0.00 C ATOM 2045 CD2 LEU A 131 3.079 10.085 -4.384 1.00 0.00 C ATOM 0 H LEU A 131 6.744 9.063 -6.997 1.00 0.00 H new ATOM 0 HA LEU A 131 4.404 10.781 -6.366 1.00 0.00 H new ATOM 0 HB2 LEU A 131 6.319 9.009 -4.889 1.00 0.00 H new ATOM 0 HB3 LEU A 131 5.740 10.411 -4.013 1.00 0.00 H new ATOM 0 HG LEU A 131 3.925 8.422 -5.462 1.00 0.00 H new ATOM 0 HD11 LEU A 131 3.339 7.646 -3.184 1.00 0.00 H new ATOM 0 HD12 LEU A 131 5.070 7.403 -3.516 1.00 0.00 H new ATOM 0 HD13 LEU A 131 4.542 8.761 -2.493 1.00 0.00 H new ATOM 0 HD21 LEU A 131 2.127 9.584 -4.210 1.00 0.00 H new ATOM 0 HD22 LEU A 131 3.328 10.701 -3.520 1.00 0.00 H new ATOM 0 HD23 LEU A 131 3.001 10.716 -5.269 1.00 0.00 H new ATOM 2057 N ASN A 132 5.687 12.837 -5.430 1.00 0.00 N ATOM 2058 CA ASN A 132 6.420 14.130 -5.286 1.00 0.00 C ATOM 2059 C ASN A 132 7.101 14.201 -3.915 1.00 0.00 C ATOM 2060 O ASN A 132 6.700 14.953 -3.052 1.00 0.00 O ATOM 2061 CB ASN A 132 5.427 15.289 -5.427 1.00 0.00 C ATOM 2062 CG ASN A 132 6.080 16.433 -6.205 1.00 0.00 C ATOM 2063 OD1 ASN A 132 5.798 16.628 -7.370 1.00 0.00 O ATOM 2064 ND2 ASN A 132 6.944 17.203 -5.606 1.00 0.00 N ATOM 0 H ASN A 132 4.745 12.828 -5.039 1.00 0.00 H new ATOM 0 HA ASN A 132 7.183 14.200 -6.062 1.00 0.00 H new ATOM 0 HB2 ASN A 132 4.529 14.951 -5.944 1.00 0.00 H new ATOM 0 HB3 ASN A 132 5.116 15.637 -4.442 1.00 0.00 H new ATOM 0 HD21 ASN A 132 7.383 17.970 -6.116 1.00 0.00 H new ATOM 0 HD22 ASN A 132 7.181 17.039 -4.627 1.00 0.00 H new ATOM 2071 N TRP A 133 8.129 13.419 -3.710 1.00 0.00 N ATOM 2072 CA TRP A 133 8.840 13.433 -2.393 1.00 0.00 C ATOM 2073 C TRP A 133 9.219 14.871 -2.015 1.00 0.00 C ATOM 2074 O TRP A 133 9.290 15.218 -0.852 1.00 0.00 O ATOM 2075 CB TRP A 133 10.113 12.587 -2.490 1.00 0.00 C ATOM 2076 CG TRP A 133 9.760 11.214 -2.960 1.00 0.00 C ATOM 2077 CD1 TRP A 133 9.826 10.791 -4.242 1.00 0.00 C ATOM 2078 CD2 TRP A 133 9.288 10.080 -2.178 1.00 0.00 C ATOM 2079 NE1 TRP A 133 9.416 9.473 -4.299 1.00 0.00 N ATOM 2080 CE2 TRP A 133 9.076 8.989 -3.051 1.00 0.00 C ATOM 2081 CE3 TRP A 133 9.024 9.895 -0.810 1.00 0.00 C ATOM 2082 CZ2 TRP A 133 8.618 7.759 -2.585 1.00 0.00 C ATOM 2083 CZ3 TRP A 133 8.563 8.657 -0.337 1.00 0.00 C ATOM 2084 CH2 TRP A 133 8.360 7.591 -1.223 1.00 0.00 C ATOM 0 H TRP A 133 8.509 12.769 -4.398 1.00 0.00 H new ATOM 0 HA TRP A 133 8.179 13.022 -1.630 1.00 0.00 H new ATOM 0 HB2 TRP A 133 10.819 13.050 -3.180 1.00 0.00 H new ATOM 0 HB3 TRP A 133 10.604 12.536 -1.518 1.00 0.00 H new ATOM 0 HD1 TRP A 133 10.147 11.386 -5.084 1.00 0.00 H new ATOM 0 HE1 TRP A 133 9.370 8.924 -5.158 1.00 0.00 H new ATOM 0 HE3 TRP A 133 9.177 10.711 -0.119 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 8.463 6.941 -3.273 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 8.364 8.525 0.716 1.00 0.00 H new ATOM 0 HH2 TRP A 133 8.004 6.641 -0.853 1.00 0.00 H new ATOM 2095 N ASP A 134 9.464 15.705 -2.989 1.00 0.00 N ATOM 2096 CA ASP A 134 9.841 17.118 -2.691 1.00 0.00 C ATOM 2097 C ASP A 134 8.674 17.839 -2.006 1.00 0.00 C ATOM 2098 O ASP A 134 8.868 18.792 -1.276 1.00 0.00 O ATOM 2099 CB ASP A 134 10.196 17.839 -3.993 1.00 0.00 C ATOM 2100 CG ASP A 134 11.462 18.673 -3.786 1.00 0.00 C ATOM 2101 OD1 ASP A 134 12.541 18.114 -3.896 1.00 0.00 O ATOM 2102 OD2 ASP A 134 11.331 19.857 -3.519 1.00 0.00 O ATOM 0 H ASP A 134 9.419 15.469 -3.980 1.00 0.00 H new ATOM 0 HA ASP A 134 10.704 17.124 -2.025 1.00 0.00 H new ATOM 0 HB2 ASP A 134 10.352 17.114 -4.792 1.00 0.00 H new ATOM 0 HB3 ASP A 134 9.371 18.481 -4.302 1.00 0.00 H new ATOM 2107 N ASP A 135 7.466 17.395 -2.233 1.00 0.00 N ATOM 2108 CA ASP A 135 6.289 18.053 -1.595 1.00 0.00 C ATOM 2109 C ASP A 135 6.017 17.408 -0.231 1.00 0.00 C ATOM 2110 O ASP A 135 5.243 17.911 0.560 1.00 0.00 O ATOM 2111 CB ASP A 135 5.062 17.878 -2.497 1.00 0.00 C ATOM 2112 CG ASP A 135 4.402 19.237 -2.741 1.00 0.00 C ATOM 2113 OD1 ASP A 135 3.856 19.786 -1.799 1.00 0.00 O ATOM 2114 OD2 ASP A 135 4.454 19.704 -3.867 1.00 0.00 O ATOM 0 H ASP A 135 7.244 16.602 -2.835 1.00 0.00 H new ATOM 0 HA ASP A 135 6.494 19.115 -1.457 1.00 0.00 H new ATOM 0 HB2 ASP A 135 5.357 17.431 -3.446 1.00 0.00 H new ATOM 0 HB3 ASP A 135 4.351 17.196 -2.031 1.00 0.00 H new ATOM 2119 N PHE A 136 6.653 16.301 0.049 1.00 0.00 N ATOM 2120 CA PHE A 136 6.435 15.629 1.360 1.00 0.00 C ATOM 2121 C PHE A 136 7.747 15.605 2.145 1.00 0.00 C ATOM 2122 O PHE A 136 8.812 15.845 1.611 1.00 0.00 O ATOM 2123 CB PHE A 136 5.957 14.193 1.137 1.00 