USER MOD reduce.3.24.130724 H: found=0, std=0, add=1288, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1286 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 19 LYS NZ :NH3+ -113:sc= 1.38 (180deg=0.194) USER MOD Set 1.2: A 150 TYR OH : rot 180:sc= 0.0166 USER MOD Set 2.1: A 44 TYR OH : rot 8:sc= 0.411 USER MOD Set 2.2: A 121 SER OG : rot 180:sc= -0.0219 USER MOD Set 3.1: A 60 HIS :FLIP no HD1:sc= 0.0613 F(o=-2,f=-1.1) USER MOD Set 3.2: A 80 HIS : no HE2:sc= -0.0947 K(o=-1.1,f=-5.2) USER MOD Set 3.3: A 83 THR OG1 : rot -24:sc= 0.602 USER MOD Set 3.4: A 96 HIS : no HD1:sc= -1.71! C(o=-1.1!,f=-7.9!) USER MOD Set 4.1: A 11 GLN : amide:sc= 0.0696 K(o=0.15,f=-2.5) USER MOD Set 4.2: A 15 ASN : amide:sc= 0.078 K(o=0.15,f=-1.8!) USER MOD Single : A 5 THR OG1 : rot 28:sc= 0.194 USER MOD Single : A 10 THR OG1 : rot 61:sc= 0.486 USER MOD Single : A 13 GLN :FLIP amide:sc= 0 F(o=-0.65,f=0) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 26 HIS : no HD1:sc= -2.82! C(o=-2.8!,f=-6.8!) USER MOD Single : A 28 GLN : amide:sc= -0.0237 X(o=-0.024,f=-0.024) USER MOD Single : A 29 SER OG : rot -18:sc= 1.47 USER MOD Single : A 43 SER OG : rot 39:sc= 0.239 USER MOD Single : A 51 TYR OH : rot -134:sc= 0.0995 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 37:sc= 0.592 USER MOD Single : A 65 SER OG : rot 31:sc= 0.0589 USER MOD Single : A 70 THR OG1 : rot 180:sc= -0.0376 USER MOD Single : A 71 SER OG : rot 180:sc= 0.0114 USER MOD Single : A 75 THR OG1 : rot -128:sc= 0.737 USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 100 GLN : amide:sc= -0.743 X(o=-0.74,f=-0.56) USER MOD Single : A 105 SER OG : rot -40:sc= 0.423 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot -84:sc= 0.0595 USER MOD Single : A 117 THR OG1 : rot 80:sc= 0.145 USER MOD Single : A 119 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 120 GLN : amide:sc= -0.823 K(o=-0.82,f=-2.7) USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 127 TYR OH : rot 149:sc= 0.928 USER MOD Single : A 128 MET CE :methyl -151:sc=-0.00583 (180deg=-1.18) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 ASN : amide:sc= -4.94 K(o=-4.9,f=-6.1!) USER MOD Single : A 151 SER OG : rot -49:sc= 0.103 USER MOD Single : A 154 CYS SG : rot 82:sc= 0.339 USER MOD Single : A 156 TYR OH : rot 67:sc= 0.715 USER MOD Single : A 157 SER OG : rot 72:sc= 0.183 USER MOD Single : A 159 THR OG1 : rot -31:sc= 0.157 USER MOD Single : A 161 SER OG : rot 180:sc= 0 USER MOD Single : A 162 CYS SG : rot 180:sc= 0.0526 USER MOD Single : A 168 SER OG : rot 180:sc= 0 USER MOD Single : A 169 ASN : amide:sc= -3.87! X(o=-3.9!,f=-3.7) USER MOD Single : A 173 THR OG1 : rot 124:sc= 0.243 USER MOD Single : A 176 THR OG1 : rot 35:sc= 0.127 USER MOD ----------------------------------------------------------------- ATOM 59 N THR A 5 -14.328 2.503 -16.841 1.00 2.03 N ATOM 60 CA THR A 5 -14.000 1.620 -15.707 1.00 11.42 C ATOM 61 C THR A 5 -12.704 0.803 -15.964 1.00 71.50 C ATOM 62 O THR A 5 -11.847 0.692 -15.078 1.00 70.41 O ATOM 63 CB THR A 5 -15.193 0.643 -15.428 1.00 14.40 C ATOM 64 OG1 THR A 5 -16.419 1.390 -15.338 1.00 54.35 O ATOM 65 CG2 THR A 5 -15.001 -0.175 -14.134 1.00 14.13 C ATOM 0 HA THR A 5 -13.828 2.253 -14.837 1.00 11.42 H new ATOM 0 HB THR A 5 -15.231 -0.061 -16.259 1.00 14.40 H new ATOM 0 HG1 THR A 5 -16.348 2.201 -15.883 1.00 54.35 H new ATOM 0 HG21 THR A 5 -15.857 -0.835 -13.990 1.00 14.13 H new ATOM 0 HG22 THR A 5 -14.092 -0.771 -14.212 1.00 14.13 H new ATOM 0 HG23 THR A 5 -14.918 0.503 -13.284 1.00 14.13 H new ATOM 73 N GLU A 6 -12.557 0.271 -17.192 1.00 3.54 N ATOM 74 CA GLU A 6 -11.434 -0.618 -17.568 1.00 71.24 C ATOM 75 C GLU A 6 -10.143 0.188 -17.830 1.00 44.42 C ATOM 76 O GLU A 6 -9.079 -0.390 -18.058 1.00 53.40 O ATOM 77 CB GLU A 6 -11.817 -1.460 -18.813 1.00 52.31 C ATOM 78 CG GLU A 6 -11.998 -0.641 -20.109 1.00 11.15 C ATOM 79 CD GLU A 6 -12.645 -1.435 -21.253 1.00 11.22 C ATOM 80 OE1 GLU A 6 -13.890 -1.507 -21.312 1.00 13.24 O ATOM 81 OE2 GLU A 6 -11.916 -1.979 -22.103 1.00 25.54 O ATOM 0 H GLU A 6 -13.212 0.444 -17.954 1.00 3.54 H new ATOM 0 HA GLU A 6 -11.237 -1.291 -16.733 1.00 71.24 H new ATOM 0 HB2 GLU A 6 -11.046 -2.212 -18.978 1.00 52.31 H new ATOM 0 HB3 GLU A 6 -12.744 -1.994 -18.603 1.00 52.31 H new ATOM 0 HG2 GLU A 6 -12.611 0.234 -19.893 1.00 11.15 H new ATOM 0 HG3 GLU A 6 -11.025 -0.275 -20.437 1.00 11.15 H new ATOM 88 N ASP A 7 -10.255 1.525 -17.769 1.00 73.20 N ATOM 89 CA ASP A 7 -9.097 2.438 -17.796 1.00 12.24 C ATOM 90 C ASP A 7 -8.161 2.167 -16.588 1.00 72.14 C ATOM 91 O ASP A 7 -6.941 2.334 -16.682 1.00 44.23 O ATOM 92 CB ASP A 7 -9.586 3.900 -17.808 1.00 24.55 C ATOM 93 CG ASP A 7 -8.447 4.916 -17.957 1.00 12.40 C ATOM 94 OD1 ASP A 7 -7.914 5.057 -19.085 1.00 53.33 O ATOM 95 OD2 ASP A 7 -8.064 5.558 -16.958 1.00 54.44 O ATOM 0 H ASP A 7 -11.152 2.006 -17.699 1.00 73.20 H new ATOM 0 HA ASP A 7 -8.522 2.260 -18.705 1.00 12.24 H new ATOM 0 HB2 ASP A 7 -10.293 4.033 -18.627 1.00 24.55 H new ATOM 0 HB3 ASP A 7 -10.127 4.103 -16.884 1.00 24.55 H new ATOM 100 N TRP A 8 -8.775 1.745 -15.470 1.00 34.45 N ATOM 101 CA TRP A 8 -8.086 1.176 -14.289 1.00 11.32 C ATOM 102 C TRP A 8 -6.989 0.162 -14.678 1.00 53.13 C ATOM 103 O TRP A 8 -5.810 0.396 -14.400 1.00 42.33 O ATOM 104 CB TRP A 8 -9.134 0.509 -13.367 1.00 12.21 C ATOM 105 CG TRP A 8 -8.598 -0.132 -12.101 1.00 74.32 C ATOM 106 CD1 TRP A 8 -7.912 0.479 -11.084 1.00 15.43 C ATOM 107 CD2 TRP A 8 -8.731 -1.512 -11.711 1.00 60.32 C ATOM 108 NE1 TRP A 8 -7.647 -0.423 -10.089 1.00 1.12 N ATOM 109 CE2 TRP A 8 -8.129 -1.650 -10.453 1.00 44.31 C ATOM 110 CE3 TRP A 8 -9.305 -2.642 -12.306 1.00 23.54 C ATOM 111 CZ2 TRP A 8 -8.093 -2.861 -9.771 1.00 73.13 C ATOM 112 CZ3 TRP A 8 -9.266 -3.847 -11.629 1.00 12.31 C ATOM 113 CH2 TRP A 8 -8.664 -3.945 -10.373 1.00 71.34 C ATOM 0 H TRP A 8 -9.788 1.789 -15.355 1.00 34.45 H new ATOM 0 HA TRP A 8 -7.586 1.990 -13.764 1.00 11.32 H new ATOM 0 HB2 TRP A 8 -9.871 1.261 -13.085 1.00 12.21 H new ATOM 0 HB3 TRP A 8 -9.660 -0.254 -13.941 1.00 12.21 H new ATOM 0 HD1 TRP A 8 -7.623 1.519 -11.070 1.00 15.43 H new ATOM 0 HE1 TRP A 8 -7.166 -0.213 -9.214 1.00 1.12 H new ATOM 0 HE3 TRP A 8 -9.771 -2.574 -13.278 1.00 23.54 H new ATOM 0 HZ2 TRP A 8 -7.629 -2.941 -8.799 1.00 73.13 H new ATOM 0 HZ3 TRP A 8 -9.707 -4.725 -12.078 1.00 12.31 H new ATOM 0 HH2 TRP A 8 -8.650 -4.899 -9.867 1.00 71.34 H new ATOM 124 N GLU A 9 -7.385 -0.929 -15.384 1.00 11.21 N ATOM 125 CA GLU A 9 -6.455 -2.024 -15.751 1.00 24.23 C ATOM 126 C GLU A 9 -5.466 -1.589 -16.859 1.00 42.41 C ATOM 127 O GLU A 9 -4.411 -2.215 -17.030 1.00 12.10 O ATOM 128 CB GLU A 9 -7.221 -3.306 -16.191 1.00 43.43 C ATOM 129 CG GLU A 9 -7.943 -3.194 -17.548 1.00 24.31 C ATOM 130 CD GLU A 9 -8.643 -4.485 -17.981 1.00 70.45 C ATOM 131 OE1 GLU A 9 -9.787 -4.715 -17.556 1.00 30.34 O ATOM 132 OE2 GLU A 9 -8.048 -5.280 -18.745 1.00 73.00 O ATOM 0 H GLU A 9 -8.341 -1.072 -15.709 1.00 11.21 H new ATOM 0 HA GLU A 9 -5.882 -2.258 -14.854 1.00 24.23 H new ATOM 0 HB2 GLU A 9 -6.515 -4.136 -16.238 1.00 43.43 H new ATOM 0 HB3 GLU A 9 -7.955 -3.555 -15.424 1.00 43.43 H new ATOM 0 HG2 GLU A 9 -8.680 -2.393 -17.492 1.00 24.31 H new ATOM 0 HG3 GLU A 9 -7.220 -2.909 -18.312 1.00 24.31 H new ATOM 139 N THR A 10 -5.809 -0.491 -17.574 1.00 61.12 N ATOM 140 CA THR A 10 -5.009 0.042 -18.685 1.00 11.43 C ATOM 141 C THR A 10 -3.659 0.579 -18.180 1.00 15.23 C ATOM 142 O THR A 10 -2.612 0.232 -18.731 1.00 74.21 O ATOM 143 CB THR A 10 -5.798 1.161 -19.442 1.00 24.52 C ATOM 144 OG1 THR A 10 -7.074 0.650 -19.873 1.00 55.10 O ATOM 145 CG2 THR A 10 -5.041 1.710 -20.665 1.00 41.51 C ATOM 0 H THR A 10 -6.655 0.048 -17.389 1.00 61.12 H new ATOM 0 HA THR A 10 -4.810 -0.772 -19.382 1.00 11.43 H new ATOM 0 HB THR A 10 -5.925 1.984 -18.739 1.00 24.52 H new ATOM 0 HG1 THR A 10 -7.594 0.367 -19.092 1.00 55.10 H new ATOM 0 HG21 THR A 10 -5.640 2.482 -21.147 1.00 41.51 H new ATOM 0 HG22 THR A 10 -4.090 2.136 -20.344 1.00 41.51 H new ATOM 0 HG23 THR A 10 -4.856 0.901 -21.371 1.00 41.51 H new ATOM 153 N GLN A 11 -3.682 1.439 -17.133 1.00 71.35 N ATOM 154 CA GLN A 11 -2.444 1.856 -16.448 1.00 62.22 C ATOM 155 C GLN A 11 -1.879 0.708 -15.590 1.00 2.13 C ATOM 156 O GLN A 11 -0.667 0.493 -15.569 1.00 30.42 O ATOM 157 CB GLN A 11 -2.658 3.120 -15.565 1.00 64.22 C ATOM 158 CG GLN A 11 -3.656 2.962 -14.392 1.00 42.43 C ATOM 159 CD GLN A 11 -3.594 4.112 -13.380 1.00 32.03 C ATOM 160 OE1 GLN A 11 -2.549 4.729 -13.181 1.00 64.43 O ATOM 161 NE2 GLN A 11 -4.698 4.392 -12.715 1.00 63.14 N ATOM 0 H GLN A 11 -4.534 1.850 -16.752 1.00 71.35 H new ATOM 0 HA GLN A 11 -1.725 2.111 -17.226 1.00 62.22 H new ATOM 0 HB2 GLN A 11 -1.693 3.423 -15.158 1.00 64.22 H new ATOM 0 HB3 GLN A 11 -3.004 3.932 -16.204 1.00 64.22 H new ATOM 0 HG2 GLN A 11 -4.668 2.894 -14.792 1.00 42.43 H new ATOM 0 HG3 GLN A 11 -3.454 2.023 -13.877 1.00 42.43 H new ATOM 0 HE21 GLN A 11 -5.552 3.865 -12.899 1.00 63.14 H new ATOM 0 HE22 GLN A 11 -4.698 5.135 -12.017 1.00 63.14 H new ATOM 170 N LEU A 12 -2.788 -0.056 -14.945 1.00 5.05 N ATOM 171 CA LEU A 12 -2.448 -1.025 -13.886 1.00 23.12 C ATOM 172 C LEU A 12 -1.554 -2.167 -14.375 1.00 24.30 C ATOM 173 O LEU A 12 -0.758 -2.688 -13.594 1.00 24.12 O ATOM 174 CB LEU A 12 -3.735 -1.586 -13.249 1.00 60.35 C ATOM 175 CG LEU A 12 -3.561 -2.615 -12.092 1.00 51.42 C ATOM 176 CD1 LEU A 12 -2.697 -2.046 -10.947 1.00 72.42 C ATOM 177 CD2 LEU A 12 -4.930 -3.102 -11.591 1.00 52.13 C ATOM 0 H LEU A 12 -3.787 -0.015 -15.149 1.00 5.05 H new ATOM 0 HA LEU A 12 -1.871 -0.482 -13.138 1.00 23.12 H new ATOM 0 HB2 LEU A 12 -4.320 -0.747 -12.871 1.00 60.35 H new ATOM 0 HB3 LEU A 12 -4.325 -2.057 -14.035 1.00 60.35 H new ATOM 0 HG LEU A 12 -3.025 -3.478 -12.486 1.00 51.42 H new ATOM 0 HD11 LEU A 12 -2.599 -2.793 -10.159 1.00 72.42 H new ATOM 0 HD12 LEU A 12 -1.709 -1.790 -11.329 1.00 72.42 H new ATOM 0 HD13 LEU A 12 -3.172 -1.152 -10.542 1.00 72.42 H new ATOM 0 HD21 LEU A 12 -4.788 -3.820 -10.783 1.00 52.13 H new ATOM 0 HD22 LEU A 12 -5.506 -2.253 -11.224 1.00 52.13 H new ATOM 0 HD23 LEU A 12 -5.468 -3.579 -12.410 1.00 52.13 H new ATOM 189 N GLN A 13 -1.671 -2.535 -15.665 1.00 10.51 N ATOM 190 CA GLN A 13 -0.805 -3.564 -16.280 1.00 31.25 C ATOM 191 C GLN A 13 0.690 -3.211 -16.102 1.00 23.34 C ATOM 192 O GLN A 13 1.515 -4.089 -15.898 1.00 65.11 O ATOM 193 CB GLN A 13 -1.153 -3.732 -17.782 1.00 23.51 C ATOM 194 CG GLN A 13 -0.936 -2.470 -18.641 1.00 72.54 C ATOM 195 CD GLN A 13 -1.421 -2.589 -20.087 1.00 5.22 C ATOM 196 OE1 GLN A 13 -2.508 -3.318 -20.319 1.00 75.14 O flip ATOM 197 NE2 GLN A 13 -0.844 -1.994 -20.997 1.00 44.12 N flip ATOM 0 H GLN A 13 -2.358 -2.135 -16.304 1.00 10.51 H new ATOM 0 HA GLN A 13 -0.987 -4.511 -15.772 1.00 31.25 H new ATOM 0 HB2 GLN A 13 -0.549 -4.542 -18.192 1.00 23.51 H new ATOM 0 HB3 GLN A 13 -2.196 -4.037 -17.867 1.00 23.51 H new ATOM 0 HG2 GLN A 13 -1.449 -1.633 -18.168 1.00 72.54 H new ATOM 0 HG3 GLN A 13 0.127 -2.230 -18.647 