0.00 C ATOM 2124 CG PHE A 136 4.596 14.196 0.484 1.00 0.00 C ATOM 2125 CD1 PHE A 136 4.489 14.314 -0.903 1.00 0.00 C ATOM 2126 CD2 PHE A 136 3.442 14.067 1.265 1.00 0.00 C ATOM 2127 CE1 PHE A 136 3.231 14.303 -1.513 1.00 0.00 C ATOM 2128 CE2 PHE A 136 2.183 14.058 0.655 1.00 0.00 C ATOM 2129 CZ PHE A 136 2.078 14.175 -0.734 1.00 0.00 C ATOM 0 H PHE A 136 7.313 15.835 -0.574 1.00 0.00 H new ATOM 0 HA PHE A 136 5.679 16.179 1.920 1.00 0.00 H new ATOM 0 HB2 PHE A 136 6.669 13.658 0.509 1.00 0.00 H new ATOM 0 HB3 PHE A 136 5.911 13.664 2.089 1.00 0.00 H new ATOM 0 HD1 PHE A 136 5.380 14.414 -1.506 1.00 0.00 H new ATOM 0 HD2 PHE A 136 3.523 13.974 2.338 1.00 0.00 H new ATOM 0 HE1 PHE A 136 3.150 14.393 -2.586 1.00 0.00 H new ATOM 0 HE2 PHE A 136 1.292 13.961 1.257 1.00 0.00 H new ATOM 0 HZ PHE A 136 1.106 14.166 -1.205 1.00 0.00 H new ATOM 2139 N THR A 137 7.669 15.307 3.410 1.00 0.00 N ATOM 2140 CA THR A 137 8.902 15.252 4.244 1.00 0.00 C ATOM 2141 C THR A 137 8.864 14.006 5.124 1.00 0.00 C ATOM 2142 O THR A 137 7.860 13.702 5.738 1.00 0.00 O ATOM 2143 CB THR A 137 8.984 16.496 5.127 1.00 0.00 C ATOM 2144 OG1 THR A 137 8.575 17.632 4.379 1.00 0.00 O ATOM 2145 CG2 THR A 137 10.424 16.687 5.605 1.00 0.00 C ATOM 0 H THR A 137 6.802 15.098 3.905 1.00 0.00 H new ATOM 0 HA THR A 137 9.776 15.214 3.593 1.00 0.00 H new ATOM 0 HB THR A 137 8.330 16.376 5.991 1.00 0.00 H new ATOM 0 HG1 THR A 137 8.625 18.431 4.944 1.00 0.00 H new ATOM 0 HG21 THR A 137 10.484 17.574 6.235 1.00 0.00 H new ATOM 0 HG22 THR A 137 10.736 15.814 6.178 1.00 0.00 H new ATOM 0 HG23 THR A 137 11.080 16.809 4.743 1.00 0.00 H new ATOM 2153 N LYS A 138 9.949 13.282 5.193 1.00 0.00 N ATOM 2154 CA LYS A 138 9.969 12.057 6.035 1.00 0.00 C ATOM 2155 C LYS A 138 9.998 12.476 7.505 1.00 0.00 C ATOM 2156 O LYS A 138 10.914 13.135 7.956 1.00 0.00 O ATOM 2157 CB LYS A 138 11.216 11.231 5.698 1.00 0.00 C ATOM 2158 CG LYS A 138 10.880 9.737 5.752 1.00 0.00 C ATOM 2159 CD LYS A 138 11.888 9.012 6.647 1.00 0.00 C ATOM 2160 CE LYS A 138 13.121 8.625 5.826 1.00 0.00 C ATOM 2161 NZ LYS A 138 14.337 9.222 6.446 1.00 0.00 N ATOM 0 H LYS A 138 10.819 13.488 4.703 1.00 0.00 H new ATOM 0 HA LYS A 138 9.083 11.452 5.845 1.00 0.00 H new ATOM 0 HB2 LYS A 138 11.581 11.495 4.706 1.00 0.00 H new ATOM 0 HB3 LYS A 138 12.016 11.459 6.403 1.00 0.00 H new ATOM 0 HG2 LYS A 138 9.870 9.596 6.137 1.00 0.00 H new ATOM 0 HG3 LYS A 138 10.901 9.314 4.748 1.00 0.00 H new ATOM 0 HD2 LYS A 138 12.179 9.654 7.478 1.00 0.00 H new ATOM 0 HD3 LYS A 138 11.432 8.121 7.078 1.00 0.00 H new ATOM 0 HE2 LYS A 138 13.217 7.540 5.783 1.00 0.00 H new ATOM 0 HE3 LYS A 138 13.013 8.976 4.800 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 15.184 8.742 6.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 14.384 10.234 6.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 14.292 9.107 7.479 1.00 0.00 H new ATOM 2175 N VAL A 139 8.993 12.105 8.252 1.00 0.00 N ATOM 2176 CA VAL A 139 8.949 12.488 9.692 1.00 0.00 C ATOM 2177 C VAL A 139 9.419 11.318 10.556 1.00 0.00 C ATOM 2178 O VAL A 139 9.846 11.500 11.679 1.00 0.00 O ATOM 2179 CB VAL A 139 7.516 12.870 10.079 1.00 0.00 C ATOM 2180 CG1 VAL A 139 7.079 14.095 9.274 1.00 0.00 C ATOM 2181 CG2 VAL A 139 6.571 11.703 9.779 1.00 0.00 C ATOM 0 H VAL A 139 8.200 11.553 7.926 1.00 0.00 H new ATOM 0 HA VAL A 139 9.608 13.340 9.855 1.00 0.00 H new ATOM 0 HB VAL A 139 7.481 13.100 11.144 1.00 0.00 H new ATOM 0 HG11 VAL A 139 6.060 14.367 9.549 1.00 0.00 H new ATOM 0 HG12 VAL A 139 7.747 14.929 9.489 1.00 0.00 H new ATOM 0 HG13 VAL A 139 7.118 13.864 8.210 1.00 0.00 H new ATOM 0 HG21 VAL A 139 5.553 11.979 10.056 1.00 0.00 H new ATOM 0 HG22 VAL A 139 6.607 11.470 8.715 1.00 0.00 H new ATOM 0 HG23 VAL A 139 6.879 10.829 10.353 1.00 0.00 H new ATOM 2191 N SER A 140 9.341 10.117 10.048 1.00 0.00 N ATOM 2192 CA SER A 140 9.780 8.945 10.853 1.00 0.00 C ATOM 2193 C SER A 140 10.443 7.906 9.947 1.00 0.00 C ATOM 2194 O SER A 140 9.970 7.608 8.862 1.00 0.00 O ATOM 2195 CB SER A 140 8.567 8.320 11.545 1.00 0.00 C ATOM 2196 OG SER A 140 8.575 8.682 12.920 1.00 0.00 O ATOM 0 H SER A 140 8.993 9.899 9.114 1.00 0.00 H new ATOM 0 HA SER A 140 10.500 9.275 11.602 1.00 0.00 H new ATOM 0 HB2 SER A 140 7.647 8.663 11.072 1.00 0.00 H new ATOM 0 HB3 SER A 140 8.594 7.235 11.442 1.00 0.00 H new ATOM 0 HG SER A 140 7.799 8.285 13.367 1.00 0.00 H new ATOM 2202 N SER A 141 11.537 7.351 10.396 1.00 0.00 N ATOM 2203 CA SER A 