1.00 72.54 H new ATOM 0 HE21 GLN A 13 -0.011 -1.440 -20.797 1.00 44.12 H new ATOM 0 HE22 GLN A 13 -1.199 -2.055 -21.951 1.00 44.12 H new ATOM 206 N ALA A 14 0.991 -1.898 -16.134 1.00 31.23 N ATOM 207 CA ALA A 14 2.340 -1.353 -15.942 1.00 64.13 C ATOM 208 C ALA A 14 2.607 -1.051 -14.450 1.00 4.51 C ATOM 209 O ALA A 14 3.692 -1.349 -13.940 1.00 64.00 O ATOM 210 CB ALA A 14 2.495 -0.086 -16.801 1.00 70.42 C ATOM 0 H ALA A 14 0.288 -1.178 -16.297 1.00 31.23 H new ATOM 0 HA ALA A 14 3.077 -2.092 -16.257 1.00 64.13 H new ATOM 0 HB1 ALA A 14 3.495 0.326 -16.665 1.00 70.42 H new ATOM 0 HB2 ALA A 14 2.346 -0.338 -17.851 1.00 70.42 H new ATOM 0 HB3 ALA A 14 1.754 0.653 -16.497 1.00 70.42 H new ATOM 216 N ASN A 15 1.585 -0.478 -13.758 1.00 51.30 N ATOM 217 CA ASN A 15 1.673 -0.063 -12.327 1.00 25.51 C ATOM 218 C ASN A 15 1.993 -1.243 -11.386 1.00 45.41 C ATOM 219 O ASN A 15 2.682 -1.075 -10.375 1.00 40.43 O ATOM 220 CB ASN A 15 0.357 0.633 -11.853 1.00 0.02 C ATOM 221 CG ASN A 15 0.079 1.993 -12.520 1.00 14.31 C ATOM 222 OD1 ASN A 15 0.433 2.225 -13.674 1.00 31.13 O ATOM 223 ND2 ASN A 15 -0.544 2.910 -11.795 1.00 45.24 N ATOM 0 H ASN A 15 0.674 -0.290 -14.176 1.00 51.30 H new ATOM 0 HA ASN A 15 2.498 0.647 -12.273 1.00 25.51 H new ATOM 0 HB2 ASN A 15 -0.483 -0.033 -12.051 1.00 0.02 H new ATOM 0 HB3 ASN A 15 0.404 0.775 -10.773 1.00 0.02 H new ATOM 0 HD21 ASN A 15 -0.738 3.829 -12.193 1.00 45.24 H new ATOM 0 HD22 ASN A 15 -0.829 2.697 -10.839 1.00 45.24 H new ATOM 230 N ARG A 16 1.481 -2.441 -11.717 1.00 75.31 N ATOM 231 CA ARG A 16 1.755 -3.658 -10.933 1.00 54.34 C ATOM 232 C ARG A 16 3.071 -4.295 -11.399 1.00 52.20 C ATOM 233 O ARG A 16 3.821 -4.834 -10.588 1.00 1.54 O ATOM 234 CB ARG A 16 0.584 -4.680 -11.046 1.00 5.25 C ATOM 235 CG ARG A 16 0.447 -5.395 -12.411 1.00 51.12 C ATOM 236 CD ARG A 16 -0.725 -6.390 -12.437 1.00 3.22 C ATOM 237 NE ARG A 16 -0.623 -7.397 -11.363 1.00 50.22 N ATOM 238 CZ ARG A 16 -1.435 -8.461 -11.203 1.00 21.24 C ATOM 239 NH1 ARG A 16 -2.432 -8.704 -12.052 1.00 64.40 N ATOM 240 NH2 ARG A 16 -1.273 -9.257 -10.160 1.00 55.11 N ATOM 0 H ARG A 16 0.875 -2.593 -12.523 1.00 75.31 H new ATOM 0 HA ARG A 16 1.847 -3.375 -9.884 1.00 54.34 H new ATOM 0 HB2 ARG A 16 0.710 -5.436 -10.271 1.00 5.25 H new ATOM 0 HB3 ARG A 16 -0.350 -4.159 -10.834 1.00 5.25 H new ATOM 0 HG2 ARG A 16 0.306 -4.651 -13.195 1.00 51.12 H new ATOM 0 HG3 ARG A 16 1.374 -5.923 -12.636 1.00 51.12 H new ATOM 0 HD2 ARG A 16 -1.664 -5.846 -12.335 1.00 3.22 H new ATOM 0 HD3 ARG A 16 -0.751 -6.893 -13.404 1.00 3.22 H new ATOM 0 HE ARG A 16 0.127 -7.277 -10.682 1.00 50.22 H new ATOM 0 HH11 ARG A 16 -2.593 -8.079 -12.842 1.00 64.40 H new ATOM 0 HH12 ARG A 16 -3.035 -9.515 -11.912 1.00 64.40 H new ATOM 0 HH21 ARG A 16 -0.536 -9.065 -9.481 1.00 55.11 H new ATOM 0 HH22 ARG A 16 -1.885 -10.063 -10.034 1.00 55.11 H new ATOM 254 N ASP A 17 3.353 -4.163 -12.714 1.00 63.34 N ATOM 255 CA ASP A 17 4.489 -4.822 -13.385 1.00 24.21 C ATOM 256 C ASP A 17 5.824 -4.307 -12.851 1.00 11.23 C ATOM 257 O ASP A 17 6.760 -5.085 -12.691 1.00 33.41 O ATOM 258 CB ASP A 17 4.399 -4.605 -14.918 1.00 52.40 C ATOM 259 CG ASP A 17 5.541 -5.277 -15.706 1.00 50.55 C ATOM 260 OD1 ASP A 17 5.468 -6.500 -15.956 1.00 34.43 O ATOM 261 OD2 ASP A 17 6.512 -4.586 -16.089 1.00 75.15 O ATOM 0 H ASP A 17 2.791 -3.590 -13.343 1.00 63.34 H new ATOM 0 HA ASP A 17 4.436 -5.890 -13.173 1.00 24.21 H new ATOM 0 HB2 ASP A 17 3.445 -4.993 -15.276 1.00 52.40 H new ATOM 0 HB3 ASP A 17 4.406 -3.535 -15.126 1.00 52.40 H new ATOM 266 N GLU A 18 5.887 -2.986 -12.574 1.00 51.41 N ATOM 267 CA GLU A 18 7.076 -2.331 -11.990 1.00 72.42 C ATOM 268 C GLU A 18 7.387 -2.865 -10.580 1.00 24.11 C ATOM 269 O GLU A 18 8.541 -2.854 -10.151 1.00 73.13 O ATOM 270 CB GLU A 18 6.891 -0.787 -11.972 1.00 24.31 C ATOM 271 CG GLU A 18 5.616 -0.307 -11.257 1.00 5.02 C ATOM 272 CD GLU A 18 5.453 1.219 -11.232 1.00 3.31 C ATOM 273 OE1 GLU A 18 5.281 1.829 -12.310 1.00 54.22 O ATOM 274 OE2 GLU A 18 5.495 1.822 -10.140 1.00 22.12 O ATOM 0 H GLU A 18 5.114 -2.344 -12.750 1.00 51.41 H new ATOM 0 HA GLU A 18 7.932 -2.571 -12.621 1.00 72.42 H new ATOM 0 HB2 GLU A 18 7.756 -0.335 -11.487 1.00 24.31 H new ATOM 0 HB3 GLU A 18 6.875 -0.423 -12.999 1.00 24.31 H new ATOM 0 HG2 GLU A 18 4.748 -0.747 -11.748 1.00 5.02 H new ATOM 0 HG3 GLU A 18 5.624 -0.678 -10.232 1.00 5.02 H new ATOM 281 N LYS A 19 6.345 -3.352 -9.885 1.00 71.40 N ATOM 282 CA LYS A 19 6.453 -3.876 -8.515 1.00 14.12 C ATOM 283 C LYS A 19 6.795 -5.378 -8.530 1.00 73.34 C ATOM 284 O LYS A 19 7.552 -5.856 -7.676 1.00 62.23 O ATOM 285 CB LYS A 19 5.131 -3.603 -7.745 1.00 24.11 C ATOM 286 CG LYS A 19 4.718 -2.107 -7.719 1.00 31.10 C ATOM 287 CD LYS A 19 5.775 -1.207 -7.032 1.00 2.53 C ATOM 288 CE LYS A 19 5.454 0.294 -7.138 1.00 4.15 C ATOM 289 NZ LYS A 19 4.210 0.677 -6.419 1.00 21.13 N ATOM 0 H LYS A 19 5.398 -3.393 -10.262 1.00 71.40 H new ATOM 0 HA LYS A 19 7.265 -3.364 -7.999 1.00 14.12 H new ATOM 0 HB2 LYS A 19 4.329 -4.184 -8.201 1.00 24.11 H new ATOM 0 HB3 LYS A 19 5.238 -3.958 -6.720 1.00 24.11 H new ATOM 0 HG2 LYS A 19 4.560 -1.760 -8.740 1.00 31.10 H new ATOM 0 HG3 LYS A 19 3.766 -2.006 -7.197 1.00 31.10 H new ATOM 0 HD2 LYS A 19 5.849 -1.483 -5.980 1.00 2.53 H new ATOM 0 HD3 LYS A 19 6.750 -1.396 -7.480 1.00 2.53 H new ATOM 0 HE2 LYS A 19 6.290 0.867 -6.737 1.00 4.15 H new ATOM 0 HE3 LYS A 19 5.357 0.565 -8.189 1.00 4.15 H new ATOM 0 HZ1 LYS A 19 3.489 0.975 -7.107 1.00 21.13 H new ATOM 0 HZ2 LYS A 19 3.857 -0.138 -5.878 1.00 21.13 H new ATOM 0 HZ3 LYS A 19 4.413 1.462 -5.768 1.00 21.13 H new ATOM 303 N ASP A 20 6.265 -6.102 -9.532 1.00 10.13 N ATOM 304 CA ASP A 20 6.550 -7.537 -9.730 1.00 60.44 C ATOM 305 C ASP A 20 7.994 -7.722 -10.251 1.00 41.42 C ATOM 306 O ASP A 20 8.674 -8.697 -9.902 1.00 14.01 O ATOM 307 CB ASP A 20 5.519 -8.166 -10.710 1.00 22.43 C ATOM 308 CG ASP A 20 4.065 -8.137 -10.188 1.00 51.34 C ATOM 309 OD1 ASP A 20 3.831 -8.584 -9.043 1.00 23.02 O ATOM 310 OD2 ASP A 20 3.148 -7.680 -10.912 1.00 11.52 O ATOM 0 H ASP A 20 5.628 -5.711 -10.227 1.00 10.13 H new ATOM 0 HA ASP A 20 6.460 -8.051 -8.773 1.00 60.44 H new ATOM 0 HB2 ASP A 20 5.565 -7.635 -11.661 1.00 22.43 H new ATOM 0 HB3 ASP A 20 5.804 -9.199 -10.908 1.00 22.43 H new ATOM 315 N ARG A 21 8.462 -6.752 -11.069 1.00 34.41 N ATOM 316 CA ARG A 21 9.842 -6.746 -11.592 1.00 44.14 C ATOM 317 C ARG A 21 10.785 -6.024 -10.626 1.00 23.20 C ATOM 318 O ARG A 21 11.989 -6.046 -10.831 1.00 41.23 O ATOM 319 CB ARG A 21 9.935 -6.084 -12.998 1.00 64.32 C ATOM 320 CG ARG A 21 9.882 -4.545 -12.998 1.00 31.44 C ATOM 321 CD ARG A 21 10.123 -3.942 -14.385 1.00 53.42 C ATOM 322 NE ARG A 21 11.477 -4.223 -14.901 1.00 74.34 N ATOM 323 CZ ARG A 21 12.426 -3.301 -15.157 1.00 73.13 C ATOM 324 NH1 ARG A 21 12.202 -1.995 -14.949 1.00 5.42 N ATOM 325 NH2 ARG A 21 13.591 -3.697 -15.643 1.00 74.41 N ATOM 0 H ARG A 21 7.899 -5.961 -11.381 1.00 34.41 H new ATOM 0 HA ARG A 21 10.145 -7.789 -11.688 1.00 44.14 H new ATOM 0 HB2 ARG A 21 10.865 -6.400 -13.471 1.00 64.32 H new ATOM 0 HB3 ARG A 21 9.119 -6.461 -13.615 1.00 64.32 H new ATOM 0 HG2 ARG A 21 8.909 -4.220 -12.630 1.00 31.44 H new ATOM 0 HG3 ARG A 21 10.630 -4.160 -12.305 1.00 31.44 H new ATOM 0 HD2 ARG A 21 9.384 -4.337 -15.082 1.00 53.42 H new ATOM 0 HD3 ARG A 21 9.973 -2.863 -14.339 1.00 53.42 H new ATOM 0 HE ARG A 21 11.715 -5.199 -15.079 1.00 74.34 H new ATOM 0 HH11 ARG A 21 11.299 -1.683 -14.590 1.00 5.42 H new ATOM 0 HH12 ARG A 21 12.934 -1.314 -15.149 1.00 5.42 H new ATOM 0 HH21 ARG A 21 13.760 -4.687 -15.818 1.00 74.41 H new ATOM 0 HH22 ARG A 21 14.320 -3.012 -15.842 1.00 74.41 H new ATOM 339 N PHE A 22 10.230 -5.328 -9.612 1.00 15.35 N ATOM 340 CA PHE A 22 11.042 -4.722 -8.543 1.00 2.14 C ATOM 341 C PHE A 22 11.826 -5.817 -7.805 1.00 4.23 C ATOM 342 O PHE A 22 13.035 -5.730 -7.649 1.00 73.33 O ATOM 343 CB PHE A 22 10.161 -3.923 -7.541 1.00 75.15 C ATOM 344 CG PHE A 22 10.963 -3.032 -6.593 1.00 23.02 C ATOM 345 CD1 PHE A 22 11.495 -3.531 -5.397 1.00 31.21 C ATOM 346 CD2 PHE A 22 11.199 -1.695 -6.912 1.00 54.54 C ATOM 347 CE1 PHE A 22 12.234 -2.721 -4.561 1.00 42.32 C ATOM 348 CE2 PHE A 22 11.939 -0.888 -6.074 1.00 60.32 C ATOM 349 CZ PHE A 22 12.456 -1.400 -4.901 1.00 22.53 C ATOM 0 H PHE A 22 9.227 -5.174 -9.514 1.00 15.35 H new ATOM 0 HA PHE A 22 11.739 -4.021 -9.001 1.00 2.14 H new ATOM 0 HB2 PHE A 22 9.460 -3.304 -8.101 1.00 75.15 H new ATOM 0 HB3 PHE A 22 9.569 -4.624 -6.953 1.00 75.15 H new ATOM 0 HD1 PHE A 22 11.324 -4.563 -5.127 1.00 31.21 H new ATOM 0 HD2 PHE A 22 10.797 -1.286 -7.827 1.00 54.54 H new ATOM 0 HE1 PHE A 22 12.639 -3.118 -3.642 1.00 42.32 H new ATOM 0 HE2 PHE A 22 12.114 0.145 -6.335 1.00 60.32 H new ATOM 0 HZ PHE A 22 13.036 -0.766 -4.247 1.00 22.53 H new ATOM 359 N PHE A 23 11.102 -6.863 -7.394 1.00 21.13 N ATOM 360 CA PHE A 23 11.676 -8.008 -6.667 1.00 31.02 C ATOM 361 C PHE A 23 12.458 -8.944 -7.616 1.00 53.43 C ATOM 362 O PHE A 23 13.267 -9.738 -7.153 1.00 15.41 O ATOM 363 CB PHE A 23 10.544 -8.787 -5.931 1.00 43.22 C ATOM 364 CG PHE A 23 9.921 -8.045 -4.732 1.00 62.52 C ATOM 365 CD1 PHE A 23 9.269 -6.818 -4.892 1.00 31.11 C ATOM 366 CD2 PHE A 23 9.992 -8.579 -3.442 1.00 73.10 C ATOM 367 CE1 PHE A 23 8.710 -6.158 -3.808 1.00 74.50 C ATOM 368 CE2 PHE A 23 9.433 -7.917 -2.360 1.00 13.14 C ATOM 369 CZ PHE A 23 8.796 -6.707 -2.543 1.00 32.11 C ATOM 0 H PHE A 23 10.098 -6.943 -7.555 1.00 21.13 H new ATOM 0 HA PHE A 23 12.383 -7.628 -5.930 1.00 31.02 H new ATOM 0 HB2 PHE A 23 9.755 -9.016 -6.648 1.00 43.22 H new ATOM 0 HB3 PHE A 23 10.945 -9.739 -5.582 1.00 43.22 H new ATOM 0 HD1 PHE A 23 9.200 -6.377 -5.876 1.00 31.11 H new ATOM 0 HD2 PHE A 23 10.491 -9.524 -3.286 1.00 73.10 H new ATOM 0 HE1 PHE A 23 8.207 -5.213 -3.953 1.00 74.50 H new ATOM 0 HE2 PHE A 23 9.496 -8.349 -1.372 1.00 13.14 H new ATOM 0 HZ PHE A 23 8.365 -6.190 -1.699 1.00 32.11 H new ATOM 379 N SER A 24 12.253 -8.814 -8.939 1.00 0.03 N ATOM 380 CA SER A 24 12.814 -9.750 -9.936 1.00 3.41 C ATOM 381 C SER A 24 14.053 -9.161 -10.651 1.00 31.42 C ATOM 382 O SER A 24 15.007 -9.888 -10.946 1.00 34.20 O ATOM 383 CB SER A 24 11.711 -10.112 -10.962 1.00 32.20 C ATOM 384 OG SER A 24 12.140 -11.121 -11.861 1.00 54.02 O ATOM 0 H SER A 24 11.697 -8.063 -9.348 1.00 0.03 H new ATOM 0 HA SER A 24 13.149 -10.649 -9.418 1.00 3.41 H new ATOM 0 HB2 SER A 24 10.820 -10.451 -10.434 1.00 32.20 H new ATOM 0 HB3 SER A 24 11.430 -9.221 -11.523 1.00 32.20 H new ATOM 0 HG SER A 24 11.419 -11.325 -12.492 1.00 54.02 H new ATOM 390 N GLU A 25 14.048 -7.837 -10.901 1.00 32.42 N ATOM 391 CA GLU A 25 15.019 -7.176 -11.812 1.00 41.02 C ATOM 392 C GLU A 25 15.761 -6.036 -11.091 1.00 51.32 C ATOM 393 O GLU A 25 16.996 -5.968 -11.150 1.00 61.13 O ATOM 394 CB GLU A 25 14.306 -6.622 -13.089 1.00 21.11 C ATOM 395 CG GLU A 25 13.532 -7.675 -13.923 1.00 50.44 C ATOM 396 CD GLU A 25 13.072 -7.164 -15.296 1.00 45.30 C ATOM 397 OE1 GLU A 25 13.914 -6.651 -16.067 