141 12.248 6.322 9.590 1.00 0.00 C ATOM 2204 C SER A 141 12.937 5.333 10.535 1.00 0.00 C ATOM 2205 O SER A 141 13.596 5.722 11.480 1.00 0.00 O ATOM 2206 CB SER A 141 13.296 6.995 8.696 1.00 0.00 C ATOM 2207 OG SER A 141 13.293 8.397 8.934 1.00 0.00 O ATOM 0 H SER A 141 11.970 7.569 11.293 1.00 0.00 H new ATOM 0 HA SER A 141 11.532 5.793 8.961 1.00 0.00 H new ATOM 0 HB2 SER A 141 14.284 6.583 8.902 1.00 0.00 H new ATOM 0 HB3 SER A 141 13.078 6.793 7.647 1.00 0.00 H new ATOM 0 HG SER A 141 14.162 8.669 9.295 1.00 0.00 H new ATOM 2213 N ARG A 142 12.798 4.059 10.285 1.00 0.00 N ATOM 2214 CA ARG A 142 13.451 3.044 11.161 1.00 0.00 C ATOM 2215 C ARG A 142 14.219 2.062 10.275 1.00 0.00 C ATOM 2216 O ARG A 142 13.693 1.569 9.297 1.00 0.00 O ATOM 2217 CB ARG A 142 12.381 2.290 11.956 1.00 0.00 C ATOM 2218 CG ARG A 142 13.050 1.460 13.054 1.00 0.00 C ATOM 2219 CD ARG A 142 11.995 0.988 14.055 1.00 0.00 C ATOM 2220 NE ARG A 142 12.652 0.701 15.366 1.00 0.00 N ATOM 2221 CZ ARG A 142 12.173 -0.213 16.176 1.00 0.00 C ATOM 2222 NH1 ARG A 142 11.094 -0.888 15.870 1.00 0.00 N ATOM 2223 NH2 ARG A 142 12.776 -0.446 17.309 1.00 0.00 N ATOM 0 H ARG A 142 12.258 3.676 9.509 1.00 0.00 H new ATOM 0 HA ARG A 142 14.133 3.532 11.857 1.00 0.00 H new ATOM 0 HB2 ARG A 142 11.676 2.995 12.397 1.00 0.00 H new ATOM 0 HB3 ARG A 142 11.810 1.641 11.292 1.00 0.00 H new ATOM 0 HG2 ARG A 142 13.560 0.602 12.616 1.00 0.00 H new ATOM 0 HG3 ARG A 142 13.808 2.055 13.563 1.00 0.00 H new ATOM 0 HD2 ARG A 142 11.227 1.752 14.179 1.00 0.00 H new ATOM 0 HD3 ARG A 142 11.497 0.093 13.681 1.00 0.00 H new ATOM 0 HE ARG A 142 13.486 1.224 15.635 1.00 0.00 H new ATOM 0 HH11 ARG A 142 10.612 -0.707 14.990 1.00 0.00 H new ATOM 0 HH12 ARG A 142 10.736 -1.595 16.512 1.00 0.00 H new ATOM 0 HH21 ARG A 142 13.613 0.081 17.559 1.00 0.00 H new ATOM 0 HH22 ARG A 142 12.411 -1.155 17.945 1.00 0.00 H new ATOM 2237 N THR A 143 15.456 1.779 10.592 1.00 0.00 N ATOM 2238 CA THR A 143 16.244 0.836 9.746 1.00 0.00 C ATOM 2239 C THR A 143 16.319 -0.534 10.420 1.00 0.00 C ATOM 2240 O THR A 143 16.770 -0.659 11.542 1.00 0.00 O ATOM 2241 CB THR A 143 17.662 1.387 9.565 1.00 0.00 C ATOM 2242 OG1 THR A 143 17.602 2.795 9.388 1.00 0.00 O ATOM 2243 CG2 THR A 143 18.317 0.742 8.341 1.00 0.00 C ATOM 0 H THR A 143 15.953 2.159 11.398 1.00 0.00 H new ATOM 0 HA THR A 143 15.757 0.732 8.776 1.00 0.00 H new ATOM 0 HB THR A 143 18.255 1.156 10.450 1.00 0.00 H new ATOM 0 HG1 THR A 143 18.509 3.149 9.274 1.00 0.00 H new ATOM 0 HG21 THR A 143 19.325 1.137 8.217 1.00 0.00 H new ATOM 0 HG22 THR A 143 18.366 -0.338 8.481 1.00 0.00 H new ATOM 0 HG23 THR A 143 17.727 0.966 7.452 1.00 0.00 H new ATOM 2251 N VAL A 144 15.891 -1.563 9.740 1.00 0.00 N ATOM 2252 CA VAL A 144 15.946 -2.928 10.336 1.00 0.00 C ATOM 2253 C VAL A 144 16.839 -3.830 9.477 1.00 0.00 C ATOM 2254 O VAL A 144 16.612 -4.004 8.290 1.00 0.00 O ATOM 2255 CB VAL A 144 14.533 -3.516 10.401 1.00 0.00 C ATOM 2256 CG1 VAL A 144 13.981 -3.680 8.985 1.00 0.00 C ATOM 2257 CG2 VAL A 144 14.577 -4.884 11.094 1.00 0.00 C ATOM 0 H VAL A 144 15.505 -1.517 8.797 1.00 0.00 H new ATOM 0 HA VAL A 144 16.359 -2.866 11.343 1.00 0.00 H new ATOM 0 HB VAL A 144 13.888 -2.843 10.966 1.00 0.00 H new ATOM 0 HG11 VAL A 144 12.976 -4.098 9.033 1.00 0.00 H new ATOM 0 HG12 VAL A 144 13.947 -2.708 8.493 1.00 0.00 H new ATOM 0 HG13 VAL A 144 14.627 -4.351 8.418 1.00 0.00 H new ATOM 0 HG21 VAL A 144 13.571 -5.301 11.140 1.00 0.00 H new ATOM 0 HG22 VAL A 144 15.224 -5.557 10.531 1.00 0.00 H new ATOM 0 HG23 VAL A 144 14.968 -4.767 12.105 1.00 0.00 H new ATOM 2267 N GLU A 145 17.858 -4.395 10.068 1.00 0.00 N ATOM 2268 CA GLU A 145 18.777 -5.280 9.299 1.00 0.00 C ATOM 2269 C GLU A 145 18.257 -6.719 9.336 1.00 0.00 C ATOM 2270 O GLU A 145 17.465 -7.082 10.183 1.00 0.00 O ATOM 2271 CB GLU A 145 20.173 -5.225 9.922 1.00 0.00 C ATOM 2272 CG GLU A 145 20.786 -3.844 9.683 1.00 0.00 C ATOM 2273 CD GLU A 145 22.291 -3.985 9.455 1.00 0.00 C ATOM 2274 OE1 GLU A 145 22.986 -4.309 10.404 1.00 0.00 O ATOM 2275 OE2 GLU A 145 22.724 -3.767 8.335 1.00 0.00 O ATOM 0 H GLU A 145 18.093 -4.280 11.054 1.00 0.00 H new ATOM 0 HA GLU A 145 18.825 -4.941 8.264 1.00 0.00 H new ATOM 0 HB2 GLU A 145 20.114 -5.428 10.991 1.00 0.00 H new ATOM 0 HB3 GLU A 145 20.808 -5.996 9.486 1.00 0.00 H new ATOM 0 HG2 GLU A 145 20.319 -3.372 8.818 1.00 0.00 H new ATOM 0 HG3 GLU A 145 20.597 -3.197 10.540 1.00 0.00 H new ATOM 2282 N ASP A 146 18.701 -7.539 8.421 1.00 0.00 N ATOM 2283 CA ASP A 146 18.238 -8.956 8.398 1.00 0.00 C ATOM 2284 C ASP A 146 19.412 -9.877 8.048 1.00 0.00 C ATOM 2285 O ASP A 146 20.390 -9.455 7.464 1.00 0.00 O ATOM 2286 CB ASP A 146 17.133 -9.111 7.349 1.00 0.00 C ATOM 2287 CG ASP A 146 15.973 -9.917 7.938 1.00 0.00 C ATOM 2288 OD1 ASP A 146 16.055 -11.134 7.922 1.00 0.00 O ATOM 2289 OD2 ASP A 146 15.023 -9.302 8.395 1.00 0.00 O ATOM 0 H ASP A 146 19.365 -7.288 7.688 1.00 0.00 H new ATOM 0 HA ASP A 146 17.850 -9.227 9.380 1.00 0.00 H new ATOM 0 HB2 ASP A 146 16.782 -8.130 7.029 1.00 0.00 H new ATOM 0 HB3 ASP A 146 17.525 -9.613 6.465 1.00 0.00 H new ATOM 2294 N THR A 147 19.315 -11.134 8.395 1.00 0.00 N ATOM 2295 CA THR A 147 20.417 -12.091 8.078 1.00 0.00 C ATOM 2296 C THR A 147 20.591 -12.199 6.556 1.00 0.00 C ATOM 2297 O THR A 147 21.591 -12.691 6.070 1.00 0.00 O ATOM 2298 CB THR A 147 20.067 -13.468 8.648 1.00 0.00 C ATOM 2299 OG1 THR A 147 18.680 -13.714 8.468 1.00 0.00 O ATOM 2300 CG2 THR A 147 20.399 -13.507 10.138 1.00 0.00 C ATOM 0 H THR A 147 18.518 -11.540 8.885 1.00 0.00 H new ATOM 0 HA THR A 147 21.346 -11.733 8.521 1.00 0.00 H new ATOM 0 HB THR A 147 20.645 -14.232 8.128 1.00 0.00 H new ATOM 0 HG1 THR A 147 18.454 -14.596 8.831 1.00 0.00 H new ATOM 0 HG21 THR A 147 20.149 -14.488 10.541 1.00 0.00 H new ATOM 0 HG22 THR A 147 21.463 -13.318 10.279 1.00 0.00 H new ATOM 0 HG23 THR A 147 19.822 -12.743 10.659 1.00 0.00 H new ATOM 2308 N ASN A 148 19.627 -11.736 5.805 1.00 0.00 N ATOM 2309 CA ASN A 148 19.737 -11.803 4.319 1.00 0.00 C ATOM 2310 C ASN A 148 20.040 -10.400 3.770 1.00 0.00 C ATOM 2311 O ASN A 148 19.303 -9.468 4.024 1.00 0.00 O ATOM 2312 CB ASN A 148 18.424 -12.313 3.730 1.00 0.00 C ATOM 2313 CG ASN A 148 18.691 -12.977 2.378 1.00 0.00 C ATOM 2314 OD1 ASN A 148 18.237 -12.503 1.355 1.00 0.00 O ATOM 2315 ND2 ASN A 148 19.411 -14.063 2.328 1.00 0.00 N ATOM 0 H ASN A 148 18.768 -11.314 6.157 1.00 0.00 H new ATOM 0 HA ASN A 148 20.542 -12.484 4.042 1.00 0.00 H new ATOM 0 HB2 ASN A 148 17.961 -13.026 4.412 1.00 0.00 H new ATOM 0 HB3 ASN A 148 17.723 -11.487 3.609 1.00 0.00 H new ATOM 0 HD21 ASN A 148 19.593 -14.514 1.431 1.00 0.00 H new ATOM 0 HD22 ASN A 148 19.793 -14.462 3.186 1.00 0.00 H new ATOM 2322 N PRO A 149 21.125 -10.291 3.040 1.00 0.00 N ATOM 2323 CA PRO A 149 21.628 -9.019 2.408 1.00 0.00 C ATOM 2324 C PRO A 149 20.496 -8.294 1.672 1.00 0.00 C ATOM 2325 O PRO A 149 20.311 -7.103 1.824 1.00 0.00 O ATOM 2326 CB PRO A 149 22.718 -9.414 1.415 1.00 0.00 C ATOM 2327 CG PRO A 149 22.969 -10.898 1.568 1.00 0.00 C ATOM 2328 CD PRO A 149 22.076 -11.406 2.693 1.00 0.00 C ATOM 0 HA PRO A 149 22.013 -8.343 3.172 1.00 0.00 H new ATOM 0 HB2 PRO A 149 22.408 -9.182 0.396 1.00 0.00 H new ATOM 0 HB3 PRO A 149 23.631 -8.851 1.606 1.00 0.00 H new ATOM 0 HG2 PRO A 149 22.747 -11.421 0.638 1.00 0.00 H new ATOM 0 HG3 PRO A 149 24.018 -11.087 1.797 1.00 0.00 H new ATOM 0 HD2 PRO A 149 21.529 -12.295 2.379 1.00 0.00 H new ATOM 0 HD3 PRO A 149 22.672 -11.688 3.561 1.00 0.00 H new ATOM 2336 N ALA A 150 19.757 -8.995 0.854 1.00 0.00 N ATOM 2337 CA ALA A 150 18.663 -8.335 0.083 1.00 0.00 C ATOM 2338 C ALA A 150 17.437 -8.111 0.973 1.00 0.00 C ATOM 2339 O ALA A 150 16.698 -7.164 0.784 1.00 0.00 O ATOM 2340 CB ALA A 150 18.273 -9.220 -1.103 1.00 0.00 C ATOM 0 H ALA A 150 19.863 -9.995 0.686 1.00 0.00 H new ATOM 0 HA ALA A 150 19.019 -7.369 -0.274 1.00 0.00 H new ATOM 0 HB1 ALA A 150 17.474 -8.740 -1.668 1.00 0.00 H new ATOM 0 HB2 ALA A 150 19.139 -9.364 -1.750 1.00 0.00 H new ATOM 0 HB3 ALA A 150 17.928 -10.187 -0.737 1.00 0.00 H new ATOM 2346 N LEU A 151 17.204 -8.965 1.935 1.00 0.00 N ATOM 2347 CA LEU A 151 16.013 -8.777 2.816 1.00 0.00 C ATOM 2348 C LEU A 151 16.223 -7.582 3.753 1.00 0.00 C ATOM 2349 O LEU A 151 15.340 -7.217 4.505 1.00 0.00 O ATOM 2350 CB LEU A 151 15.775 -10.041 3.644 1.00 0.00 C ATOM 2351 CG LEU A 151 15.535 -11.237 2.711 1.00 0.00 C ATOM 2352 CD1 LEU A 151 15.204 -12.475 3.548 1.00 0.00 C ATOM 2353 CD2 LEU A 151 14.367 -10.939 1.761 1.00 0.00 C ATOM 0 H LEU A 151 17.781 -9.778 2.148 1.00 0.00 H new ATOM 0 HA LEU A 151 15.143 -8.584 2.188 1.00 0.00 H new ATOM 0 HB2 LEU A 151 16.636 -10.235 4.284 1.00 0.00 H new ATOM 0 HB3 LEU A 151 14.915 -9.901 4.299 1.00 0.00 H new ATOM 0 HG LEU A 151 16.435 -11.417 2.124 1.00 0.00 H new ATOM 0 HD11 LEU A 151 15.033 -13.325 2.888 1.00 0.00 H new ATOM 0 HD12 LEU A 151 16.036 -12.696 4.216 1.00 0.00 H new ATOM 0 