1.00 70.14 O ATOM 398 OE2 GLU A 25 11.864 -7.244 -15.607 1.00 23.13 O ATOM 0 H GLU A 25 13.377 -7.193 -10.482 1.00 32.42 H new ATOM 0 HA GLU A 25 15.745 -7.929 -12.119 1.00 41.02 H new ATOM 0 HB2 GLU A 25 13.610 -5.839 -12.786 1.00 21.11 H new ATOM 0 HB3 GLU A 25 15.054 -6.154 -13.729 1.00 21.11 H new ATOM 0 HG2 GLU A 25 14.167 -8.550 -14.066 1.00 50.44 H new ATOM 0 HG3 GLU A 25 12.660 -8.003 -13.357 1.00 50.44 H new ATOM 405 N HIS A 26 14.994 -5.145 -10.422 1.00 73.03 N ATOM 406 CA HIS A 26 15.553 -3.948 -9.748 1.00 10.32 C ATOM 407 C HIS A 26 16.449 -4.383 -8.560 1.00 53.32 C ATOM 408 O HIS A 26 17.668 -4.166 -8.558 1.00 71.52 O ATOM 409 CB HIS A 26 14.386 -3.021 -9.287 1.00 34.12 C ATOM 410 CG HIS A 26 14.811 -1.751 -8.581 1.00 21.00 C ATOM 411 ND1 HIS A 26 15.193 -1.768 -7.268 1.00 35.20 N ATOM 412 CD2 HIS A 26 14.891 -0.474 -9.035 1.00 72.24 C ATOM 413 CE1 HIS A 26 15.494 -0.527 -6.948 1.00 11.31 C ATOM 414 NE2 HIS A 26 15.326 0.299 -7.987 1.00 13.25 N ATOM 0 H HIS A 26 13.982 -5.232 -10.334 1.00 73.03 H new ATOM 0 HA HIS A 26 16.177 -3.385 -10.441 1.00 10.32 H new ATOM 0 HB2 HIS A 26 13.792 -2.751 -10.160 1.00 34.12 H new ATOM 0 HB3 HIS A 26 13.735 -3.587 -8.621 1.00 34.12 H new ATOM 0 HD2 HIS A 26 14.657 -0.131 -10.032 1.00 72.24 H new ATOM 0 HE1 HIS A 26 15.833 -0.215 -5.971 1.00 11.31 H new ATOM 0 HE2 HIS A 26 15.489 1.306 -7.998 1.00 13.25 H new ATOM 422 N ARG A 27 15.825 -5.028 -7.575 1.00 11.50 N ATOM 423 CA ARG A 27 16.501 -5.657 -6.424 1.00 13.35 C ATOM 424 C ARG A 27 16.284 -7.169 -6.489 1.00 23.55 C ATOM 425 O ARG A 27 15.313 -7.638 -7.090 1.00 74.02 O ATOM 426 CB ARG A 27 15.965 -5.100 -5.072 1.00 12.35 C ATOM 427 CG ARG A 27 16.232 -3.600 -4.841 1.00 43.24 C ATOM 428 CD ARG A 27 17.734 -3.248 -4.853 1.00 1.34 C ATOM 429 NE ARG A 27 18.469 -3.857 -3.724 1.00 74.13 N ATOM 430 CZ ARG A 27 19.776 -3.666 -3.452 1.00 42.22 C ATOM 431 NH1 ARG A 27 20.529 -2.880 -4.221 1.00 3.21 N ATOM 432 NH2 ARG A 27 20.321 -4.259 -2.399 1.00 44.05 N ATOM 0 H ARG A 27 14.811 -5.134 -7.548 1.00 11.50 H new ATOM 0 HA ARG A 27 17.565 -5.426 -6.475 1.00 13.35 H new ATOM 0 HB2 ARG A 27 14.890 -5.275 -5.023 1.00 12.35 H new ATOM 0 HB3 ARG A 27 16.417 -5.665 -4.257 1.00 12.35 H new ATOM 0 HG2 ARG A 27 15.723 -3.023 -5.613 1.00 43.24 H new ATOM 0 HG3 ARG A 27 15.802 -3.303 -3.884 1.00 43.24 H new ATOM 0 HD2 ARG A 27 18.175 -3.583 -5.792 1.00 1.34 H new ATOM 0 HD3 ARG A 27 17.850 -2.165 -4.815 1.00 1.34 H new ATOM 0 HE ARG A 27 17.945 -4.471 -3.100 1.00 74.13 H new ATOM 0 HH11 ARG A 27 20.118 -2.412 -5.029 1.00 3.21 H new ATOM 0 HH12 ARG A 27 21.516 -2.746 -4.001 1.00 3.21 H new ATOM 0 HH21 ARG A 27 19.752 -4.856 -1.799 1.00 44.05 H new ATOM 0 HH22 ARG A 27 21.309 -4.118 -2.189 1.00 44.05 H new ATOM 446 N GLN A 28 17.225 -7.932 -5.913 1.00 73.31 N ATOM 447 CA GLN A 28 17.010 -9.360 -5.643 1.00 22.30 C ATOM 448 C GLN A 28 16.006 -9.470 -4.482 1.00 25.02 C ATOM 449 O GLN A 28 16.142 -8.733 -3.492 1.00 44.51 O ATOM 450 CB GLN A 28 18.346 -10.068 -5.297 1.00 74.23 C ATOM 451 CG GLN A 28 19.460 -9.890 -6.348 1.00 74.54 C ATOM 452 CD GLN A 28 19.080 -10.397 -7.740 1.00 15.32 C ATOM 453 OE1 GLN A 28 19.295 -11.566 -8.075 1.00 12.01 O ATOM 454 NE2 GLN A 28 18.525 -9.525 -8.568 1.00 21.41 N ATOM 0 H GLN A 28 18.140 -7.584 -5.626 1.00 73.31 H new ATOM 0 HA GLN A 28 16.613 -9.856 -6.529 1.00 22.30 H new ATOM 0 HB2 GLN A 28 18.705 -9.690 -4.340 1.00 74.23 H new ATOM 0 HB3 GLN A 28 18.154 -11.133 -5.167 1.00 74.23 H new ATOM 0 HG2 GLN A 28 19.719 -8.833 -6.414 1.00 74.54 H new ATOM 0 HG3 GLN A 28 20.353 -10.416 -6.011 1.00 74.54 H new ATOM 0 HE21 GLN A 28 18.360 -8.566 -8.263 1.00 21.41 H new ATOM 0 HE22 GLN A 28 18.263 -9.813 -9.511 1.00 21.41 H new ATOM 463 N SER A 29 15.000 -10.351 -4.635 1.00 61.32 N ATOM 464 CA SER A 29 13.858 -10.467 -3.711 1.00 61.33 C ATOM 465 C SER A 29 14.282 -10.603 -2.222 1.00 14.24 C ATOM 466 O SER A 29 15.092 -11.481 -1.903 1.00 35.31 O ATOM 467 CB SER A 29 13.012 -11.702 -4.097 1.00 2.41 C ATOM 468 OG SER A 29 12.668 -11.717 -5.467 1.00 52.34 O ATOM 0 H SER A 29 14.957 -11.009 -5.413 1.00 61.32 H new ATOM 0 HA SER A 29 13.286 -9.544 -3.804 1.00 61.33 H new ATOM 0 HB2 SER A 29 13.567 -12.608 -3.856 1.00 2.41 H new ATOM 0 HB3 SER A 29 12.102 -11.716 -3.497 1.00 2.41 H new ATOM 0 HG SER A 29 12.777 -10.818 -5.842 1.00 52.34 H new ATOM 474 N PRO A 30 13.739 -9.731 -1.295 1.00 43.21 N ATOM 475 CA PRO A 30 13.786 -9.977 0.176 1.00 45.30 C ATOM 476 C PRO A 30 13.146 -11.331 0.550 1.00 24.02 C ATOM 477 O PRO A 30 13.419 -11.878 1.622 1.00 72.53 O ATOM 478 CB PRO A 30 12.980 -8.786 0.773 1.00 44.14 C ATOM 479 CG PRO A 30 13.077 -7.704 -0.264 1.00 44.11 C ATOM 480 CD PRO A 30 13.096 -8.423 -1.603 1.00 10.24 C ATOM 0 HA PRO A 30 14.806 -10.033 0.557 1.00 45.30 H new ATOM 0 HB2 PRO A 30 11.943 -9.064 0.960 1.00 44.14 H new ATOM 0 HB3 PRO A 30 13.400 -8.461 1.725 1.00 44.14 H new ATOM 0 HG2 PRO A 30 12.231 -7.020 -0.198 1.00 44.11 H new ATOM 0 HG3 PRO A 30 13.979 -7.108 -0.126 1.00 44.11 H new ATOM 0 HD2 PRO A 30 12.090 -8.556 -2.000 1.00 10.24 H new ATOM 0 HD3 PRO A 30 13.662 -7.865 -2.349 1.00 10.24 H new ATOM 488 N ILE A 31 12.278 -11.843 -0.360 1.00 0.23 N ATOM 489 CA ILE A 31 11.677 -13.188 -0.256 1.00 53.22 C ATOM 490 C ILE A 31 12.827 -14.234 -0.184 1.00 31.03 C ATOM 491 O ILE A 31 13.639 -14.282 -1.119 1.00 11.43 O ATOM 492 CB ILE A 31 10.742 -13.551 -1.498 1.00 32.13 C ATOM 493 CG1 ILE A 31 10.001 -12.303 -2.096 1.00 12.25 C ATOM 494 CG2 ILE A 31 9.727 -14.662 -1.117 1.00 10.10 C ATOM 495 CD1 ILE A 31 9.060 -11.565 -1.171 1.00 21.02 C ATOM 0 H ILE A 31 11.977 -11.328 -1.188 1.00 0.23 H new ATOM 0 HA ILE A 31 11.053 -13.200 0.638 1.00 53.22 H new ATOM 0 HB ILE A 31 11.401 -13.925 -2.282 1.00 32.13 H new ATOM 0 HG12 ILE A 31 10.753 -11.598 -2.450 1.00 12.25 H new ATOM 0 HG13 ILE A 31 9.435 -12.629 -2.968 1.00 12.25 H new ATOM 0 HG21 ILE A 31 9.100 -14.893 -1.978 1.00 10.10 H new ATOM 0 HG22 ILE A 31 10.267 -15.558 -0.810 1.00 10.10 H new ATOM 0 HG23 ILE A 31 9.100 -14.316 -0.295 1.00 10.10 H new ATOM 0 HD11 ILE A 31 8.612 -10.725 -1.702 1.00 21.02 H new ATOM 0 HD12 ILE A 31 8.275 -12.242 -0.835 1.00 21.02 H new ATOM 0 HD13 ILE A 31 9.614 -11.195 -0.308 1.00 21.02 H new ATOM 507 N PRO A 32 12.936 -15.052 0.917 1.00 3.35 N ATOM 508 CA PRO A 32 14.057 -16.019 1.091 1.00 44.44 C ATOM 509 C PRO A 32 14.143 -17.046 -0.082 1.00 73.31 C ATOM 510 O PRO A 32 13.109 -17.398 -0.666 1.00 35.32 O ATOM 511 CB PRO A 32 13.751 -16.686 2.462 1.00 12.01 C ATOM 512 CG PRO A 32 12.837 -15.719 3.164 1.00 32.41 C ATOM 513 CD PRO A 32 12.000 -15.108 2.071 1.00 54.04 C ATOM 0 HA PRO A 32 15.036 -15.539 1.076 1.00 44.44 H new ATOM 0 HB2 PRO A 32 13.274 -17.657 2.332 1.00 12.01 H new ATOM 0 HB3 PRO A 32 14.664 -16.853 3.033 1.00 12.01 H new ATOM 0 HG2 PRO A 32 12.214 -16.228 3.900 1.00 32.41 H new ATOM 0 HG3 PRO A 32 13.404 -14.957 3.699 1.00 32.41 H new ATOM 0 HD2 PRO A 32 11.123 -15.715 1.849 1.00 54.04 H new ATOM 0 HD3 PRO A 32 11.640 -14.117 2.346 1.00 54.04 H new ATOM 521 N PRO A 33 15.386 -17.527 -0.439 1.00 0.33 N ATOM 522 CA PRO A 33 15.674 -18.281 -1.704 1.00 35.44 C ATOM 523 C PRO A 33 14.733 -19.484 -1.969 1.00 41.23 C ATOM 524 O PRO A 33 14.192 -19.635 -3.075 1.00 73.35 O ATOM 525 CB PRO A 33 17.153 -18.741 -1.511 1.00 50.24 C ATOM 526 CG PRO A 33 17.429 -18.581 -0.045 1.00 64.24 C ATOM 527 CD PRO A 33 16.624 -17.383 0.376 1.00 11.34 C ATOM 0 HA PRO A 33 15.510 -17.655 -2.581 1.00 35.44 H new ATOM 0 HB2 PRO A 33 17.287 -19.776 -1.826 1.00 50.24 H new ATOM 0 HB3 PRO A 33 17.835 -18.135 -2.108 1.00 50.24 H new ATOM 0 HG2 PRO A 33 17.133 -19.470 0.511 1.00 64.24 H new ATOM 0 HG3 PRO A 33 18.492 -18.427 0.142 1.00 64.24 H new ATOM 0 HD2 PRO A 33 16.410 -17.393 1.445 1.00 11.34 H new ATOM 0 HD3 PRO A 33 17.144 -16.449 0.163 1.00 11.34 H new ATOM 535 N GLU A 34 14.523 -20.312 -0.938 1.00 25.12 N ATOM 536 CA GLU A 34 13.725 -21.553 -1.050 1.00 31.15 C ATOM 537 C GLU A 34 12.221 -21.239 -1.037 1.00 61.02 C ATOM 538 O GLU A 34 11.435 -21.958 -1.666 1.00 54.24 O ATOM 539 CB GLU A 34 14.092 -22.584 0.069 1.00 62.41 C ATOM 540 CG GLU A 34 13.754 -22.171 1.523 1.00 51.12 C ATOM 541 CD GLU A 34 14.667 -21.074 2.084 1.00 55.14 C ATOM 542 OE1 GLU A 34 15.755 -21.404 2.601 1.00 34.23 O ATOM 543 OE2 GLU A 34 14.314 -19.880 1.992 1.00 45.13 O ATOM 0 H GLU A 34 14.897 -20.147 -0.004 1.00 25.12 H new ATOM 0 HA GLU A 34 13.971 -22.013 -2.007 1.00 31.15 H new ATOM 0 HB2 GLU A 34 13.579 -23.521 -0.148 1.00 62.41 H new ATOM 0 HB3 GLU A 34 15.162 -22.785 0.011 1.00 62.41 H new ATOM 0 HG2 GLU A 34 12.721 -21.826 1.562 1.00 51.12 H new ATOM 0 HG3 GLU A 34 13.821 -23.049 2.165 1.00 51.12 H new ATOM 550 N GLU A 35 11.829 -20.159 -0.320 1.00 23.32 N ATOM 551 CA GLU A 35 10.426 -19.699 -0.268 1.00 34.34 C ATOM 552 C GLU A 35 9.941 -19.263 -1.661 1.00 50.13 C ATOM 553 O GLU A 35 8.919 -19.750 -2.150 1.00 1.41 O ATOM 554 CB GLU A 35 10.264 -18.521 0.737 1.00 41.11 C ATOM 555 CG GLU A 35 10.736 -18.823 2.173 1.00 22.15 C ATOM 556 CD GLU A 35 10.019 -20.014 2.824 1.00 1.13 C ATOM 557 OE1 GLU A 35 8.773 -19.983 2.927 1.00 62.32 O ATOM 558 OE2 GLU A 35 10.689 -20.982 3.239 1.00 43.40 O ATOM 0 H GLU A 35 12.470 -19.590 0.232 1.00 23.32 H new ATOM 0 HA GLU A 35 9.817 -20.537 0.071 1.00 34.34 H new ATOM 0 HB2 GLU A 35 10.820 -17.662 0.360 1.00 41.11 H new ATOM 0 HB3 GLU A 35 9.214 -18.232 0.769 1.00 41.11 H new ATOM 0 HG2 GLU A 35 11.808 -19.020 2.159 1.00 22.15 H new ATOM 0 HG3 GLU A 35 10.582 -17.937 2.790 1.00 22.15 H new ATOM 565 N ARG A 36 10.727 -18.386 -2.320 1.00 50.32 N ATOM 566 CA ARG A 36 10.382 -17.819 -3.641 1.00 74.11 C ATOM 567 C ARG A 36 10.523 -18.860 -4.771 1.00 14.22 C ATOM 568 O ARG A 36 10.093 -18.612 -5.897 1.00 12.25 O ATOM 569 CB ARG A 36 11.289 -16.595 -3.930 1.00 65.03 C ATOM 570 CG ARG A 36 12.777 -16.951 -4.145 1.00 2.12 C ATOM 571 CD ARG A 36 13.681 -15.724 -4.295 1.00 44.35 C ATOM 572 NE ARG A 36 13.204 -14.784 -5.326 1.00 40.35 N ATOM 573 CZ ARG A 36 13.341 -14.922 -6.656 1.00 12.23 C ATOM 574 NH1 ARG A 36 13.938 -15.987 -7.191 1.00 54.12 N ATOM 575 NH2 ARG A 36 12.893 -13.958 -7.443 1.00 14.24 N ATOM 0 H ARG A 36 11.617 -18.051 -1.952 1.00 50.32 H new ATOM 0 HA ARG A 36 9.337 -17.510 -3.612 1.00 74.11 H new ATOM 0 HB2 ARG A 36 10.917 -16.082 -4.817 1.00 65.03 H new ATOM 0 HB3 ARG A 36 11.210 -15.894 -3.099 1.00 65.03 H new ATOM 0 HG2 ARG A 36 13.125 -17.549 -3.303 1.00 2.12 H new ATOM 0 HG3 ARG A 36 12.869 -17.572 -5.036 1.00 2.12 H new ATOM 0 HD2 ARG A 36 13.743 -15.205 -3.338 1.00 44.35 H new ATOM 0 HD3 ARG A 36 14.690 -16.051 -4.547 1.00 44.35 H new ATOM 0 HE ARG A 36 12.723 -13.947 -4.998 1.00 40.35 H new ATOM 0 HH11 ARG A 36 14.305 -16.723 -6.587 1.00 54.12 H new ATOM 0 HH12 ARG A 36 14.028 -16.066 -8.204 1.00 54.12 H new ATOM 0 HH21 ARG A 36 12.454 -13.131 -7.038 1.00 14.24 H new ATOM 0 HH22 ARG A 36 12.986 -14.041 -8.455 1.00 14.24 H new ATOM 589 N ASP A 37 11.157 -20.005 -4.470 1.00 24.40 N ATOM 590 CA ASP A 37 11.333 -21.098 -5.440 1.00 10.04 C ATOM 591 C ASP A 37 9.987 -21.784 -5.733 1.00 24.24 C ATOM 592 O ASP A 37 9.718 -22.177 -6.874 1.00 0.12 O ATOM 593 CB ASP A 37 12.379 -22.115 -4.916 1.00 30.05 C ATOM 594 CG ASP A 37 12.636 -23.269 -5.899 1.00 2.25 C ATOM 595 OD1 ASP A 37 13.358 -23.055 -6.898 1.00 53.11 O ATOM 596 OD2 ASP A 37 12.103 -24.385 -5.696 1.00 71.23 O ATOM 0 H ASP A 37 11.560 -20.198 -3.553 1.00 24.40 H new ATOM 0 HA ASP A 37 11.704 -20.681 -6.376 1.00 10.04 H new ATOM 0 HB2 ASP A 37 13.317 -21.595 -4.720 1.00 30.05 H new ATOM 0 HB3 ASP A 37 12.036 -22.524 -3.965 1.00 30.05 H new ATOM 601 N ASP A 38 9.151 -21.906 -4.689 1.00 75.52 N ATOM 602 CA ASP A 38 7.799 -22.493 -4.802 1.00 42.11 C ATOM 603 C ASP A 38 6.818 -21.524 -5.474 1.00 1.35 C ATOM 604 O ASP A 38 5.908 -21.954 -6.188 1.00 4.11 O ATOM 605 CB ASP A 38 7.258 -22.893 -3.404 1.00 41.31 C ATOM 606 CG ASP A 38 8.096 -23.986 -2.731 1.00 14.40 C ATOM 607 OD1 ASP A 38 7.943 -25.171 -3.104 1.00 62.54 O ATOM 608 OD2 ASP A 38 8.922 -23.667 -1.846 1.00 61.44 O ATOM 0 H ASP A 38 9.389 -21.603 -3.745 1.00 75.52 H new ATOM 0 HA ASP A 38 7.884 -23.383 -5.425 1.00 42.11 H new ATOM 0 HB2 ASP A 38 7.236 -22.012 -2.763 1.00 41.31 H new ATOM 0 HB3 ASP A 38 6.230 -23.240 -3.504 1.00 41.31 H new ATOM 613 N PHE A 39 7.006 -20.216 -5.230 1.00 43.14 N ATOM 614 CA PHE A 39 6.096 -19.168 -5.731 1.00 43.24 C ATOM 615 C PHE A 39 6.806 -18.325 -6.796 1.00 42.21 C ATOM 616 O PHE A 39 7.647 -17.478 -6.462 1.00 13.14 O ATOM 617 CB PHE A 39 5.636 -18.264 -4.543 1.00 74.13 C ATOM 618 CG PHE A 39 5.005 -19.041 -3.390 1.00 42.52 C ATOM 619 CD1 PHE A 39 3.650 -19.358 -3.399 1.00 21.24 C ATOM 620 CD2 PHE A 39 5.773 -19.469 -2.305 1.00 34.31 C ATOM 621 CE1 PHE A 39 3.091 -20.075 -2.362 1.00 2.10 C ATOM 622 CE2 PHE A 39 5.212 -20.189 -1.273 1.00 70.24 C ATOM 623 CZ PHE A 39 3.870 -20.490 -1.302 1.00 43.04 C ATOM 0 H PHE A 39 7.788 -19.855 -4.683 1.00 43.14 H new ATOM 0 HA PHE A 39 5.220 -19.635 -6.183 1.00 43.24 H new ATOM 0 HB2 PHE A 39 6.495 -17.707 -4.168 1.00 74.13 H new ATOM 0 HB3 PHE A 39 4.918 -17.532 -4.912 1.00 74.13 H new ATOM 0 HD1 PHE A 39 3.031 -19.040 -4.225 1.00 21.24 H new ATOM 0 HD2 PHE A 39 6.826 -19.231 -2.274 1.00 34.31 H new ATOM 0 HE1 PHE A 39 2.038 -20.313 -2.380 1.00 2.10 H new ATOM 0 HE2 PHE A 39 5.823 -20.516 -0.445 1.00 70.24 H new ATOM 0 HZ PHE A 39 3.426 -21.052 -0.494 1.00 43.04 H new ATOM 633 N ASP A 40 6.467 -18.548 -8.080 1.00 53.10 N ATOM 634 CA ASP A 40 6.981 -17.716 -9.183 1.00 50.41 C ATOM 635 C ASP A 40 6.057 -16.505 -9.365 1.00 42.23 C ATOM 636 O ASP A 40 5.099 -16.528 -10.153 1.00 24.42 O ATOM 637 CB ASP A 40 7.098 -18.552 -10.489 1.00 25.31 C ATOM 638 CG ASP A 40 7.652 -17.742 -11.681 1.00 11.33 C ATOM 639 OD1 ASP A 40 8.886 -17.522 -11.739 1.00 22.05 O ATOM 640 OD2 ASP A 40 6.867 -17.324 -12.568 1.00 53.25 O ATOM 0 H ASP A 40 5.841 -19.296 -8.378 1.00 53.10 H new ATOM 0 HA ASP A 40 7.982 -17.359 -8.943 1.00 50.41 H new ATOM 0 HB2 ASP A 40 7.747 -19.409 -10.307 1.00 25.31 H new ATOM 0 HB3 ASP A 40 6.116 -18.945 -10.750 1.00 25.31 H new ATOM 645 N GLY A 41 6.293 -15.498 -8.526 1.00 41.01 N ATOM 646 CA GLY A 41 5.564 -14.237 -8.567 1.00 71.41 C ATOM 647 C GLY A 41 5.419 -13.660 -7.172 1.00 4.22 C ATOM 648 O GLY A 41 5.709 -14.354 -6.182 1.00 52.13 O ATOM 0 H GLY A 41 7.002 -15.537 -7.794 1.00 41.01 H new ATOM 0 HA2 GLY A 41 6.089 -13.528 -9.207 1.00 71.41 H new ATOM 0 HA3 GLY A 41 4.579 -14.394 -9.006 1.00 71.41 H new ATOM 652 N LEU A 42 4.980 -12.396 -7.072 1.00 4.43 N ATOM 653 CA LEU A 42 4.489 -11.848 -5.801 1.00 42.23 C ATOM 654 C LEU A 42 3.087 -12.417 -5.535 1.00 45.33 C ATOM 655 O LEU A 42 2.071 -11.821 -5.931 1.00 1.44 O ATOM 656 CB LEU A 42 4.495 -10.292 -5.805 1.00 5.41 C ATOM 657 CG LEU A 42 5.899 -9.626 -5.949 1.00 31.54 C ATOM 658 CD1 LEU A 42 5.796 -8.084 -5.918 1.00 11.15 C ATOM 659 CD2 LEU A 42 6.882 -10.156 -4.877 1.00 44.22 C ATOM 0 H LEU A 42 4.955 -11.739 -7.852 1.00 4.43 H new ATOM 0 HA LEU A 42 5.157 -12.146 -4.993 1.00 42.23 H new ATOM 0 HB2 LEU A 42 3.862 -9.946 -6.622 1.00 5.41 H new ATOM 0 HB3 LEU A 42 4.039 -9.942 -4.879 1.00 5.41 H new ATOM 0 HG LEU A 42 6.300 -9.903 -6.924 1.00 31.54 H new ATOM 0 HD11 LEU A 42 6.791 -7.651 -6.021 1.00 11.15 H new ATOM 0 HD12 LEU A 42 5.166 -7.745 -6.740 1.00 11.15 H new ATOM 0 HD13 LEU A 42 5.358 -7.768 -4.971 1.00 11.15 H new ATOM 0 HD21 LEU A 42 7.852 -9.674 -5.002 1.00 44.22 H new ATOM 0 HD22 LEU A 42 6.492 -9.933 -3.884 1.00 44.22 H new ATOM 0 HD23 LEU A 42 6.996 -11.234 -4.989 1.00 44.22 H new ATOM 671 N SER A 43 3.056 -13.620 -4.935 1.00 35.42 N ATOM 672 CA SER A 43 1.808 -14.324 -4.632 1.00 52.15 C ATOM 673 C SER A 43 1.100 -13.583 -3.490 1.00 23.30 C ATOM 674 O SER A 43 1.628 -13.523 -2.373 1.00 4.20 O ATOM 675 CB SER A 43 2.108 -15.803 -4.265 1.00 65.32 C ATOM 676 OG SER A 43 3.092 -15.900 -3.242 1.00 45.34 O ATOM 0 H SER A 43 3.895 -14.126 -4.649 1.00 35.42 H new ATOM 0 HA SER A 43 1.151 -14.337 -5.502 1.00 52.15 H new ATOM 0 HB2 SER A 43 1.190 -16.290 -3.935 1.00 65.32 H new ATOM 0 HB3 SER A 43 2.451 -16.336 -5.152 1.00 65.32 H new ATOM 0 HG SER A 43 2.951 -15.188 -2.584 1.00 45.34 H new ATOM 682 N TYR A 44 -0.088 -13.039 -3.799 1.00 65.22 N ATOM 683 CA TYR A 44 -0.854 -12.146 -2.909 1.00 23.41 C ATOM 684 C TYR A 44 -2.232 -11.859 -3.530 1.00 14.03 C ATOM 685 O TYR A 44 -2.668 -12.570 -4.450 1.00 24.04 O ATOM 686 CB TYR A 44 -0.057 -10.816 -2.587 1.00 50.14 C ATOM 687 CG TYR A 44 0.462 -10.755 -1.140 1.00 44.22 C ATOM 688 CD1 TYR A 44 -0.420 -10.542 -0.081 1.00 62.12 C ATOM 689 CD2 TYR A 44 1.813 -10.960 -0.825 1.00 24.10 C ATOM 690 CE1 TYR A 44 0.024 -10.527 1.222 1.00 34.42 C ATOM 691 CE2 TYR A 44 2.255 -10.953 0.482 1.00 3.04 C ATOM 692 CZ TYR A 44 1.361 -10.737 1.501 1.00 30.34 C ATOM 693 OH TYR A 44 1.801 -10.719 2.810 1.00 2.15 O ATOM 0 H TYR A 44 -0.553 -13.210 -4.691 1.00 65.22 H new ATOM 0 HA TYR A 44 -1.005 -12.647 -1.953 1.00 23.41 H new ATOM 0 HB2 TYR A 44 0.786 -10.731 -3.272 1.00 50.14 H new ATOM 0 HB3 TYR A 44 -0.705 -9.959 -2.770 1.00 50.14 H new ATOM 0 HD1 TYR A 44 -1.469 -10.386 -0.286 1.00 62.12 H new ATOM 0 HD2 TYR A 44 2.522 -11.127 -1.622 1.00 24.10 H new ATOM 0 HE1 TYR A 44 -0.674 -10.351 2.027 1.00 34.42 H new ATOM 0 HE2 TYR A 44 3.300 -11.117 0.702 1.00 3.04 H new ATOM 0 HH TYR A 44 1.030 -10.673 3.414 1.00 2.15 H new ATOM 703 N PHE A 45 -2.923 -10.842 -2.979 1.00 23.10 N ATOM 704 CA PHE A 45 -4.256 -10.433 -3.446 1.00 42.54 C ATOM 705 C PHE A 45 -4.148 -9.889 -4.879 1.00 74.14 C ATOM 706 O PHE A 45 -3.352 -8.978 -5.139 1.00 33.42 O ATOM 707 CB PHE A 45 -4.873 -9.367 -2.493 1.00 31.03 C ATOM 708 CG PHE A 45 -4.752 -9.733 -1.012 1.00 34.35 C ATOM 709 CD1 PHE A 45 -5.170 -10.984 -0.547 1.00 23.03 C ATOM 710 CD2 PHE A 45 -4.189 -8.843 -0.090 1.00 73.32 C ATOM 711 CE1 PHE A 45 -5.026 -11.331 0.783 1.00 32.32 C ATOM 712 CE2 PHE A 45 -4.055 -9.191 1.240 1.00 51.24 C ATOM 713 CZ PHE A 45 -4.467 -10.434 1.673 1.00 51.11 C ATOM 0 H PHE A 45 -2.572 -10.285 -2.200 1.00 23.10 H new ATOM 0 HA PHE A 45 -4.917 -11.299 -3.443 1.00 42.54 H new ATOM 0 HB2 PHE A 45 -4.381 -8.409 -2.664 1.00 31.03 H new ATOM 0 HB3 PHE A 45 -5.926 -9.234 -2.742 1.00 31.03 H new ATOM 0 HD1 PHE A 45 -5.611 -11.688 -1.237 1.00 23.03 H new ATOM 0 HD2 PHE A 45 -3.855 -7.871 -0.423 1.00 73.32 H new ATOM 0 HE1 PHE A 45 -5.350 -12.302 1.126 1.00 32.32 H new ATOM 0 HE2 PHE A 45 -3.627 -8.490 1.941 1.00 51.24 H new ATOM 0 HZ PHE A 45 -4.352 -10.707 2.712 1.00 51.11 H new ATOM 723 N ASP A 46 -4.911 -10.489 -5.801 1.00 51.44 N ATOM 724 CA ASP A 46 -4.868 -10.133 -7.230 1.00 73.41 C ATOM 725 C ASP A 46 -5.933 -9.054 -7.526 1.00 41.03 C ATOM 726 O ASP A 46 -7.076 -9.205 -7.072 1.00 14.01 O ATOM 727 CB ASP A 46 -5.068 -11.397 -8.108 1.00 50.01 C ATOM 728 CG ASP A 46 -4.974 -11.113 -9.626 1.00 10.44 C ATOM 729 OD1 ASP A 46 -3.847 -10.871 -10.131 1.00 33.14 O ATOM 730 OD2 ASP A 46 -6.020 -11.125 -10.318 1.00 34.55 O ATOM 0 H ASP A 46 -5.574 -11.232 -5.582 1.00 51.44 H new ATOM 0 HA ASP A 46 -3.890 -9.720 -7.475 1.00 73.41 H new ATOM 0 HB2 ASP A 46 -4.318 -12.140 -7.838 1.00 50.01 H new ATOM 0 HB3 ASP A 46 -6.042 -11.833 -7.887 1.00 50.01 H new ATOM 735 N PRO A 47 -5.559 -7.938 -8.266 1.00 53.12 N ATOM 736 CA PRO A 47 -6.459 -6.800 -8.611 1.00 53.42 C ATOM 737 C PRO A 47 -7.904 -7.210 -8.969 1.00 11.11 C ATOM 738 O PRO A 47 -8.167 -7.770 -10.036 1.00 44.22 O ATOM 739 CB PRO A 47 -5.749 -6.134 -9.834 1.00 31.21 C ATOM 740 CG PRO A 47 -4.508 -6.945 -10.092 1.00 40.11 C ATOM 741 CD PRO A 47 -4.200 -7.655 -8.793 1.00 44.54 C ATOM 0 HA PRO A 47 -6.592 -6.140 -7.754 1.00 53.42 H new ATOM 0 HB2 PRO A 47 -6.400 -6.131 -10.708 1.00 31.21 H new ATOM 0 HB3 PRO A 47 -5.498 -5.095 -9.620 1.00 31.21 H new ATOM 0 HG2 PRO A 47 -4.669 -7.660 -10.899 1.00 40.11 H new ATOM 0 HG3 PRO A 47 -3.679 -6.305 -10.394 1.00 40.11 H new ATOM 0 HD2 PRO A 47 -3.626 -8.568 -8.953 1.00 44.54 H new ATOM 0 HD3 PRO A 47 -3.621 -7.030 -8.114 1.00 44.54 H new ATOM 749 N ASP A 48 -8.826 -6.938 -8.043 1.00 4.32 N ATOM 750 CA ASP A 48 -10.247 -7.273 -8.195 1.00 72.02 C ATOM 751 C ASP A 48 -11.070 -5.971 -8.031 1.00 43.11 C ATOM 752 O ASP A 48 -10.887 -5.264 -7.034 1.00 73.01 O ATOM 753 CB ASP A 48 -10.651 -8.362 -7.147 1.00 44.42 C ATOM 754 CG ASP A 48 -11.822 -9.244 -7.606 1.00 14.23 C ATOM 755 OD1 ASP A 48 -12.929 -8.720 -7.800 1.00 44.21 O ATOM 756 OD2 ASP A 48 -11.629 -10.469 -7.793 1.00 75.25 O ATOM 0 H ASP A 48 -8.608 -6.476 -7.160 1.00 4.32 H new ATOM 0 HA ASP A 48 -10.447 -7.691 -9.182 1.00 72.02 H new ATOM 0 HB2 ASP A 48 -9.788 -8.995 -6.940 1.00 44.42 H new ATOM 0 HB3 ASP A 48 -10.919 -7.873 -6.210 1.00 44.42 H new ATOM 761 N PRO A 49 -11.980 -5.618 -8.986 1.00 45.35 N ATOM 762 CA PRO A 49 -12.826 -4.396 -8.874 1.00 65.13 C ATOM 763 C PRO A 49 -13.904 -4.495 -7.753 1.00 43.13 C ATOM 764 O PRO A 49 -14.505 -3.479 -7.377 1.00 43.54 O ATOM 765 CB PRO A 49 -13.469 -4.275 -10.285 1.00 73.25 C ATOM 766 CG PRO A 49 -12.693 -5.222 -11.162 1.00 25.10 C ATOM 767 CD PRO A 49 -12.251 -6.340 -10.255 1.00 14.21 C ATOM 0 HA PRO A 49 -12.242 -3.521 -8.588 1.00 65.13 H new ATOM 0 HB2 PRO A 49 -14.526 -4.541 -10.259 1.00 73.25 H new ATOM 0 HB3 PRO A 49 -13.406 -3.253 -10.659 1.00 73.25 H new ATOM 0 HG2 PRO A 49 -13.312 -5.599 -11.976 1.00 25.10 H new ATOM 0 HG3 PRO A 49 -11.837 -4.724 -11.616 1.00 25.10 H new ATOM 0 HD2 PRO A 49 -13.024 -7.099 -10.136 1.00 14.21 H new ATOM 0 HD3 PRO A 49 -11.363 -6.846 -10.634 1.00 14.21 H new ATOM 775 N ASP A 50 -14.113 -5.723 -7.230 1.00 60.01 N ATOM 776 CA ASP A 50 -15.104 -6.009 -6.169 1.00 3.33 C ATOM 777 C ASP A 50 -14.749 -5.327 -4.834 1.00 64.10 C ATOM 778 O ASP A 50 -15.571 -4.606 -4.269 1.00 32.34 O ATOM 779 CB ASP A 50 -15.250 -7.542 -5.976 1.00 32.41 C ATOM 780 CG ASP A 50 -16.189 -7.947 -4.825 1.00 0.04 C ATOM 781 OD1 ASP A 50 -17.423 -7.991 -5.031 1.00 33.22 O ATOM 782 OD2 ASP A 50 -15.694 -8.234 -3.712 