HD13 LEU A 151 14.306 -12.287 4.137 1.00 0.00 H new ATOM 0 HD21 LEU A 151 14.205 -11.793 1.104 1.00 0.00 H new ATOM 0 HD22 LEU A 151 13.464 -10.752 2.342 1.00 0.00 H new ATOM 0 HD23 LEU A 151 14.601 -10.059 1.161 1.00 0.00 H new ATOM 2365 N THR A 152 17.368 -6.951 3.706 1.00 0.00 N ATOM 2366 CA THR A 152 17.598 -5.767 4.580 1.00 0.00 C ATOM 2367 C THR A 152 16.724 -4.629 4.057 1.00 0.00 C ATOM 2368 O THR A 152 16.518 -4.508 2.865 1.00 0.00 O ATOM 2369 CB THR A 152 19.072 -5.360 4.510 1.00 0.00 C ATOM 2370 OG1 THR A 152 19.887 -6.506 4.708 1.00 0.00 O ATOM 2371 CG2 THR A 152 19.375 -4.323 5.591 1.00 0.00 C ATOM 0 H THR A 152 18.150 -7.205 3.102 1.00 0.00 H new ATOM 0 HA THR A 152 17.347 -5.997 5.616 1.00 0.00 H new ATOM 0 HB THR A 152 19.281 -4.928 3.532 1.00 0.00 H new ATOM 0 HG1 THR A 152 20.200 -6.838 3.841 1.00 0.00 H new ATOM 0 HG21 THR A 152 20.425 -4.037 5.537 1.00 0.00 H new ATOM 0 HG22 THR A 152 18.751 -3.443 5.436 1.00 0.00 H new ATOM 0 HG23 THR A 152 19.165 -4.748 6.572 1.00 0.00 H new ATOM 2379 N HIS A 153 16.206 -3.787 4.914 1.00 0.00 N ATOM 2380 CA HIS A 153 15.353 -2.677 4.394 1.00 0.00 C ATOM 2381 C HIS A 153 15.129 -1.610 5.464 1.00 0.00 C ATOM 2382 O HIS A 153 15.421 -1.800 6.628 1.00 0.00 O ATOM 2383 CB HIS A 153 14.001 -3.236 3.935 1.00 0.00 C ATOM 2384 CG HIS A 153 13.390 -4.073 5.025 1.00 0.00 C ATOM 2385 ND1 HIS A 153 13.937 -5.282 5.426 1.00 0.00 N ATOM 2386 CD2 HIS A 153 12.271 -3.892 5.801 1.00 0.00 C ATOM 2387 CE1 HIS A 153 13.154 -5.777 6.402 1.00 0.00 C ATOM 2388 NE2 HIS A 153 12.125 -4.970 6.670 1.00 0.00 N ATOM 0 H HIS A 153 16.332 -3.817 5.926 1.00 0.00 H new ATOM 0 HA HIS A 153 15.868 -2.216 3.551 1.00 0.00 H new ATOM 0 HB2 HIS A 153 13.330 -2.417 3.675 1.00 0.00 H new ATOM 0 HB3 HIS A 153 14.134 -3.837 3.036 1.00 0.00 H new ATOM 0 HD1 HIS A 153 14.779 -5.717 5.050 1.00 0.00 H new ATOM 0 HD2 HIS A 153 11.606 -3.043 5.745 1.00 0.00 H new ATOM 0 HE1 HIS A 153 13.336 -6.714 6.907 1.00 0.00 H new ATOM 2396 N THR A 154 14.591 -0.490 5.061 1.00 0.00 N ATOM 2397 CA THR A 154 14.319 0.615 6.020 1.00 0.00 C ATOM 2398 C THR A 154 12.860 1.050 5.867 1.00 0.00 C ATOM 2399 O THR A 154 12.285 0.945 4.801 1.00 0.00 O ATOM 2400 CB THR A 154 15.244 1.793 5.698 1.00 0.00 C ATOM 2401 OG1 THR A 154 16.561 1.310 5.474 1.00 0.00 O ATOM 2402 CG2 THR A 154 15.252 2.779 6.865 1.00 0.00 C ATOM 0 H THR A 154 14.326 -0.293 4.096 1.00 0.00 H new ATOM 0 HA THR A 154 14.498 0.282 7.042 1.00 0.00 H new ATOM 0 HB THR A 154 14.884 2.301 4.803 1.00 0.00 H new ATOM 0 HG1 THR A 154 17.154 2.062 5.266 1.00 0.00 H new ATOM 0 HG21 THR A 154 15.911 3.615 6.631 1.00 0.00 H new ATOM 0 HG22 THR A 154 14.241 3.151 7.034 1.00 0.00 H new ATOM 0 HG23 THR A 154 15.609 2.276 7.764 1.00 0.00 H new ATOM 2410 N TYR A 155 12.253 1.533 6.918 1.00 0.00 N ATOM 2411 CA TYR A 155 10.830 1.970 6.819 1.00 0.00 C ATOM 2412 C TYR A 155 10.775 3.495 6.763 1.00 0.00 C ATOM 2413 O TYR A 155 11.255 4.169 7.651 1.00 0.00 O ATOM 2414 CB TYR A 155 10.055 1.494 8.050 1.00 0.00 C ATOM 2415 CG TYR A 155 10.073 -0.013 8.117 1.00 0.00 C ATOM 2416 CD1 TYR A 155 9.272 -0.763 7.249 1.00 0.00 C ATOM 2417 CD2 TYR A 155 10.886 -0.660 9.052 1.00 0.00 C ATOM 2418 CE1 TYR A 155 9.285 -2.161 7.316 1.00 0.00 C ATOM 2419 CE2 TYR A 155 10.900 -2.057 9.119 1.00 0.00 C ATOM 2420 CZ TYR A 155 10.098 -2.808 8.251 1.00 0.00 C ATOM 2421 OH TYR A 155 10.108 -4.188 8.316 1.00 0.00 O ATOM 0 H TYR A 155 12.679 1.644 7.838 1.00 0.00 H new ATOM 0 HA TYR A 155 10.386 1.544 5.919 1.00 0.00 H new ATOM 0 HB2 TYR A 155 10.498 1.912 8.954 1.00 0.00 H new ATOM 0 HB3 TYR A 155 9.027 1.852 8.004 1.00 0.00 H new ATOM 0 HD1 TYR A 155 8.643 -0.263 6.527 1.00 0.00 H new ATOM 0 HD2 TYR A 155 11.503 -0.081 9.723 1.00 0.00 H new ATOM 0 HE1 TYR A 155 8.667 -2.740 6.645 1.00 0.00 H new ATOM 0 HE2 TYR A 155 11.530 -2.557 9.840 1.00 0.00 H new ATOM 0 HH TYR A 155 11.003 -4.520 8.093 1.00 0.00 H new ATOM 2431 N GLU A 156 10.200 4.048 5.730 1.00 0.00 N ATOM 2432 CA GLU A 156 10.124 5.531 5.626 1.00 0.00 C ATOM 2433 C GLU A 156 8.690 5.988 5.908 1.00 0.00 C ATOM 2434 O GLU A 156 7.737 5.280 5.637 1.00 0.00 O ATOM 2435 CB GLU A 156 10.540 5.970 4.224 1.00 0.00 C ATOM 2436 CG GLU A 156 11.978 5.521 3.953 1.00 0.00 C ATOM 2437 CD GLU A 156 12.420 6.026 2.578 1.00 0.00 C ATOM 2438 OE1 GLU A 156 12.334 7.222 2.352 1.00 0.00 O ATOM 2439 OE2 GLU A 156 12.838 5.208 1.776 1.00 0.00 O ATOM 0 H GLU A 156 9.780 3.536 4.954 1.00 0.00 H new ATOM 0 HA GLU A 156 10.797 5.982 6.355 1.00 0.00 H new ATOM 0 HB2 GLU A 156 9.868 5.539 3.482 1.00 0.00 H new ATOM 0 HB3 GLU A 156 10.463 7.053 4.133 1.00 0.00 H new ATOM 0 HG2 GLU A 156 12.643 5.908 4.725 1.00 0.00 H new ATOM 0 HG3 GLU A 156 12.044 4.434 3.991 1.00 0.00 H new ATOM 2446 N VAL A 157 8.538 7.192 6.398 1.00 0.00 N ATOM 2447 CA VAL A 157 7.175 7.743 6.663 1.00 0.00 C ATOM 2448 C VAL A 157 7.178 9.235 6.322 1.00 0.00 C ATOM 2449 O VAL A 157 7.913 10.002 6.909 1.00 0.00 O ATOM 2450 CB VAL A 157 6.816 7.553 8.140 1.00 0.00 C ATOM 2451 CG1 VAL A 157 5.397 8.068 8.395 1.00 0.00 C ATOM 2452 CG2 VAL A 157 6.887 6.065 8.495 1.00 0.00 C ATOM 0 H VAL A 157 9.307 7.822 6.628 1.00 0.00 H new ATOM 0 HA VAL A 157 6.438 7.221 6.052 1.00 0.00 H new ATOM 0 HB VAL A 157 7.521 8.111 8.757 1.00 0.00 H new ATOM 0 HG11 VAL A 157 5.144 7.932 9.446 1.00 0.00 H new ATOM 0 HG12 VAL A 157 5.344 9.127 8.143 1.00 0.00 H new ATOM 0 HG13 VAL A 157 4.692 7.512 7.777 1.00 0.00 H new ATOM 0 HG21 VAL A 157 6.632 5.929 9.546 1.00 0.00 H new ATOM 0 HG22 VAL A 157 6.183 5.509 7.876 1.00 0.00 H new ATOM 0 HG23 VAL A 157 7.897 5.696 8.316 1.00 0.00 H new ATOM 2462 N TRP A 158 6.367 9.663 5.387 1.00 0.00 N ATOM 2463 CA TRP A 158 6.353 11.114 5.029 1.00 0.00 C ATOM 2464 C TRP A 158 4.982 11.726 5.329 1.00 0.00 C ATOM 2465 O TRP A 158 3.992 11.034 5.469 1.00 0.00 O ATOM 2466 CB TRP A 158 6.656 11.285 3.537 1.00 0.00 C ATOM 2467 CG TRP A 158 7.920 10.566 3.182 1.00 0.00 C ATOM 2468 CD1 TRP A 158 8.081 9.223 3.196 1.00 0.00 C ATOM 2469 CD2 TRP A 158 9.196 11.127 2.755 1.00 0.00 C ATOM 2470 NE1 TRP A 158 9.375 8.925 2.808 1.00 0.00 N ATOM 2471 CE2 TRP A 158 10.102 10.064 2.527 1.00 0.00 C ATOM 2472 CE3 TRP A 158 9.652 12.441 2.547 1.00 0.00 C ATOM 2473 CZ2 TRP A 158 11.413 10.296 2.109 1.00 0.00 C ATOM 2474 CZ3 TRP A 158 10.971 12.679 2.126 1.00 0.00 C ATOM 2475 CH2 TRP A 158 11.849 11.608 1.907 1.00 0.00 C ATOM 0 H TRP A 158 5.720 9.076 4.860 1.00 0.00 H new ATOM 0 HA TRP A 158 7.113 11.621 5.623 1.00 0.00 H new ATOM 0 HB2 TRP A 158 5.829 10.896 2.943 1.00 0.00 H new ATOM 0 HB3 TRP A 158 6.751 12.344 3.297 1.00 0.00 H new ATOM 0 HD1 TRP A 158 7.324 8.502 3.466 1.00 0.00 H new ATOM 0 HE1 TRP A 158 9.747 7.978 2.738 1.00 0.00 H new ATOM 0 HE3 TRP A 158 8.983 13.273 2.712 1.00 0.00 H new ATOM 0 HZ2 TRP A 158 12.086 9.468 1.943 1.00 0.00 H new ATOM 0 HZ3 TRP A 158 11.311 13.692 1.970 1.00 0.00 H new ATOM 0 HH2 TRP A 158 12.862 11.797 1.582 1.00 0.00 H new ATOM 2486 N GLN A 159 4.923 13.029 5.400 1.00 0.00 N ATOM 2487 CA GLN A 159 3.631 13.725 5.662 1.00 0.00 C ATOM 2488 C GLN A 159 3.551 14.947 4.743 1.00 0.00 C ATOM 2489 O GLN A 159 4.547 15.597 4.491 1.00 0.00 O ATOM 2490 CB GLN A 159 3.576 14.179 7.124 1.00 0.00 C ATOM 2491 CG GLN A 159 3.372 12.964 8.032 1.00 0.00 C ATOM 2492 CD GLN A 159 2.961 13.436 9.428 1.00 0.00 C ATOM 2493 OE1 GLN A 159 3.681 14.174 10.070 1.00 0.00 O ATOM 2494 NE2 GLN A 159 1.824 13.037 9.930 1.00 0.00 N ATOM 0 H GLN A 159 5.726 13.648 5.286 1.00 0.00 H new ATOM 0 HA GLN A 159 2.796 13.052 5.471 1.00 0.00 H new ATOM 0 HB2 GLN A 159 4.499 14.694 7.390 1.00 0.00 H new ATOM 0 HB3 GLN A 159 2.762 14.891 7.264 1.00 0.00 H new ATOM 0 HG2 GLN A 159 2.605 12.310 7.617 1.00 0.00 H new ATOM 0 HG3 GLN A 159 4.291 12.381 8.089 1.00 0.00 H new ATOM 0 HE21 GLN A 159 1.218 12.417 9.392 1.00 0.00 H new ATOM 0 HE22 GLN A 159 1.541 13.345 10.860 1.00 0.00 H new ATOM 2503 N LYS A 160 2.392 15.269 4.231 1.00 0.00 N ATOM 2504 CA LYS A 160 2.285 16.448 3.323 1.00 0.00 C ATOM 2505 C LYS A 160 2.376 17.743 4.132 1.00 0.00 C ATOM 2506 O LYS A 160 1.671 17.931 5.104 1.00 0.00 O ATOM 2507 CB LYS A 160 0.941 16.406 2.593 1.00 0.00 C ATOM 2508 CG LYS A 160 1.058 17.154 1.264 1.00 0.00 C ATOM 2509 CD LYS A 160 -0.203 16.913 0.431 1.00 0.00 C ATOM 2510 CE LYS A 160 -0.070 17.630 -0.915 1.00 0.00 C ATOM 2511 NZ LYS A 160 -1.383 17.613 -1.625 1.00 0.00 N ATOM 0 H LYS A 160 1.519 14.769 4.401 1.00 0.00 H new ATOM 0 HA LYS A 160 3.101 16.416 2.601 1.00 0.00 H new ATOM 0 HB2 LYS A 160 0.644 15.372 2.416 1.00 0.00 H new ATOM 0 HB3 LYS A 160 0.166 16.859 3.210 1.00 0.00 H new ATOM 0 HG2 LYS A 160 1.189 18.221 1.445 1.00 0.00 H new ATOM 0 HG3 LYS A 160 1.938 16.813 0.719 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -0.349 15.844 0.273 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -1.080 17.279 0.965 1.00 0.00 H new ATOM 0 HE2 LYS A 160 0.257 18.658 -0.760 1.00 0.00 H new ATOM 0 HE3 LYS A 160 0.691 17.142 -1.525 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -1.290 18.101 -2.