1.00 2.14 O ATOM 0 H ASP A 50 -13.596 -6.548 -7.534 1.00 60.01 H new ATOM 0 HA ASP A 50 -16.058 -5.593 -6.493 1.00 3.33 H new ATOM 0 HB2 ASP A 50 -15.620 -7.980 -6.903 1.00 32.41 H new ATOM 0 HB3 ASP A 50 -14.264 -7.969 -5.793 1.00 32.41 H new ATOM 787 N TYR A 51 -13.495 -5.498 -4.365 1.00 54.12 N ATOM 788 CA TYR A 51 -13.083 -5.012 -3.015 1.00 61.22 C ATOM 789 C TYR A 51 -12.498 -3.570 -3.105 1.00 21.54 C ATOM 790 O TYR A 51 -11.964 -3.026 -2.133 1.00 1.31 O ATOM 791 CB TYR A 51 -12.059 -6.007 -2.363 1.00 52.34 C ATOM 792 CG TYR A 51 -12.102 -6.040 -0.818 1.00 24.13 C ATOM 793 CD1 TYR A 51 -11.449 -5.080 -0.040 1.00 13.10 C ATOM 794 CD2 TYR A 51 -12.827 -7.021 -0.144 1.00 42.30 C ATOM 795 CE1 TYR A 51 -11.518 -5.099 1.340 1.00 75.31 C ATOM 796 CE2 TYR A 51 -12.898 -7.039 1.236 1.00 33.23 C ATOM 797 CZ TYR A 51 -12.245 -6.078 1.975 1.00 54.41 C ATOM 798 OH TYR A 51 -12.321 -6.093 3.354 1.00 24.25 O ATOM 0 H TYR A 51 -12.752 -5.962 -4.888 1.00 54.12 H new ATOM 0 HA TYR A 51 -13.964 -4.972 -2.374 1.00 61.22 H new ATOM 0 HB2 TYR A 51 -12.253 -7.010 -2.742 1.00 52.34 H new ATOM 0 HB3 TYR A 51 -11.053 -5.735 -2.681 1.00 52.34 H new ATOM 0 HD1 TYR A 51 -10.877 -4.305 -0.529 1.00 13.10 H new ATOM 0 HD2 TYR A 51 -13.343 -7.782 -0.711 1.00 42.30 H new ATOM 0 HE1 TYR A 51 -11.002 -4.347 1.918 1.00 75.31 H new ATOM 0 HE2 TYR A 51 -13.467 -7.809 1.736 1.00 33.23 H new ATOM 0 HH TYR A 51 -12.173 -7.005 3.680 1.00 24.25 H new ATOM 808 N ARG A 52 -12.609 -2.963 -4.293 1.00 33.24 N ATOM 809 CA ARG A 52 -12.160 -1.588 -4.552 1.00 2.11 C ATOM 810 C ARG A 52 -13.121 -0.591 -3.856 1.00 13.34 C ATOM 811 O ARG A 52 -14.326 -0.625 -4.104 1.00 24.21 O ATOM 812 CB ARG A 52 -12.125 -1.359 -6.092 1.00 35.31 C ATOM 813 CG ARG A 52 -11.391 -0.090 -6.550 1.00 10.43 C ATOM 814 CD ARG A 52 -11.321 0.043 -8.093 1.00 12.22 C ATOM 815 NE ARG A 52 -10.268 0.998 -8.489 1.00 50.33 N ATOM 816 CZ ARG A 52 -10.416 2.035 -9.313 1.00 31.23 C ATOM 817 NH1 ARG A 52 -11.588 2.301 -9.872 1.00 74.23 N ATOM 818 NH2 ARG A 52 -9.383 2.835 -9.543 1.00 11.22 N ATOM 0 H ARG A 52 -13.017 -3.417 -5.110 1.00 33.24 H new ATOM 0 HA ARG A 52 -11.160 -1.427 -4.149 1.00 2.11 H new ATOM 0 HB2 ARG A 52 -11.652 -2.222 -6.560 1.00 35.31 H new ATOM 0 HB3 ARG A 52 -13.150 -1.319 -6.460 1.00 35.31 H new ATOM 0 HG2 ARG A 52 -11.895 0.784 -6.138 1.00 10.43 H new ATOM 0 HG3 ARG A 52 -10.379 -0.095 -6.145 1.00 10.43 H new ATOM 0 HD2 ARG A 52 -11.120 -0.932 -8.538 1.00 12.22 H new ATOM 0 HD3 ARG A 52 -12.285 0.377 -8.478 1.00 12.22 H new ATOM 0 HE ARG A 52 -9.339 0.850 -8.095 1.00 50.33 H new ATOM 0 HH11 ARG A 52 -12.394 1.708 -9.674 1.00 74.23 H new ATOM 0 HH12 ARG A 52 -11.684 3.099 -10.500 1.00 74.23 H new ATOM 0 HH21 ARG A 52 -8.487 2.653 -9.091 1.00 11.22 H new ATOM 0 HH22 ARG A 52 -9.485 3.632 -10.172 1.00 11.22 H new ATOM 832 N VAL A 53 -12.594 0.266 -2.955 1.00 64.23 N ATOM 833 CA VAL A 53 -13.411 1.282 -2.230 1.00 41.53 C ATOM 834 C VAL A 53 -12.924 2.696 -2.581 1.00 51.14 C ATOM 835 O VAL A 53 -11.970 2.855 -3.339 1.00 24.40 O ATOM 836 CB VAL A 53 -13.385 1.074 -0.659 1.00 24.44 C ATOM 837 CG1 VAL A 53 -13.821 -0.357 -0.281 1.00 44.12 C ATOM 838 CG2 VAL A 53 -12.005 1.413 -0.054 1.00 55.02 C ATOM 0 H VAL A 53 -11.605 0.280 -2.707 1.00 64.23 H new ATOM 0 HA VAL A 53 -14.444 1.155 -2.554 1.00 41.53 H new ATOM 0 HB VAL A 53 -14.104 1.772 -0.230 1.00 24.44 H new ATOM 0 HG11 VAL A 53 -13.794 -0.471 0.803 1.00 44.12 H new ATOM 0 HG12 VAL A 53 -14.835 -0.535 -0.639 1.00 44.12 H new ATOM 0 HG13 VAL A 53 -13.143 -1.077 -0.739 1.00 44.12 H new ATOM 0 HG21 VAL A 53 -12.032 1.256 1.024 1.00 55.02 H new ATOM 0 HG22 VAL A 53 -11.246 0.767 -0.495 1.00 55.02 H new ATOM 0 HG23 VAL A 53 -11.762 2.455 -0.263 1.00 55.02 H new ATOM 848 N GLU A 54 -13.583 3.717 -2.016 1.00 4.23 N ATOM 849 CA GLU A 54 -13.200 5.133 -2.184 1.00 4.54 C ATOM 850 C GLU A 54 -13.129 5.813 -0.806 1.00 0.14 C ATOM 851 O GLU A 54 -13.821 5.397 0.128 1.00 41.43 O ATOM 852 CB GLU A 54 -14.209 5.867 -3.108 1.00 21.22 C ATOM 853 CG GLU A 54 -15.675 5.836 -2.622 1.00 24.41 C ATOM 854 CD GLU A 54 -16.618 6.716 -3.460 1.00 60.42 C ATOM 855 OE1 GLU A 54 -17.130 6.246 -4.500 1.00 11.33 O ATOM 856 OE2 GLU A 54 -16.841 7.889 -3.088 1.00 55.43 O ATOM 0 H GLU A 54 -14.404 3.587 -1.424 1.00 4.23 H new ATOM 0 HA GLU A 54 -12.218 5.183 -2.655 1.00 4.54 H new ATOM 0 HB2 GLU A 54 -13.897 6.906 -3.210 1.00 21.22 H new ATOM 0 HB3 GLU A 54 -14.161 5.421 -4.101 1.00 21.22 H new ATOM 0 HG2 GLU A 54 -16.035 4.807 -2.644 1.00 24.41 H new ATOM 0 HG3 GLU A 54 -15.712 6.164 -1.583 1.00 24.41 H new ATOM 863 N ALA A 55 -12.304 6.868 -0.693 1.00 72.40 N ATOM 864 CA ALA A 55 -12.066 7.572 0.578 1.00 44.14 C ATOM 865 C ALA A 55 -11.962 9.086 0.368 1.00 52.23 C ATOM 866 O ALA A 55 -11.517 9.554 -0.689 1.00 71.42 O ATOM 867 CB ALA A 55 -10.793 7.042 1.253 1.00 13.22 C ATOM 0 H ALA A 55 -11.784 7.256 -1.480 1.00 72.40 H new ATOM 0 HA ALA A 55 -12.919 7.381 1.229 1.00 44.14 H new ATOM 0 HB1 ALA A 55 -10.631 7.572 2.191 1.00 13.22 H new ATOM 0 HB2 ALA A 55 -10.904 5.976 1.453 1.00 13.22 H new ATOM 0 HB3 ALA A 55 -9.939 7.200 0.594 1.00 13.22 H new ATOM 873 N THR A 56 -12.380 9.833 1.397 1.00 34.41 N ATOM 874 CA THR A 56 -12.206 11.278 1.482 1.00 52.25 C ATOM 875 C THR A 56 -10.866 11.576 2.176 1.00 12.43 C ATOM 876 O THR A 56 -10.633 11.126 3.303 1.00 30.34 O ATOM 877 CB THR A 56 -13.376 11.914 2.293 1.00 71.32 C ATOM 878 OG1 THR A 56 -14.635 11.510 1.719 1.00 14.12 O ATOM 879 CG2 THR A 56 -13.287 13.454 2.329 1.00 31.03 C ATOM 0 H THR A 56 -12.857 9.437 2.207 1.00 34.41 H new ATOM 0 HA THR A 56 -12.208 11.706 0.479 1.00 52.25 H new ATOM 0 HB THR A 56 -13.301 11.558 3.321 1.00 71.32 H new ATOM 0 HG1 THR A 56 -15.370 11.908 2.230 1.00 14.12 H new ATOM 0 HG21 THR A 56 -14.122 13.853 2.904 1.00 31.03 H new ATOM 0 HG22 THR A 56 -12.349 13.753 2.796 1.00 31.03 H new ATOM 0 HG23 THR A 56 -13.327 13.845 1.312 1.00 31.03 H new ATOM 887 N VAL A 57 -10.009 12.340 1.502 1.00 31.15 N ATOM 888 CA VAL A 57 -8.653 12.651 1.966 1.00 15.54 C ATOM 889 C VAL A 57 -8.706 13.697 3.096 1.00 73.04 C ATOM 890 O VAL A 57 -9.418 14.692 2.986 1.00 13.10 O ATOM 891 CB VAL A 57 -7.786 13.207 0.775 1.00 71.40 C ATOM 892 CG1 VAL A 57 -6.307 13.354 1.176 1.00 23.23 C ATOM 893 CG2 VAL A 57 -7.937 12.333 -0.491 1.00 3.33 C ATOM 0 H VAL A 57 -10.238 12.768 0.605 1.00 31.15 H new ATOM 0 HA VAL A 57 -8.197 11.736 2.345 1.00 15.54 H new ATOM 0 HB VAL A 57 -8.163 14.201 0.536 1.00 71.40 H new ATOM 0 HG11 VAL A 57 -5.737 13.740 0.331 1.00 23.23 H new ATOM 0 HG12 VAL A 57 -6.224 14.045 2.015 1.00 23.23 H new ATOM 0 HG13 VAL A 57 -5.910 12.381 1.467 1.00 23.23 H new ATOM 0 HG21 VAL A 57 -7.325 12.746 -1.293 1.00 3.33 H new ATOM 0 HG22 VAL A 57 -7.611 11.316 -0.272 1.00 3.33 H new ATOM 0 HG23 VAL A 57 -8.982 12.320 -0.802 1.00 3.33 H new ATOM 903 N THR A 58 -7.969 13.447 4.182 1.00 20.21 N ATOM 904 CA THR A 58 -7.840 14.384 5.305 1.00 71.25 C ATOM 905 C THR A 58 -6.364 14.803 5.416 1.00 40.21 C ATOM 906 O THR A 58 -5.561 14.120 6.065 1.00 71.54 O ATOM 907 CB THR A 58 -8.341 13.728 6.637 1.00 53.53 C ATOM 908 OG1 THR A 58 -9.678 13.225 6.458 1.00 72.11 O ATOM 909 CG2 THR A 58 -8.308 14.709 7.823 1.00 40.50 C ATOM 0 H THR A 58 -7.441 12.584 4.309 1.00 20.21 H new ATOM 0 HA THR A 58 -8.459 15.264 5.129 1.00 71.25 H new ATOM 0 HB THR A 58 -7.661 12.910 6.873 1.00 53.53 H new ATOM 0 HG1 THR A 58 -9.987 12.814 7.292 1.00 72.11 H new ATOM 0 HG21 THR A 58 -8.665 14.206 8.722 1.00 40.50 H new ATOM 0 HG22 THR A 58 -7.286 15.054 7.982 1.00 40.50 H new ATOM 0 HG23 THR A 58 -8.950 15.563 7.607 1.00 40.50 H new ATOM 917 N VAL A 59 -5.998 15.918 4.762 1.00 61.41 N ATOM 918 CA VAL A 59 -4.593 16.347 4.663 1.00 50.11 C ATOM 919 C VAL A 59 -4.234 17.198 5.880 1.00 34.21 C ATOM 920 O VAL A 59 -4.973 18.116 6.245 1.00 21.53 O ATOM 921 CB VAL A 59 -4.283 17.131 3.320 1.00 3.04 C ATOM 922 CG1 VAL A 59 -2.921 17.880 3.367 1.00 62.31 C ATOM 923 CG2 VAL A 59 -4.308 16.162 2.120 1.00 44.25 C ATOM 0 H VAL A 59 -6.657 16.540 4.293 1.00 61.41 H new ATOM 0 HA VAL A 59 -3.975 15.450 4.643 1.00 50.11 H new ATOM 0 HB VAL A 59 -5.063 17.884 3.203 1.00 3.04 H new ATOM 0 HG11 VAL A 59 -2.759 18.400 2.423 1.00 62.31 H new ATOM 0 HG12 VAL A 59 -2.932 18.603 4.182 1.00 62.31 H new ATOM 0 HG13 VAL A 59 -2.117 17.163 3.529 1.00 62.31 H new ATOM 0 HG21 VAL A 59 -4.094 16.712 1.204 1.00 44.25 H new ATOM 0 HG22 VAL A 59 -3.555 15.387 2.262 1.00 44.25 H new ATOM 0 HG23 VAL A 59 -5.293 15.701 2.045 1.00 44.25 H new ATOM 933 N HIS A 60 -3.103 16.857 6.501 1.00 33.44 N ATOM 934 CA HIS A 60 -2.565 17.569 7.648 1.00 44.35 C ATOM 935 C HIS A 60 -1.623 18.670 7.159 1.00 65.12 C ATOM 936 O HIS A 60 -0.618 18.389 6.501 1.00 64.33 O ATOM 937 CB HIS A 60 -1.856 16.562 8.586 1.00 25.34 C ATOM 938 CG HIS A 60 -2.843 15.618 9.221 1.00 61.34 C ATOM 939 ND1 HIS A 60 -3.550 15.731 10.368 1.00 41.42 N flip ATOM 940 CD2 HIS A 60 -3.295 14.462 8.613 1.00 51.12 C flip ATOM 941 CE1 HIS A 60 -4.409 14.667 10.424 1.00 25.53 C flip ATOM 942 NE2 HIS A 60 -4.235 13.920 9.359 1.00 72.20 N flip ATOM 0 H HIS A 60 -2.530 16.064 6.211 1.00 33.44 H new ATOM 0 HA HIS A 60 -3.363 18.045 8.218 1.00 44.35 H new ATOM 0 HB2 HIS A 60 -1.117 15.993 8.021 1.00 25.34 H new ATOM 0 HB3 HIS A 60 -1.316 17.103 9.363 1.00 25.34 H new ATOM 0 HD2 HIS A 60 -2.934 14.066 7.675 1.00 51.12 H new ATOM 0 HE1 HIS A 60 -5.116 14.473 11.217 1.00 25.53 H new ATOM 0 HE2 HIS A 60 -4.743 13.062 9.145 1.00 72.20 H new ATOM 951 N GLU A 61 -1.995 19.925 7.468 1.00 64.41 N ATOM 952 CA GLU A 61 -1.215 21.126 7.102 1.00 51.52 C ATOM 953 C GLU A 61 0.160 21.137 7.814 1.00 23.44 C ATOM 954 O GLU A 61 1.069 21.883 7.427 1.00 33.14 O ATOM 955 CB GLU A 61 -2.036 22.404 7.443 1.00 75.34 C ATOM 956 CG GLU A 61 -2.288 22.625 8.950 1.00 72.11 C ATOM 957 CD GLU A 61 -3.203 23.821 9.246 1.00 34.54 C ATOM 958 OE1 GLU A 61 -2.752 24.978 9.086 1.00 64.01 O ATOM 959 OE2 GLU A 61 -4.377 23.616 9.629 1.00 42.32 O ATOM 0 H GLU A 61 -2.850 20.138 7.982 1.00 64.41 H new ATOM 0 HA GLU A 61 -1.022 21.108 6.029 1.00 51.52 H new ATOM 0 HB2 GLU A 61 -1.512 23.273 7.045 1.00 75.34 H new ATOM 0 HB3 GLU A 61 -2.997 22.349 6.932 1.00 75.34 H new ATOM 0 HG2 GLU A 61 -2.732 21.724 9.372 1.00 72.11 H new ATOM 0 HG3 GLU A 61 -1.332 22.775 9.452 1.00 72.11 H new ATOM 966 N THR A 62 0.279 20.305 8.862 1.00 25.04 N ATOM 967 CA THR A 62 1.523 20.042 9.577 1.00 44.35 C ATOM 968 C THR A 62 1.874 18.532 9.439 1.00 62.51 C ATOM 969 O THR A 62 1.260 17.689 10.106 1.00 54.20 O ATOM 970 CB THR A 62 1.368 20.454 11.079 1.00 23.44 C ATOM 971 OG1 THR A 62 0.259 19.756 11.670 1.00 71.40 O ATOM 972 CG2 THR A 62 1.141 21.972 11.244 1.00 11.23 C ATOM 0 H THR A 62 -0.514 19.786 9.240 1.00 25.04 H new ATOM 0 HA THR A 62 2.335 20.631 9.151 1.00 44.35 H new ATOM 0 HB THR A 62 2.298 20.188 11.580 1.00 23.44 H new ATOM 0 HG1 THR A 62 0.216 18.845 11.310 1.00 71.40 H new ATOM 0 HG21 THR A 62 1.039 22.212 12.302 