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -1.678 16.629 -1.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -2.097 18.098 -1.045 1.00 0.00 H new ATOM 2525 N LYS A 161 3.238 18.640 3.732 1.00 0.00 N ATOM 2526 CA LYS A 161 3.376 19.928 4.468 1.00 0.00 C ATOM 2527 C LYS A 161 2.151 20.803 4.195 1.00 0.00 C ATOM 2528 O LYS A 161 1.547 20.731 3.143 1.00 0.00 O ATOM 2529 CB LYS A 161 4.637 20.653 3.994 1.00 0.00 C ATOM 2530 CG LYS A 161 5.874 19.859 4.417 1.00 0.00 C ATOM 2531 CD LYS A 161 6.146 20.089 5.905 1.00 0.00 C ATOM 2532 CE LYS A 161 5.481 18.981 6.727 1.00 0.00 C ATOM 2533 NZ LYS A 161 6.530 18.104 7.319 1.00 0.00 N ATOM 0 H LYS A 161 3.853 18.535 2.925 1.00 0.00 H new ATOM 0 HA LYS A 161 3.451 19.731 5.537 1.00 0.00 H new ATOM 0 HB2 LYS A 161 4.618 20.766 2.910 1.00 0.00 H new ATOM 0 HB3 LYS A 161 4.673 21.656 4.419 1.00 0.00 H new ATOM 0 HG2 LYS A 161 5.721 18.797 4.225 1.00 0.00 H new ATOM 0 HG3 LYS A 161 6.737 20.168 3.827 1.00 0.00 H new ATOM 0 HD2 LYS A 161 7.220 20.099 6.091 1.00 0.00 H new ATOM 0 HD3 LYS A 161 5.761 21.062 6.209 1.00 0.00 H new ATOM 0 HE2 LYS A 161 4.868 19.417 7.516 1.00 0.00 H new ATOM 0 HE3 LYS A 161 4.815 18.394 6.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 161 6.188 17.122 7.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 161 7.392 18.155 6.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 161 6.743 18.422 8.286 1.00 0.00 H new ATOM 2547 N ALA A 162 1.782 21.630 5.137 1.00 0.00 N ATOM 2548 CA ALA A 162 0.597 22.512 4.936 1.00 0.00 C ATOM 2549 C ALA A 162 0.795 23.817 5.710 1.00 0.00 C ATOM 2550 O ALA A 162 1.200 23.746 6.858 1.00 0.00 O ATOM 2551 CB ALA A 162 -0.662 21.801 5.441 1.00 0.00 C ATOM 2552 OXT ALA A 162 0.537 24.865 5.141 1.00 0.00 O ATOM 0 H ALA A 162 2.251 21.732 6.037 1.00 0.00 H new ATOM 0 HA ALA A 162 0.485 22.734 3.875 1.00 0.00 H new ATOM 0 HB1 ALA A 162 -1.528 22.446 5.294 1.00 0.00 H new ATOM 0 HB2 ALA A 162 -0.803 20.873 4.887 1.00 0.00 H new ATOM 0 HB3 ALA A 162 -0.553 21.577 6.502 1.00 0.00 H new TER 2558 ALA A 162 HETATM 2559 PA NDP A 168 -3.514 -3.107 -9.376 1.00 0.00 P HETATM 2560 O1A NDP A 168 -3.554 -4.230 -8.417 1.00 0.00 O HETATM 2561 O2A NDP A 168 -2.913 -1.841 -8.916 1.00 0.00 O HETATM 2562 O5B NDP A 168 -4.939 -2.865 -10.046 1.00 0.00 O HETATM 2563 C5B NDP A 168 -5.889 -1.960 -9.453 1.00 0.00 C HETATM 2564 C4B NDP A 168 -7.286 -2.278 -9.930 1.00 0.00 C HETATM 2565 O4B NDP A 168 -8.254 -1.578 -9.106 1.00 0.00 O HETATM 2566 C3B NDP A 168 -7.615 -1.860 -11.353 1.00 0.00 C HETATM 2567 O3B NDP A 168 -7.196 -2.856 -12.292 1.00 0.00 O HETATM 2568 C2B NDP A 168 -9.134 -1.736 -11.309 1.00 0.00 C HETATM 2569 O2B NDP A 168 -9.806 -2.969 -11.458 1.00 0.00 O HETATM 2570 C1B NDP A 168 -9.355 -1.174 -9.902 1.00 0.00 C HETATM 2571 N9A NDP A 168 -9.431 0.284 -9.860 1.00 0.00 N HETATM 2572 C8A NDP A 168 -8.384 1.170 -9.806 1.00 0.00 C HETATM 2573 N7A NDP A 168 -8.756 2.427 -9.775 1.00 0.00 N HETATM 2574 C5A NDP A 168 -10.142 2.365 -9.809 1.00 0.00 C HETATM 2575 C6A NDP A 168 -11.136 3.362 -9.798 1.00 0.00 C HETATM 2576 N6A NDP A 168 -10.873 4.670 -9.748 1.00 0.00 N HETATM 2577 N1A NDP A 168 -12.428 2.964 -9.840 1.00 0.00 N HETATM 2578 C2A NDP A 168 -12.693 1.652 -9.890 1.00 0.00 C HETATM 2579 N3A NDP A 168 -11.846 0.621 -9.907 1.00 0.00 N HETATM 2580 C4A NDP A 168 -10.572 1.051 -9.863 1.00 0.00 C HETATM 2581 O3 NDP A 168 -2.707 -3.605 -10.725 1.00 0.00 O HETATM 2582 PN NDP A 168 -1.148 -3.519 -11.258 1.00 0.00 P HETATM 2583 O1N NDP A 168 -0.894 -2.145 -11.732 1.00 0.00 O HETATM 2584 O2N NDP A 168 -0.925 -4.623 -12.213 1.00 0.00 O HETATM 2585 O5D NDP A 168 -0.423 -3.798 -9.868 1.00 0.00 O HETATM 2586 C5D NDP A 168 -0.936 -4.783 -8.952 1.00 0.00 C HETATM 2587 C4D NDP A 168 0.184 -5.667 -8.452 1.00 0.00 C HETATM 2588 O4D NDP A 168 1.201 -4.860 -7.801 1.00 0.00 O HETATM 2589 C3D NDP A 168 -0.196 -6.697 -7.401 1.00 0.00 C HETATM 2590 O3D NDP A 168 -0.741 -7.872 -8.010 1.00 0.00 O HETATM 2591 C2D NDP A 168 1.146 -6.989 -6.739 1.00 0.00 C HETATM 2592 O2D NDP A 168 1.944 -7.933 -7.457 1.00 0.00 O HETATM 2593 C1D NDP A 168 1.808 -5.609 -6.760 1.00 0.00 C HETATM 2594 N1N NDP A 168 1.673 -4.861 -5.508 1.00 0.00 N HETATM 2595 C2N NDP A 168 2.589 -4.197 -4.810 1.00 0.00 C HETATM 2596 C3N NDP A 168 2.401 -3.525 -3.717 1.00 0.00 C HETATM 2597 C7N NDP A 168 3.651 -3.016 -3.229 1.00 