1.00 11.23 H new ATOM 0 HG22 THR A 62 1.991 22.514 10.829 1.00 11.23 H new ATOM 0 HG23 THR A 62 0.233 22.263 10.717 1.00 11.23 H new ATOM 980 N PRO A 63 2.825 18.153 8.520 1.00 5.22 N ATOM 981 CA PRO A 63 3.239 16.737 8.342 1.00 70.20 C ATOM 982 C PRO A 63 4.133 16.252 9.515 1.00 12.24 C ATOM 983 O PRO A 63 5.151 16.877 9.831 1.00 4.21 O ATOM 984 CB PRO A 63 3.992 16.768 6.986 1.00 15.32 C ATOM 985 CG PRO A 63 4.529 18.166 6.857 1.00 24.32 C ATOM 986 CD PRO A 63 3.539 19.067 7.582 1.00 35.34 C ATOM 0 HA PRO A 63 2.406 16.034 8.341 1.00 70.20 H new ATOM 0 HB2 PRO A 63 4.798 16.035 6.968 1.00 15.32 H new ATOM 0 HB3 PRO A 63 3.323 16.527 6.160 1.00 15.32 H new ATOM 0 HG2 PRO A 63 5.523 18.244 7.298 1.00 24.32 H new ATOM 0 HG3 PRO A 63 4.622 18.453 5.809 1.00 24.32 H new ATOM 0 HD2 PRO A 63 4.049 19.868 8.118 1.00 35.34 H new ATOM 0 HD3 PRO A 63 2.848 19.540 6.885 1.00 35.34 H new ATOM 994 N GLU A 64 3.726 15.145 10.171 1.00 41.31 N ATOM 995 CA GLU A 64 4.405 14.616 11.387 1.00 1.21 C ATOM 996 C GLU A 64 5.165 13.302 11.089 1.00 1.41 C ATOM 997 O GLU A 64 4.783 12.538 10.204 1.00 51.42 O ATOM 998 CB GLU A 64 3.358 14.429 12.522 1.00 70.24 C ATOM 999 CG GLU A 64 2.146 13.552 12.143 1.00 1.13 C ATOM 1000 CD GLU A 64 1.099 13.444 13.260 1.00 43.15 C ATOM 1001 OE1 GLU A 64 0.311 14.396 13.444 1.00 32.03 O ATOM 1002 OE2 GLU A 64 1.065 12.414 13.970 1.00 1.53 O ATOM 0 H GLU A 64 2.921 14.590 9.879 1.00 41.31 H new ATOM 0 HA GLU A 64 5.153 15.337 11.715 1.00 1.21 H new ATOM 0 HB2 GLU A 64 3.854 13.986 13.386 1.00 70.24 H new ATOM 0 HB3 GLU A 64 2.997 15.410 12.830 1.00 70.24 H new ATOM 0 HG2 GLU A 64 1.674 13.964 11.251 1.00 1.13 H new ATOM 0 HG3 GLU A 64 2.496 12.552 11.886 1.00 1.13 H new ATOM 1009 N SER A 65 6.240 13.045 11.856 1.00 13.30 N ATOM 1010 CA SER A 65 7.218 11.977 11.562 1.00 40.25 C ATOM 1011 C SER A 65 6.766 10.590 12.081 1.00 40.15 C ATOM 1012 O SER A 65 6.488 10.427 13.277 1.00 3.14 O ATOM 1013 CB SER A 65 8.582 12.377 12.170 1.00 62.35 C ATOM 1014 OG SER A 65 8.481 12.707 13.548 1.00 41.52 O ATOM 0 H SER A 65 6.457 13.573 12.701 1.00 13.30 H new ATOM 0 HA SER A 65 7.301 11.877 10.480 1.00 40.25 H new ATOM 0 HB2 SER A 65 9.288 11.556 12.046 1.00 62.35 H new ATOM 0 HB3 SER A 65 8.985 13.229 11.623 1.00 62.35 H new ATOM 0 HG SER A 65 7.756 12.189 13.956 1.00 41.52 H new ATOM 1020 N VAL A 66 6.701 9.595 11.163 1.00 74.03 N ATOM 1021 CA VAL A 66 6.329 8.195 11.466 1.00 4.11 C ATOM 1022 C VAL A 66 7.381 7.247 10.848 1.00 14.43 C ATOM 1023 O VAL A 66 7.690 7.365 9.658 1.00 2.35 O ATOM 1024 CB VAL A 66 4.901 7.836 10.886 1.00 61.24 C ATOM 1025 CG1 VAL A 66 4.419 6.437 11.357 1.00 42.00 C ATOM 1026 CG2 VAL A 66 3.866 8.944 11.220 1.00 43.35 C ATOM 0 H VAL A 66 6.909 9.747 10.176 1.00 74.03 H new ATOM 0 HA VAL A 66 6.296 8.077 12.549 1.00 4.11 H new ATOM 0 HB VAL A 66 4.993 7.787 9.801 1.00 61.24 H new ATOM 0 HG11 VAL A 66 3.435 6.230 10.936 1.00 42.00 H new ATOM 0 HG12 VAL A 66 5.124 5.677 11.021 1.00 42.00 H new ATOM 0 HG13 VAL A 66 4.359 6.420 12.445 1.00 42.00 H new ATOM 0 HG21 VAL A 66 2.894 8.670 10.809 1.00 43.35 H new ATOM 0 HG22 VAL A 66 3.785 9.052 12.302 1.00 43.35 H new ATOM 0 HG23 VAL A 66 4.191 9.889 10.784 1.00 43.35 H new ATOM 1036 N ASP A 67 7.917 6.315 11.658 1.00 61.23 N ATOM 1037 CA ASP A 67 8.970 5.374 11.218 1.00 43.10 C ATOM 1038 C ASP A 67 8.366 4.247 10.360 1.00 14.22 C ATOM 1039 O ASP A 67 7.651 3.384 10.880 1.00 13.12 O ATOM 1040 CB ASP A 67 9.704 4.753 12.438 1.00 53.13 C ATOM 1041 CG ASP A 67 10.487 5.775 13.276 1.00 73.40 C ATOM 1042 OD1 ASP A 67 11.674 6.017 12.981 1.00 13.23 O ATOM 1043 OD2 ASP A 67 9.921 6.331 14.243 1.00 21.32 O ATOM 0 H ASP A 67 7.636 6.191 12.631 1.00 61.23 H new ATOM 0 HA ASP A 67 9.687 5.937 10.621 1.00 43.10 H new ATOM 0 HB2 ASP A 67 8.973 4.257 13.077 1.00 53.13 H new ATOM 0 HB3 ASP A 67 10.391 3.984 12.084 1.00 53.13 H new ATOM 1048 N LEU A 68 8.648 4.265 9.047 1.00 63.01 N ATOM 1049 CA LEU A 68 8.233 3.202 8.109 1.00 64.25 C ATOM 1050 C LEU A 68 9.459 2.737 7.314 1.00 52.32 C ATOM 1051 O LEU A 68 10.308 3.560 6.953 1.00 50.31 O ATOM 1052 CB LEU A 68 7.138 3.702 7.122 1.00 22.42 C ATOM 1053 CG LEU A 68 5.858 4.344 7.742 1.00 44.33 C ATOM 1054 CD1 LEU A 68 4.922 4.843 6.639 1.00 35.43 C ATOM 1055 CD2 LEU A 68 5.118 3.373 8.683 1.00 65.30 C ATOM 0 H LEU A 68 9.172 5.019 8.602 1.00 63.01 H new ATOM 0 HA LEU A 68 7.812 2.379 8.687 1.00 64.25 H new ATOM 0 HB2 LEU A 68 7.593 4.434 6.455 1.00 22.42 H new ATOM 0 HB3 LEU A 68 6.828 2.858 6.506 1.00 22.42 H new ATOM 0 HG LEU A 68 6.180 5.193 8.345 1.00 44.33 H new ATOM 0 HD11 LEU A 68 4.034 5.288 7.089 1.00 35.43 H new ATOM 0 HD12 LEU A 68 5.437 5.591 6.036 1.00 35.43 H new ATOM 0 HD13 LEU A 68 4.627 4.006 6.006 1.00 35.43 H new ATOM 0 HD21 LEU A 68 4.234 3.864 9.090 1.00 65.30 H new ATOM 0 HD22 LEU A 68 4.816 2.486 8.126 1.00 65.30 H new ATOM 0 HD23 LEU A 68 5.780 3.082 9.499 1.00 65.30 H new ATOM 1067 N GLU A 69 9.556 1.426 7.040 1.00 2.13 N ATOM 1068 CA GLU A 69 10.632 0.887 6.192 1.00 70.11 C ATOM 1069 C GLU A 69 10.375 1.242 4.716 1.00 21.44 C ATOM 1070 O GLU A 69 9.222 1.381 4.278 1.00 53.34 O ATOM 1071 CB GLU A 69 10.796 -0.643 6.395 1.00 11.42 C ATOM 1072 CG GLU A 69 9.545 -1.496 6.075 1.00 62.51 C ATOM 1073 CD GLU A 69 9.695 -2.990 6.428 1.00 30.01 C ATOM 1074 OE1 GLU A 69 10.472 -3.314 7.343 1.00 10.21 O ATOM 1075 OE2 GLU A 69 8.992 -3.835 5.834 1.00 32.24 O ATOM 0 H GLU A 69 8.906 0.723 7.391 1.00 2.13 H new ATOM 0 HA GLU A 69 11.573 1.349 6.491 1.00 70.11 H new ATOM 0 HB2 GLU A 69 11.619 -0.989 5.770 1.00 11.42 H new ATOM 0 HB3 GLU A 69 11.084 -0.826 7.430 1.00 11.42 H new ATOM 0 HG2 GLU A 69 8.692 -1.089 6.618 1.00 62.51 H new ATOM 0 HG3 GLU A 69 9.319 -1.406 5.013 1.00 62.51 H new ATOM 1082 N THR A 70 11.468 1.432 3.977 1.00 55.33 N ATOM 1083 CA THR A 70 11.433 1.784 2.555 1.00 72.51 C ATOM 1084 C THR A 70 11.738 0.533 1.705 1.00 44.53 C ATOM 1085 O THR A 70 12.027 -0.547 2.239 1.00 2.42 O ATOM 1086 CB THR A 70 12.448 2.951 2.264 1.00 43.33 C ATOM 1087 OG1 THR A 70 12.405 3.343 0.879 1.00 64.13 O ATOM 1088 CG2 THR A 70 13.897 2.590 2.656 1.00 2.42 C ATOM 0 H THR A 70 12.413 1.345 4.351 1.00 55.33 H new ATOM 0 HA THR A 70 10.438 2.139 2.286 1.00 72.51 H new ATOM 0 HB THR A 70 12.134 3.789 2.887 1.00 43.33 H new ATOM 0 HG1 THR A 70 13.043 4.070 0.725 1.00 64.13 H new ATOM 0 HG21 THR A 70 14.554 3.431 2.434 1.00 2.42 H new ATOM 0 HG22 THR A 70 13.941 2.367 3.722 1.00 2.42 H new ATOM 0 HG23 THR A 70 14.220 1.717 2.089 1.00 2.42 H new ATOM 1096 N SER A 71 11.712 0.700 0.378 1.00 11.34 N ATOM 1097 CA SER A 71 11.990 -0.362 -0.598 1.00 11.22 C ATOM 1098 C SER A 71 13.470 -0.282 -1.044 1.00 71.21 C ATOM 1099 O SER A 71 13.866 -0.858 -2.064 1.00 54.45 O ATOM 1100 CB SER A 71 11.007 -0.196 -1.779 1.00 61.42 C ATOM 1101 OG SER A 71 11.000 1.145 -2.259 1.00 15.23 O ATOM 0 H SER A 71 11.493 1.596 -0.058 1.00 11.34 H new ATOM 0 HA SER A 71 11.843 -1.351 -0.163 1.00 11.22 H new ATOM 0 HB2 SER A 71 11.287 -0.873 -2.586 1.00 61.42 H new ATOM 0 HB3 SER A 71 10.003 -0.477 -1.462 1.00 61.42 H new ATOM 0 HG SER A 71 10.371 1.222 -3.007 1.00 15.23 H new ATOM 1107 N ASP A 72 14.288 0.389 -0.209 1.00 31.32 N ATOM 1108 CA ASP A 72 15.693 0.724 -0.500 1.00 41.10 C ATOM 1109 C ASP A 72 16.571 0.169 0.645 1.00 1.42 C ATOM 1110 O ASP A 72 17.398 0.877 1.235 1.00 32.20 O ATOM 1111 CB ASP A 72 15.826 2.269 -0.688 1.00 54.21 C ATOM 1112 CG ASP A 72 17.212 2.719 -1.195 1.00 24.30 C ATOM 1113 OD1 ASP A 72 17.542 2.439 -2.369 1.00 53.44 O ATOM 1114 OD2 ASP A 72 17.973 3.357 -0.428 1.00 71.44 O ATOM 0 H ASP A 72 13.982 0.720 0.706 1.00 31.32 H new ATOM 0 HA ASP A 72 16.034 0.267 -1.429 1.00 41.10 H new ATOM 0 HB2 ASP A 72 15.065 2.607 -1.392 1.00 54.21 H new ATOM 0 HB3 ASP A 72 15.621 2.760 0.263 1.00 54.21 H new ATOM 1119 N ASP A 73 16.334 -1.136 0.938 1.00 11.51 N ATOM 1120 CA ASP A 73 17.071 -1.975 1.934 1.00 61.51 C ATOM 1121 C ASP A 73 17.328 -1.291 3.292 1.00 71.41 C ATOM 1122 O ASP A 73 18.333 -1.580 3.957 1.00 34.03 O ATOM 1123 CB ASP A 73 18.384 -2.592 1.331 1.00 24.42 C ATOM 1124 CG ASP A 73 19.380 -1.577 0.726 1.00 5.24 C ATOM 1125 OD1 ASP A 73 20.146 -0.929 1.479 1.00 3.04 O ATOM 1126 OD2 ASP A 73 19.409 -1.431 -0.519 1.00 52.34 O ATOM 0 H ASP A 73 15.594 -1.659 0.470 1.00 11.51 H new ATOM 0 HA ASP A 73 16.388 -2.794 2.160 1.00 61.51 H new ATOM 0 HB2 ASP A 73 18.894 -3.152 2.114 1.00 24.42 H new ATOM 0 HB3 ASP A 73 18.106 -3.307 0.557 1.00 24.42 H new ATOM 1131 N ARG A 74 16.377 -0.457 3.743 1.00 43.32 N ATOM 1132 CA ARG A 74 16.570 0.373 4.949 1.00 11.02 C ATOM 1133 C ARG A 74 15.205 0.690 5.612 1.00 35.21 C ATOM 1134 O ARG A 74 14.153 0.230 5.151 1.00 40.15 O ATOM 1135 CB ARG A 74 17.346 1.670 4.525 1.00 23.24 C ATOM 1136 CG ARG A 74 18.217 2.336 5.624 1.00 62.32 C ATOM 1137 CD ARG A 74 19.095 3.472 5.076 1.00 74.32 C ATOM 1138 NE ARG A 74 20.045 2.986 4.049 1.00 42.12 N ATOM 1139 CZ ARG A 74 19.967 3.228 2.729 1.00 31.52 C ATOM 1140 NH1 ARG A 74 18.983 3.973 2.224 1.00 22.51 N ATOM 1141 NH2 ARG A 74 20.878 2.707 1.923 1.00 41.33 N ATOM 0 H ARG A 74 15.469 -0.338 3.294 1.00 43.32 H new ATOM 0 HA ARG A 74 17.157 -0.159 5.698 1.00 11.02 H new ATOM 0 HB2 ARG A 74 17.989 1.424 3.680 1.00 23.24 H new ATOM 0 HB3 ARG A 74 16.621 2.403 4.171 1.00 23.24 H new ATOM 0 HG2 ARG A 74 17.569 2.729 6.407 1.00 62.32 H new ATOM 0 HG3 ARG A 74 18.853 1.581 6.085 1.00 62.32 H new ATOM 0 HD2 ARG A 74 18.460 4.247 4.646 1.00 74.32 H new ATOM 0 HD3 ARG A 74 19.649 3.931 5.895 1.00 74.32 H new ATOM 0 HE ARG A 74 20.828 2.417 4.372 1.00 42.12 H new ATOM 0 HH11 ARG A 74 18.275 4.369 2.842 1.00 22.51 H new ATOM 0 HH12 ARG A 74 18.939 4.147 1.220 1.00 22.51 H new ATOM 0 HH21 ARG A 74 21.627 2.130 2.305 1.00 41.33 H new ATOM 0 HH22 ARG A 74 20.831 2.882 0.919 1.00 41.33 H new ATOM 1155 N THR A 75 15.256 1.516 6.668 1.00 33.12 N ATOM 1156 CA THR A 75 14.095 1.980 7.431 1.00 31.34 C ATOM 1157 C THR A 75 14.301 3.476 7.687 1.00 5.21 C ATOM 1158 O THR A 75 15.405 3.896 8.062 1.00 20.51 O ATOM 1159 CB THR A 75 13.915 1.208 8.776 1.00 21.14 C ATOM 1160 OG1 THR A 75 13.829 -0.201 8.504 1.00 24.30 O ATOM 1161 CG2 THR A 75 12.656 1.658 9.551 1.00 72.21 C ATOM 0 H THR A 75 16.136 1.889 7.023 1.00 33.12 H new ATOM 0 HA THR A 75 13.184 1.794 6.861 1.00 31.34 H new ATOM 0 HB THR A 75 14.780 1.429 9.402 1.00 21.14 H new ATOM 0 HG1 THR A 75 13.032 -0.570 8.939 1.00 24.30 H new ATOM 0 HG21 THR A 75 12.577 1.091 10.478 1.00 72.21 H new ATOM 0 HG22 THR A 75 12.731 2.721 9.781 1.00 72.21 H new ATOM 0 HG23 THR A 75 11.770 1.481 8.941 1.00 72.21 H new ATOM 1169 N VAL A 76 13.246 4.273 7.494 1.00 34.20 N ATOM 1170 CA VAL A 76 13.368 5.738 7.319 1.00 60.13 C ATOM 1171 C VAL A 76 12.166 6.484 7.914 1.00 51.54 C ATOM 1172 O VAL A 76 11.120 5.897 8.194 1.00 2.42 O ATOM 1173 CB VAL A 76 13.525 6.134 5.796 1.00 23.24 C ATOM 1174 CG1 VAL A 76 14.915 5.764 5.231 1.00 2.21 C ATOM 1175 CG2 VAL A 76 12.407 5.499 4.947 1.00 63.54 C ATOM 0 H VAL A 76 12.286 3.932 7.454 1.00 34.20 H new ATOM 0 HA VAL A 76 14.269 6.035 7.856 1.00 60.13 H new ATOM 0 HB VAL A 76 13.435 7.219 5.740 1.00 23.24 H new ATOM 0 HG11 VAL A 76 14.971 6.057 4.183 1.00 2.21 H new ATOM 0 HG12 VAL A 76 15.688 6.286 5.795 1.00 2.21 H new ATOM 0 HG13 VAL A 76 15.068 4.688 5.316 1.00 2.21 H new ATOM 0 HG21 VAL A 76 12.536 5.785 3.903 1.00 63.54 H new ATOM 0 HG22 VAL A 76 12.456 4.414 5.034 1.00 63.54 H new ATOM 0 HG23 VAL A 76 11.437 5.848 5.302 1.00 63.54 H new ATOM 1185 N ARG A 77 12.361 7.789 8.112 1.00 12.45 N ATOM 1186 CA ARG A 77 11.317 8.707 8.562 1.00 55.51 C ATOM 1187 C ARG A 77 10.411 9.073 7.371 1.00 61.12 C ATOM 1188 O ARG A 77 10.899 9.547 6.344 1.00 34.52 O ATOM 1189 CB ARG A 77 11.986 9.973 9.196 1.00 44.53 C ATOM 1190 CG ARG A 77 11.020 11.030 9.812 1.00 53.00 C ATOM 1191 CD ARG A 77 10.515 12.093 8.820 1.00 63.01 C ATOM 1192 NE ARG A 77 11.590 13.018 8.397 1.00 55.42 N ATOM 1193 CZ ARG A 77 12.106 13.117 7.159 1.00 32.03 C ATOM 1194 NH1 ARG A 77 11.674 12.344 6.165 1.00 23.50 N ATOM 1195 NH2 ARG A 77 13.062 14.000 6.925 1.00 21.02 N ATOM 0 H ARG A 77 13.262 8.243 7.962 1.00 12.45 H new ATOM 0 HA ARG A 77 10.694 8.237 9.323 1.00 55.51 H new ATOM 0 HB2 ARG A 77 12.673 9.643 9.975 1.00 44.53 H new ATOM 0 HB3 ARG A 77 12.585 10.463 8.429 1.00 44.53 H new ATOM 0 HG2 ARG A 77 10.161 10.512 10.238 1.00 53.00 H new ATOM 0 HG3 ARG A 77 11.529 11.532 10.634 1.00 53.00 H new ATOM 0 HD2 ARG A 77 10.097 11.599 7.943 1.00 63.01 H new ATOM 0 HD3 ARG A 77 9.708 12.663 9.280 1.00 63.01 H new ATOM 0 HE ARG A 77 11.975 13.637 9.110 1.00 55.42 H new ATOM 0 HH11 ARG A 77 10.937 11.659 6.335 1.00 23.50 H new ATOM 0 HH12 ARG A 77 12.080 12.436 5.234 1.00 23.50 H new ATOM 0 HH21 ARG A 77 13.401 14.597 7.679 1.00 21.02 H new ATOM 0 HH22 ARG A 77 13.461 14.084 5.990 1.00 21.02 H new ATOM 1209 N TYR A 78 9.108 8.807 7.515 1.00 43.15 N ATOM 1210 CA TYR A 78 8.052 9.309 6.609 1.00 3.04 C ATOM 1211 C TYR A 78 7.335 10.494 7.278 1.00 55.55 C ATOM 1212 O TYR A 78 7.356 10.629 8.503 1.00 61.11 O ATOM 1213 CB TYR A 78 7.020 8.193 6.265 1.00 50.11 C ATOM 1214 CG TYR A 78 7.452 7.198 5.167 1.00 62.24 C ATOM 1215 CD1 TYR A 78 8.651 6.495 5.253 1.00 64.44 C ATOM 1216 CD2 TYR A 78 6.639 6.945 4.050 1.00 51.34 C ATOM 1217 CE1 TYR A 78 9.022 5.588 4.276 1.00 52.03 C ATOM 1218 CE2 TYR A 78 7.006 6.035 3.078 1.00 73.42 C ATOM 1219 CZ TYR A 78 8.200 5.361 3.196 1.00 32.33 C ATOM 1220 OH TYR A 78 8.572 4.441 2.232 1.00 44.42 O ATOM 0 H TYR A 78 8.745 8.229 8.273 1.00 43.15 H new ATOM 0 HA TYR A 78 8.519 9.630 5.678 1.00 3.04 H new ATOM 0 HB2 TYR A 78 6.803 7.631 7.174 1.00 50.11 H new ATOM 0 HB3 TYR A 78 6.089 8.668 5.954 1.00 50.11 H new ATOM 0 HD1 TYR A 78 9.303 6.661 6.098 1.00 64.44 H new ATOM 0 HD2 TYR A 78 5.704 7.475 3.949 1.00 51.34 H new ATOM 0 HE1 TYR A 78 9.959 5.057 4.361 1.00 52.03 H new ATOM 0 HE2 TYR A 78 6.361 5.854 2.231 1.00 73.42 H new ATOM 0 HH TYR A 78 7.882 4.398 1.537 1.00 44.42 H new ATOM 1230 N LEU A 79 6.726 11.356 6.466 1.00 32.10 N ATOM 1231 CA LEU A 79 5.874 12.455 6.948 1.00 42.44 C ATOM 1232 C LEU A 79 4.408 12.150 6.630 1.00 31.43 C ATOM 1233 O LEU A 79 4.073 11.770 5.496 1.00 23.42 O ATOM 1234 CB LEU A 79 6.310 13.813 6.331 1.00 1.14 C ATOM 1235 CG LEU A 79 7.643 14.422 6.880 1.00 65.53 C ATOM 1236 CD1 LEU A 79 7.920 15.807 6.264 1.00 12.11 C ATOM 1237 CD2 LEU A 79 7.639 14.501 8.426 1.00 23.44 C ATOM 0 H LEU A 79 6.806 11.316 5.450 1.00 32.10 H new ATOM 0 HA LEU A 79 5.988 12.539 8.029 1.00 42.44 H new ATOM 0 HB2 LEU A 79 6.410 13.684 5.253 1.00 1.14 H new ATOM 0 HB3 LEU A 79 5.510 14.536 6.493 1.00 1.14 H new ATOM 0 HG LEU A 79 8.450 13.752 6.583 1.00 65.53 H new ATOM 0 HD11 LEU A 79 8.853 16.204 6.665 1.00 12.11 H new ATOM 0 HD12 LEU A 79 8.001 15.714 5.181 1.00 12.11 H new ATOM 0 HD13 LEU A 79 7.102 16.485 6.509 1.00 12.11 H new ATOM 0 HD21 LEU A 79 8.580 14.929 8.771 1.00 23.44 H new ATOM 0 HD22 LEU A 79 6.812 15.130 8.756 1.00 23.44 H new ATOM 0 HD23 LEU A 79 7.522 13.500 8.841 1.00 23.44 H new ATOM 1249 N HIS A 80 3.547 12.334 7.646 1.00 34.31 N ATOM 1250 CA HIS A 80 2.120 12.045 7.563 1.00 64.25 C ATOM 1251 C HIS A 80 1.413 13.245 6.934 1.00 53.01 C ATOM 1252 O HIS A 80 1.176 14.268 7.588 1.00 41.12 O ATOM 1253 CB HIS A 80 1.574 11.733 8.979 1.00 53.45 C ATOM 1254 CG HIS A 80 0.110 11.380 9.030 1.00 3.32 C ATOM 1255 ND1 HIS A 80 -0.698 11.796 10.058 1.00 12.34 N ATOM 1256 CD2 HIS A 80 -0.626 10.634 8.170 1.00 45.15 C ATOM 1257 CE1 HIS A 80 -1.888 11.293 9.800 1.00 11.41 C ATOM 1258 NE2 HIS A 80 -1.888 10.587 8.672 1.00 13.12 N ATOM 0 H HIS A 80 3.835 12.693 8.556 1.00 34.31 H new ATOM 0 HA HIS A 80 1.937 11.171 6.938 1.00 64.25 H new ATOM 0 HB2 HIS A 80 2.147 10.907 9.400 1.00 53.45 H new ATOM 0 HB3 HIS A 80 1.747 12.599 9.618 1.00 53.45 H new ATOM 0 HD1 HIS A 80 -0.433 12.374 10.855 1.00 12.34 H new ATOM 0 HD2 HIS A 80 -0.277 10.167 7.261 1.00 45.15 H new ATOM 0 HE1 HIS A 80 -2.756 11.436 10.426 1.00 11.41 H new ATOM 1266 N VAL A 81 1.113 13.109 5.645 1.00 42.22 N ATOM 1267 CA VAL A 81 0.540 14.192 4.838 1.00 13.14 C ATOM 1268 C VAL A 81 -0.985 14.089 4.743 1.00 3.41 C ATOM 1269 O VAL A 81 -1.650 15.107 4.610 1.00 42.10 O ATOM 1270 CB VAL A 81 1.184 14.222 3.407 1.00 44.12 C ATOM 1271 CG1 VAL A 81 2.708 14.494 3.508 1.00 2.14 C ATOM 1272 CG2 VAL A 81 0.889 12.916 2.619 1.00 75.22 C ATOM 0 H VAL A 81 1.259 12.243 5.126 1.00 42.22 H new ATOM 0 HA VAL A 81 0.772 15.129 5.343 1.00 13.14 H new ATOM 0 HB VAL A 81 0.728 15.038 2.847 1.00 44.12 H new ATOM 0 HG11 VAL A 81 3.141 14.512 2.508 1.00 2.14 H new ATOM 0 HG12 VAL A 81 2.875 15.456 3.993 1.00 2.14 H new ATOM 0 HG13 VAL A 81 3.180 13.706 4.094 1.00 2.14 H new ATOM 0 HG21 VAL A 81 1.351 12.974 1.633 1.00 75.22 H new ATOM 0 HG22 VAL A 81 1.297 12.063 3.162 1.00 75.22 H new ATOM 0 HG23 VAL A 81 -0.188 12.793 2.508 1.00 75.22 H new ATOM 1282 N ALA A 82 -1.537 12.867 4.829 1.00 74.14 N ATOM 1283 CA ALA A 82 -2.986 12.643 4.631 1.00 61.12 C ATOM 1284 C ALA A 82 -3.506 11.474 5.470 1.00 75.33 C ATOM 1285 O ALA A 82 -2.736 10.657 5.949 1.00 60.00 O ATOM 1286 CB ALA A 82 -3.287 12.409 3.138 1.00 63.04 C ATOM 0 H ALA A 82 -1.007 12.020 5.033 1.00 74.14 H new ATOM 0 HA ALA A 82 -3.507 13.540 4.967 1.00 61.12 H new ATOM 0 HB1 ALA A 82 -4.356 12.245 3.004 1.00 63.04 H new ATOM 0 HB2 ALA A 82 -2.979 13.282 2.563 1.00 63.04 H new ATOM 0 HB3 ALA A 82 -2.739 11.534 2.789 1.00 63.04 H new ATOM 1292 N THR A 83 -4.835 11.428 5.642 1.00 21.24 N ATOM 1293 CA THR A 83 -5.549 10.308 6.264 1.00 71.50 C ATOM 1294 C THR A 83 -6.807 10.039 5.422 1.00 23.30 C ATOM 1295 O THR A 83 -7.773 10.804 5.461 1.00 50.43 O ATOM 1296 CB THR A 83 -5.930 10.599 7.761 1.00 3.32 C ATOM 1297 OG1 THR A 83 -4.746 10.905 8.512 1.00 23.43 O ATOM 1298 CG2 THR A 83 -6.650 9.404 8.422 1.00 12.43 C ATOM 0 H THR A 83 -5.454 12.183 5.347 1.00 21.24 H new ATOM 0 HA THR A 83 -4.900 9.433 6.286 1.00 71.50 H new ATOM 0 HB THR A 83 -6.614 11.448 7.762 1.00 3.32 H new ATOM 0 HG1 THR A 83 -3.967 10.507 8.071 1.00 23.43 H new ATOM 0 HG21 THR A 83 -6.893 9.652 9.455 1.00 12.43 H new ATOM 0 HG22 THR A 83 -7.567 9.185 7.876 1.00 12.43 H new ATOM 0 HG23 THR A 83 -5.998 8.530 8.402 1.00 12.43 H new ATOM 1306 N LEU A 84 -6.753 8.976 4.623 1.00 72.33 N ATOM 1307 CA LEU A 84 -7.828 8.610 3.696 1.00 63.42 C ATOM 1308 C LEU A 84 -8.967 7.922 4.488 1.00 52.25 C ATOM 1309 O LEU A 84 -8.871 6.752 4.848 1.00 1.45 O ATOM 1310 CB LEU A 84 -7.242 7.689 2.576 1.00 71.22 C ATOM 1311 CG LEU A 84 -5.876 8.155 1.950 1.00 22.13 C ATOM 1312 CD1 LEU A 84 -5.406 7.217 0.821 1.00 52.22 C ATOM 1313 CD2 LEU A 84 -5.932 9.621 1.469 1.00 30.44 C ATOM 0 H LEU A 84 -5.958 8.338 4.598 1.00 72.33 H new ATOM 0 HA LEU A 84 -8.248 9.493 3.214 1.00 63.42 H new ATOM 0 HB2 LEU A 84 -7.109 6.689 2.988 1.00 71.22 H new ATOM 0 HB3 LEU A 84 -7.978 7.609 1.776 1.00 71.22 H new ATOM 0 HG LEU A 84 -5.136 8.100 2.748 1.00 22.13 H new ATOM 0 HD11 LEU A 84 -4.459 7.578 0.419 1.00 52.22 H new ATOM 0 HD12 LEU A 84 -5.272 6.210 1.217 1.00 52.22 H new ATOM 0 HD13 LEU A 84 -6.154 7.199 0.028 1.00 52.22 H new ATOM 0 HD21 LEU A 84 -4.968 9.902 1.044 1.00 30.44 H new ATOM 0 HD22 LEU A 84 -6.708 9.726 0.710 1.00 30.44 H new ATOM 0 HD23 LEU A 84 -6.160 10.272 2.313 1.00 30.44 H new ATOM 1325 N SER A 85 -10.014 8.706 4.780 1.00 15.33 N ATOM 1326 CA SER A 85 -11.147 8.316 5.642 1.00 64.44 C ATOM 1327 C SER A 85 -12.307 7.738 4.802 1.00 31.04 C ATOM 1328 O SER A 85 -12.774 8.379 3.861 1.00 31.32 O ATOM 1329 CB SER A 85 -11.611 9.568 6.432 1.00 70.44 C ATOM 1330 OG SER A 85 -12.733 9.297 7.255 1.00 20.40 O ATOM 0 H SER A 85 -10.102 9.655 4.415 1.00 15.33 H new ATOM 0 HA SER A 85 -10.831 7.536 6.334 1.00 64.44 H new ATOM 0 HB2 SER A 85 -10.789 9.931 7.049 1.00 70.44 H new ATOM 0 HB3 SER A 85 -11.860 10.365 5.732 1.00 70.44 H new ATOM 0 HG SER A 85 -12.991 10.111 7.735 1.00 20.40 H new ATOM 1336 N PHE A 86 -12.781 6.540 5.178 1.00 32.51 N ATOM 1337 CA PHE A 86 -13.813 5.787 4.432 1.00 63.34 C ATOM 1338 C PHE A 86 -14.571 4.839 5.381 1.00 34.43 C ATOM 1339 O PHE A 86 -14.426 4.912 6.607 1.00 1.45 O ATOM 1340 CB PHE A 86 -13.172 4.997 3.245 1.00 51.32 C ATOM 1341 CG PHE A 86 -12.087 3.986 3.639 1.00 53.11 C ATOM 1342 CD1 PHE A 86 -10.771 4.397 3.845 1.00 32.12 C ATOM 1343 CD2 PHE A 86 -12.385 2.633 3.818 1.00 54.13 C ATOM 1344 CE1 PHE A 86 -9.797 3.501 4.218 1.00 31.12 C ATOM 1345 CE2 PHE A 86 -11.405 1.734 4.189 1.00 65.15 C ATOM 1346 CZ PHE A 86 -10.112 2.170 4.392 1.00 42.30 C ATOM 0 H PHE A 86 -12.458 6.058 6.017 1.00 32.51 H new ATOM 0 HA PHE A 86 -14.527 6.496 4.013 1.00 63.34 H new ATOM 0 HB2 PHE A 86 -13.963 4.467 2.714 1.00 51.32 H new ATOM 0 HB3 PHE A 86 -12.741 5.713 2.545 1.00 51.32 H new ATOM 0 HD1 PHE A 86 -10.512 5.437 3.709 1.00 32.12 H new ATOM 0 HD2 PHE A 86 -13.396 2.285 3.664 1.00 54.13 H new ATOM 0 HE1 PHE A 86 -8.784 3.840 4.375 1.00 31.12 H new ATOM 0 HE2 PHE A 86 -11.650 0.690 4.320 1.00 65.15 H new ATOM 0 HZ PHE A 86 -9.346 1.468 4.687 1.00 42.30 H new ATOM 1356 N ASP A 87 -15.404 3.970 4.795 1.00 34.32 N ATOM 1357 CA ASP A 87 -16.100 2.896 5.526 1.00 74.41 C ATOM 1358 C ASP A 87 -15.762 1.552 4.861 1.00 25.11 C ATOM 1359 O ASP A 87 -15.515 1.503 3.648 1.00 44.43 O ATOM 1360 CB ASP A 87 -17.634 3.140 5.548 1.00 10.23 C ATOM 1361 CG ASP A 87 -18.310 3.004 4.165 1.00 11.30 C ATOM 1362 OD1 ASP A 87 -18.052 3.853 3.280 1.00 43.00 O ATOM 1363 OD2 ASP A 87 -19.084 2.040 3.953 1.00 25.20 O ATOM 0 H ASP A 87 -15.617 3.989 3.798 1.00 34.32 H new ATOM 0 HA ASP A 87 -15.765 2.883 6.563 1.00 74.41 H new ATOM 0 HB2 ASP A 87 -18.095 2.433 6.238 1.00 10.23 H new ATOM 0 HB3 ASP A 87 -17.827 4.139 5.939 1.00 10.23 H new ATOM 1368 N LEU A 88 -15.737 0.482 5.656 1.00 54.42 N ATOM 1369 CA LEU A 88 -15.409 -0.868 5.170 1.00 73.34 C ATOM 1370 C LEU A 88 -16.018 -1.906 6.121 1.00 61.11 C ATOM 1371 O LEU A 88 -15.931 -1.723 7.337 1.00 35.24 O ATOM 1372 CB LEU A 88 -13.866 -1.059 