0.00 C HETATM 2598 O7N NDP A 168 3.320 -2.349 -2.145 1.00 0.00 O HETATM 2599 N7N NDP A 168 4.915 -3.150 -3.703 1.00 0.00 N HETATM 2600 C4N NDP A 168 1.008 -3.467 -3.162 1.00 0.00 C HETATM 2601 C5N NDP A 168 -0.039 -4.167 -3.857 1.00 0.00 C HETATM 2602 C6N NDP A 168 0.205 -4.893 -5.030 1.00 0.00 C HETATM 2603 P2B NDP A 168 -10.929 -3.391 -12.620 1.00 0.00 P HETATM 2604 O1X NDP A 168 -11.807 -4.352 -11.728 1.00 0.00 O HETATM 2605 O2X NDP A 168 -11.653 -2.057 -12.795 1.00 0.00 O HETATM 2606 O3X NDP A 168 -10.054 -4.224 -13.556 1.00 0.00 O HETATM 0 HO3N NDP A 168 -1.122 -8.452 -7.318 1.00 0.00 H new HETATM 0 HO3A NDP A 168 -7.966 -3.401 -12.557 1.00 0.00 H new HETATM 0 HO2N NDP A 168 2.199 -8.667 -6.860 1.00 0.00 H new HETATM 0 H72N NDP A 168 5.693 -2.708 -3.213 1.00 0.00 H new HETATM 0 H71N NDP A 168 5.087 -3.692 -4.549 1.00 0.00 H new HETATM 0 H62A NDP A 168 -11.638 5.344 -9.743 1.00 0.00 H new HETATM 0 H61A NDP A 168 -9.907 4.995 -9.715 1.00 0.00 H new HETATM 0 H52N NDP A 168 -1.422 -4.289 -8.111 1.00 0.00 H new HETATM 0 H52A NDP A 168 -5.843 -2.035 -8.367 1.00 0.00 H new HETATM 0 H51N NDP A 168 -1.694 -5.390 -9.447 1.00 0.00 H new HETATM 0 H51A NDP A 168 -5.634 -0.933 -9.713 1.00 0.00 H new HETATM 0 H42N NDP A 168 1.042 -3.850 -2.142 1.00 0.00 H new HETATM 0 H41N NDP A 168 0.720 -2.418 -3.099 1.00 0.00 H new HETATM 0 H8A NDP A 168 -7.340 0.858 -9.790 1.00 0.00 H new HETATM 0 H6N NDP A 168 -0.577 -5.436 -5.561 1.00 0.00 H new HETATM 0 H5N NDP A 168 -1.053 -4.131 -3.459 1.00 0.00 H new HETATM 0 H4D NDP A 168 0.508 -6.184 -9.355 1.00 0.00 H new HETATM 0 H4B NDP A 168 -7.333 -3.365 -9.870 1.00 0.00 H new HETATM 0 H3D NDP A 168 -0.961 -6.355 -6.704 1.00 0.00 H new HETATM 0 H3B NDP A 168 -7.114 -0.946 -11.671 1.00 0.00 H new HETATM 0 H2N NDP A 168 3.607 -4.220 -5.198 1.00 0.00 H new HETATM 0 H2D NDP A 168 1.031 -7.438 -5.753 1.00 0.00 H new HETATM 0 H2B NDP A 168 -9.524 -1.126 -12.124 1.00 0.00 H new HETATM 0 H2A NDP A 168 -13.750 1.389 -9.921 1.00 0.00 H new HETATM 0 H1D NDP A 168 2.876 -5.763 -6.911 1.00 0.00 H new HETATM 0 H1B NDP A 168 -10.310 -1.555 -9.541 1.00 0.00 H new HETATM 2633 N1 TRR A 170 4.030 -4.726 1.474 1.00 0.00 N HETATM 2634 C2 TRR A 170 3.975 -3.383 1.765 1.00 0.00 C HETATM 2635 N2 TRR A 170 5.045 -2.771 2.380 1.00 0.00 N HETATM 2636 N3 TRR A 170 2.849 -2.652 1.439 1.00 0.00 N HETATM 2637 C4 TRR A 170 1.776 -3.267 0.823 1.00 0.00 C HETATM 2638 N4 TRR A 170 0.654 -2.538 0.499 1.00 0.00 N HETATM 2639 C5 TRR A 170 1.828 -4.620 0.530 1.00 0.00 C HETATM 2640 C6 TRR A 170 2.967 -5.349 0.861 1.00 0.00 C HETATM 2641 C7 TRR A 170 0.652 -5.289 -0.139 1.00 0.00 C HETATM 2642 C11 TRR A 170 0.797 -6.779 -0.251 1.00 0.00 C HETATM 2643 C12 TRR A 170 1.200 -7.345 -1.455 1.00 0.00 C HETATM 2644 C13 TRR A 170 1.339 -8.733 -1.565 1.00 0.00 C HETATM 2645 C14 TRR A 170 1.073 -9.546 -0.466 1.00 0.00 C HETATM 2646 C15 TRR A 170 0.667 -8.981 0.743 1.00 0.00 C HETATM 2647 C16 TRR A 170 0.530 -7.590 0.848 1.00 0.00 C HETATM 2648 O13 TRR A 170 1.741 -9.313 -2.765 1.00 0.00 O HETATM 2649 O14 TRR A 170 1.211 -10.912 -0.576 1.00 0.00 O HETATM 2650 O15 TRR A 170 0.407 -9.806 1.835 1.00 0.00 O HETATM 2651 C17 TRR A 170 2.001 -8.482 -3.867 1.00 0.00 C HETATM 2652 C18 TRR A 170 2.491 -11.460 -0.411 1.00 0.00 C HETATM 2653 C19 TRR A 170 0.007 -9.223 3.050 1.00 0.00 C HETATM 0 H193 TRR A 170 0.784 -8.543 3.400 1.00 0.00 H new HETATM 0 H192 TRR A 170 -0.920 -8.669 2.900 1.00 0.00 H new HETATM 0 H191 TRR A 170 -0.154 -10.004 3.793 1.00 0.00 H new HETATM 0 H183 TRR A 170 3.163 -11.046 -1.163 1.00 0.00 H new HETATM 0 H182 TRR A 170 2.865 -11.217 0.584 1.00 0.00 H new HETATM 0 H181 TRR A 170 2.441 -12.543 -0.525 1.00 0.00 H new HETATM 0 H173 TRR A 170 1.101 -7.922 -4.121 1.00 0.00 H new HETATM 0 H172 TRR A 170 2.802 -7.786 -3.617 1.00 0.00 H new HETATM 0 H171 TRR A 170 2.302 -9.091 -4.719 1.00 0.00 H new HETATM 0 H72 TRR A 170 -0.254 -5.061 0.423 1.00 0.00 H new HETATM 0 H71 TRR A 170 0.523 -4.868 -1.136 1.00 0.00 H new HETATM 0 H6 TRR A 170 3.017 -6.414 0.634 1.00 0.00 H new HETATM 0 H42 TRR A 170 -0.137 -2.994 0.044 1.00 0.00 H new HETATM 0 H41 TRR A 170 0.614 -1.542 0.714 1.00 0.00 H new HETATM 0 H22 TRR A 170 5.007 -1.775 2.597 1.00 0.00 H new HETATM 0 H21 TRR A 170 5.875 -3.314 2.618 1.00 0.00 H new HETATM 0 H16 TRR A 170 0.214 -7.143 1.791 1.00 0.00 H new HETATM 0 H12 TRR A 170 1.408 -6.707 -2.314 1.00 0.00 H new HETATM 0 H1 TRR A 170 4.863 -5.263 1.714 1.00 0.00 H new