5.075 1.00 2.24 C ATOM 1373 CG LEU A 88 -13.382 -2.346 4.329 1.00 55.31 C ATOM 1374 CD1 LEU A 88 -13.806 -2.320 2.844 1.00 0.14 C ATOM 1375 CD2 LEU A 88 -11.865 -2.530 4.479 1.00 14.03 C ATOM 0 H LEU A 88 -15.943 0.521 6.654 1.00 54.42 H new ATOM 0 HA LEU A 88 -15.825 -1.000 4.171 1.00 73.34 H new ATOM 0 HB2 LEU A 88 -13.442 -0.190 4.572 1.00 2.24 H new ATOM 0 HB3 LEU A 88 -13.458 -1.073 6.086 1.00 2.24 H new ATOM 0 HG LEU A 88 -13.865 -3.207 4.792 1.00 55.31 H new ATOM 0 HD11 LEU A 88 -13.456 -3.226 2.350 1.00 0.14 H new ATOM 0 HD12 LEU A 88 -14.893 -2.266 2.777 1.00 0.14 H new ATOM 0 HD13 LEU A 88 -13.369 -1.449 2.356 1.00 0.14 H new ATOM 0 HD21 LEU A 88 -11.554 -3.432 3.951 1.00 14.03 H new ATOM 0 HD22 LEU A 88 -11.350 -1.667 4.057 1.00 14.03 H new ATOM 0 HD23 LEU A 88 -11.612 -2.622 5.535 1.00 14.03 H new ATOM 1387 N ASP A 89 -16.631 -2.970 5.544 1.00 34.31 N ATOM 1388 CA ASP A 89 -17.308 -4.076 6.280 1.00 41.34 C ATOM 1389 C ASP A 89 -18.601 -3.579 6.982 1.00 4.20 C ATOM 1390 O ASP A 89 -19.722 -3.909 6.562 1.00 20.32 O ATOM 1391 CB ASP A 89 -16.339 -4.765 7.291 1.00 14.32 C ATOM 1392 CG ASP A 89 -16.970 -5.961 8.031 1.00 51.41 C ATOM 1393 OD1 ASP A 89 -16.966 -7.089 7.480 1.00 20.44 O ATOM 1394 OD2 ASP A 89 -17.470 -5.787 9.163 1.00 73.21 O ATOM 0 H ASP A 89 -16.671 -3.089 4.532 1.00 34.31 H new ATOM 0 HA ASP A 89 -17.601 -4.827 5.546 1.00 41.34 H new ATOM 0 HB2 ASP A 89 -15.452 -5.106 6.757 1.00 14.32 H new ATOM 0 HB3 ASP A 89 -16.007 -4.029 8.023 1.00 14.32 H new ATOM 1399 N GLY A 90 -18.417 -2.788 8.046 1.00 2.43 N ATOM 1400 CA GLY A 90 -19.511 -2.132 8.777 1.00 2.02 C ATOM 1401 C GLY A 90 -18.972 -1.142 9.804 1.00 33.51 C ATOM 1402 O GLY A 90 -19.685 -0.733 10.722 1.00 45.02 O ATOM 0 H GLY A 90 -17.494 -2.582 8.429 1.00 2.43 H new ATOM 0 HA2 GLY A 90 -20.162 -1.612 8.074 1.00 2.02 H new ATOM 0 HA3 GLY A 90 -20.120 -2.885 9.278 1.00 2.02 H new ATOM 1406 N GLU A 91 -17.695 -0.751 9.623 1.00 51.04 N ATOM 1407 CA GLU A 91 -16.924 0.076 10.568 1.00 70.25 C ATOM 1408 C GLU A 91 -16.215 1.211 9.801 1.00 73.01 C ATOM 1409 O GLU A 91 -15.762 1.019 8.661 1.00 3.42 O ATOM 1410 CB GLU A 91 -15.902 -0.836 11.328 1.00 32.05 C ATOM 1411 CG GLU A 91 -15.000 -1.683 10.395 1.00 25.40 C ATOM 1412 CD GLU A 91 -14.156 -2.756 11.106 1.00 11.23 C ATOM 1413 OE1 GLU A 91 -14.671 -3.870 11.344 1.00 51.20 O ATOM 1414 OE2 GLU A 91 -12.977 -2.491 11.430 1.00 70.35 O ATOM 0 H GLU A 91 -17.159 -1.009 8.794 1.00 51.04 H new ATOM 0 HA GLU A 91 -17.586 0.534 11.303 1.00 70.25 H new ATOM 0 HB2 GLU A 91 -15.270 -0.210 11.958 1.00 32.05 H new ATOM 0 HB3 GLU A 91 -16.450 -1.505 11.992 1.00 32.05 H new ATOM 0 HG2 GLU A 91 -15.629 -2.171 9.651 1.00 25.40 H new ATOM 0 HG3 GLU A 91 -14.330 -1.013 9.856 1.00 25.40 H new ATOM 1421 N SER A 92 -16.144 2.397 10.429 1.00 25.15 N ATOM 1422 CA SER A 92 -15.528 3.591 9.836 1.00 12.42 C ATOM 1423 C SER A 92 -13.996 3.449 9.879 1.00 55.23 C ATOM 1424 O SER A 92 -13.381 3.591 10.941 1.00 65.01 O ATOM 1425 CB SER A 92 -16.011 4.851 10.603 1.00 1.31 C ATOM 1426 OG SER A 92 -15.526 6.055 10.027 1.00 11.22 O ATOM 0 H SER A 92 -16.515 2.553 11.366 1.00 25.15 H new ATOM 0 HA SER A 92 -15.826 3.696 8.793 1.00 12.42 H new ATOM 0 HB2 SER A 92 -17.101 4.870 10.615 1.00 1.31 H new ATOM 0 HB3 SER A 92 -15.682 4.790 11.640 1.00 1.31 H new ATOM 0 HG SER A 92 -15.857 6.820 10.542 1.00 11.22 H new ATOM 1432 N ARG A 93 -13.402 3.094 8.731 1.00 22.10 N ATOM 1433 CA ARG A 93 -11.959 2.823 8.617 1.00 71.40 C ATOM 1434 C ARG A 93 -11.228 3.987 7.950 1.00 12.04 C ATOM 1435 O ARG A 93 -11.700 4.536 6.965 1.00 3.40 O ATOM 1436 CB ARG A 93 -11.714 1.524 7.808 1.00 5.14 C ATOM 1437 CG ARG A 93 -12.236 0.220 8.451 1.00 54.41 C ATOM 1438 CD ARG A 93 -11.556 -0.097 9.799 1.00 53.14 C ATOM 1439 NE ARG A 93 -12.132 0.666 10.921 1.00 43.12 N ATOM 1440 CZ ARG A 93 -11.488 0.993 12.052 1.00 33.31 C ATOM 1441 NH1 ARG A 93 -10.217 0.656 12.238 1.00 3.34 N ATOM 1442 NH2 ARG A 93 -12.123 1.663 12.997 1.00 72.54 N ATOM 0 H ARG A 93 -13.909 2.986 7.852 1.00 22.10 H new ATOM 0 HA ARG A 93 -11.566 2.700 9.626 1.00 71.40 H new ATOM 0 HB2 ARG A 93 -12.180 1.635 6.829 1.00 5.14 H new ATOM 0 HB3 ARG A 93 -10.642 1.420 7.641 1.00 5.14 H new ATOM 0 HG2 ARG A 93 -13.312 0.301 8.603 1.00 54.41 H new ATOM 0 HG3 ARG A 93 -12.072 -0.609 7.763 1.00 54.41 H new ATOM 0 HD2 ARG A 93 -11.648 -1.163 10.005 1.00 53.14 H new ATOM 0 HD3 ARG A 93 -10.491 0.123 9.724 1.00 53.14 H new ATOM 0 HE ARG A 93 -13.101 0.971 10.830 1.00 43.12 H new ATOM 0 HH11 ARG A 93 -9.715 0.141 11.515 1.00 3.34 H new ATOM 0 HH12 ARG A 93 -9.743 0.913 13.104 1.00 3.34 H new ATOM 0 HH21 ARG A 93 -13.099 1.930 12.865 1.00 72.54 H new ATOM 0 HH22 ARG A 93 -11.638 1.914 13.858 1.00 72.54 H new ATOM 1456 N ASP A 94 -10.060 4.330 8.490 1.00 31.42 N ATOM 1457 CA ASP A 94 -9.176 5.360 7.925 1.00 72.23 C ATOM 1458 C ASP A 94 -7.755 4.798 7.778 1.00 11.54 C ATOM 1459 O ASP A 94 -7.220 4.182 8.707 1.00 14.42 O ATOM 1460 CB ASP A 94 -9.189 6.632 8.821 1.00 62.20 C ATOM 1461 CG ASP A 94 -8.686 6.388 10.261 1.00 74.14 C ATOM 1462 OD1 ASP A 94 -9.391 5.697 11.038 1.00 32.24 O ATOM 1463 OD2 ASP A 94 -7.588 6.868 10.621 1.00 13.21 O ATOM 0 H ASP A 94 -9.693 3.900 9.339 1.00 31.42 H new ATOM 0 HA ASP A 94 -9.537 5.645 6.937 1.00 72.23 H new ATOM 0 HB2 ASP A 94 -8.570 7.399 8.355 1.00 62.20 H new ATOM 0 HB3 ASP A 94 -10.205 7.025 8.863 1.00 62.20 H new ATOM 1468 N LEU A 95 -7.155 4.995 6.592 1.00 64.53 N ATOM 1469 CA LEU A 95 -5.758 4.613 6.325 1.00 62.42 C ATOM 1470 C LEU A 95 -4.933 5.879 6.172 1.00 41.40 C ATOM 1471 O LEU A 95 -5.314 6.779 5.431 1.00 51.43 O ATOM 1472 CB LEU A 95 -5.623 3.737 5.050 1.00 53.43 C ATOM 1473 CG LEU A 95 -6.431 2.403 5.032 1.00 43.43 C ATOM 1474 CD1 LEU A 95 -5.978 1.510 3.867 1.00 65.25 C ATOM 1475 CD2 LEU A 95 -6.363 1.656 6.380 1.00 2.42 C ATOM 0 H LEU A 95 -7.623 5.423 5.793 1.00 64.53 H new ATOM 0 HA LEU A 95 -5.398 4.015 7.162 1.00 62.42 H new ATOM 0 HB2 LEU A 95 -5.932 4.334 4.192 1.00 53.43 H new ATOM 0 HB3 LEU A 95 -4.569 3.499 4.910 1.00 53.43 H new ATOM 0 HG LEU A 95 -7.479 2.660 4.877 1.00 43.43 H new ATOM 0 HD11 LEU A 95 -6.554 0.585 3.873 1.00 65.25 H new ATOM 0 HD12 LEU A 95 -6.140 2.032 2.924 1.00 65.25 H new ATOM 0 HD13 LEU A 95 -4.919 1.279 3.977 1.00 65.25 H new ATOM 0 HD21 LEU A 95 -6.941 0.734 6.315 1.00 2.42 H new ATOM 0 HD22 LEU A 95 -5.325 1.417 6.612 1.00 2.42 H new ATOM 0 HD23 LEU A 95 -6.774 2.288 7.167 1.00 2.42 H new ATOM 1487 N HIS A 96 -3.800 5.934 6.853 1.00 23.02 N ATOM 1488 CA HIS A 96 -2.957 7.121 6.886 1.00 65.00 C ATOM 1489 C HIS A 96 -1.959 7.059 5.715 1.00 54.43 C ATOM 1490 O HIS A 96 -1.298 6.034 5.509 1.00 14.32 O ATOM 1491 CB HIS A 96 -2.243 7.197 8.254 1.00 74.14 C ATOM 1492 CG HIS A 96 -3.181 7.295 9.444 1.00 35.20 C ATOM 1493 ND1 HIS A 96 -3.202 8.401 10.252 1.00 30.41 N ATOM 1494 CD2 HIS A 96 -4.091 6.399 9.914 1.00 31.52 C ATOM 1495 CE1 HIS A 96 -4.102 8.155 11.185 1.00 71.04 C ATOM 1496 NE2 HIS A 96 -4.669 6.956 11.021 1.00 53.42 N ATOM 0 H HIS A 96 -3.437 5.154 7.401 1.00 23.02 H new ATOM 0 HA HIS A 96 -3.554 8.026 6.771 1.00 65.00 H new ATOM 0 HB2 HIS A 96 -1.615 6.314 8.373 1.00 74.14 H new ATOM 0 HB3 HIS A 96 -1.580 8.062 8.257 1.00 74.14 H new ATOM 0 HD2 HIS A 96 -4.315 5.430 9.492 1.00 31.52 H new ATOM 0 HE1 HIS A 96 -4.350 8.839 11.983 1.00 71.04 H new ATOM 0 HE2 HIS A 96 -5.392 6.538 11.607 1.00 53.42 H new ATOM 1504 N ALA A 97 -1.896 8.147 4.937 1.00 33.30 N ATOM 1505 CA ALA A 97 -1.044 8.262 3.750 1.00 34.23 C ATOM 1506 C ALA A 97 0.184 9.104 4.093 1.00 4.41 C ATOM 1507 O ALA A 97 0.059 10.239 4.581 1.00 12.33 O ATOM 1508 CB ALA A 97 -1.832 8.891 2.589 1.00 3.22 C ATOM 0 H ALA A 97 -2.446 8.986 5.119 1.00 33.30 H new ATOM 0 HA ALA A 97 -0.718 7.271 3.436 1.00 34.23 H new ATOM 0 HB1 ALA A 97 -1.188 8.971 1.713 1.00 3.22 H new ATOM 0 HB2 ALA A 97 -2.692 8.265 2.351 1.00 3.22 H new ATOM 0 HB3 ALA A 97 -2.176 9.884 2.878 1.00 3.22 H new ATOM 1514 N PHE A 98 1.363 8.534 3.846 1.00 24.35 N ATOM 1515 CA PHE A 98 2.649 9.166 4.141 1.00 74.12 C ATOM 1516 C PHE A 98 3.498 9.194 2.861 1.00 21.24 C ATOM 1517 O PHE A 98 3.105 8.647 1.826 1.00 35.44 O ATOM 1518 CB PHE A 98 3.426 8.372 5.246 1.00 54.23 C ATOM 1519 CG PHE A 98 2.599 7.802 6.404 1.00 23.40 C ATOM 1520 CD1 PHE A 98 1.970 6.566 6.287 1.00 33.12 C ATOM 1521 CD2 PHE A 98 2.486 8.473 7.611 1.00 42.44 C ATOM 1522 CE1 PHE A 98 1.253 6.027 7.338 1.00 3.33 C ATOM 1523 CE2 PHE A 98 1.769 7.931 8.659 1.00 33.32 C ATOM 1524 CZ PHE A 98 1.155 6.710 8.523 1.00 61.12 C ATOM 0 H PHE A 98 1.453 7.607 3.430 1.00 24.35 H new ATOM 0 HA PHE A 98 2.463 10.177 4.503 1.00 74.12 H new ATOM 0 HB2 PHE A 98 3.950 7.546 4.765 1.00 54.23 H new ATOM 0 HB3 PHE A 98 4.187 9.031 5.665 1.00 54.23 H new ATOM 0 HD1 PHE A 98 2.044 6.019 5.359 1.00 33.12 H new ATOM 0 HD2 PHE A 98 2.965 9.433 7.734 1.00 42.44 H new ATOM 0 HE1 PHE A 98 0.770 5.068 7.226 1.00 3.33 H new ATOM 0 HE2 PHE A 98 1.690 8.470 9.591 1.00 33.32 H new ATOM 0 HZ PHE A 98 0.597 6.289 9.346 1.00 61.12 H new ATOM 1534 N ARG A 99 4.664 9.831 2.967 1.00 13.34 N ATOM 1535 CA ARG A 99 5.709 9.832 1.925 1.00 2.13 C ATOM 1536 C ARG A 99 7.022 10.288 2.570 1.00 73.12 C ATOM 1537 O ARG A 99 6.969 11.050 3.538 1.00 31.40 O ATOM 1538 CB ARG A 99 5.301 10.733 0.733 1.00 0.21 C ATOM 1539 CG ARG A 99 5.075 12.233 1.076 1.00 70.03 C ATOM 1540 CD ARG A 99 3.837 12.815 0.380 1.00 32.23 C ATOM 1541 NE ARG A 99 3.837 12.585 -1.078 1.00 45.03 N ATOM 1542 CZ ARG A 99 2.974 13.130 -1.950 1.00 15.24 C ATOM 1543 NH1 ARG A 99 2.022 13.978 -1.548 1.00 3.10 N ATOM 1544 NH2 ARG A 99 3.049 12.783 -3.224 1.00 25.52 N ATOM 0 H ARG A 99 4.920 10.373 3.792 1.00 13.34 H new ATOM 0 HA ARG A 99 5.840 8.830 1.517 1.00 2.13 H new ATOM 0 HB2 ARG A 99 6.074 10.666 -0.032 1.00 0.21 H new ATOM 0 HB3 ARG A 99 4.385 10.336 0.296 1.00 0.21 H new ATOM 0 HG2 ARG A 99 4.967 12.343 2.155 1.00 70.03 H new ATOM 0 HG3 ARG A 99 5.955 12.806 0.784 1.00 70.03 H new ATOM 0 HD2 ARG A 99 2.941 12.371 0.813 1.00 32.23 H new ATOM 0 HD3 ARG A 99 3.787 13.886 0.574 1.00 32.23 H new ATOM 0 HE ARG A 99 4.551 11.961 -1.454 1.00 45.03 H new ATOM 0 HH11 ARG A 99 1.941 14.223 -0.561 1.00 3.10 H new ATOM 0 HH12 ARG A 99 1.377 14.380 -2.228 1.00 3.10 H new ATOM 0 HH21 ARG A 99 3.754 12.112 -3.529 1.00 25.52 H new ATOM 0 HH22 ARG A 99 2.402 13.186 -3.901 1.00 25.52 H new ATOM 1558 N GLN A 100 8.170 9.822 2.013 1.00 64.25 N ATOM 1559 CA GLN A 100 9.515 9.891 2.651 1.00 72.12 C ATOM 1560 C GLN A 100 9.782 11.234 3.384 1.00 72.43 C ATOM 1561 O GLN A 100 9.703 11.277 4.612 1.00 51.44 O ATOM 1562 CB GLN A 100 10.630 9.577 1.584 1.00 44.30 C ATOM 1563 CG GLN A 100 11.426 8.258 1.806 1.00 23.14 C ATOM 1564 CD GLN A 100 12.596 8.360 2.801 1.00 61.41 C ATOM 1565 OE1 GLN A 100 13.624 7.712 2.616 1.00 2.23 O ATOM 1566 NE2 GLN A 100 12.449 9.110 3.888 1.00 22.21 N ATOM 0 H GLN A 100 8.189 9.381 1.094 1.00 64.25 H new ATOM 0 HA GLN A 100 9.543 9.130 3.430 1.00 72.12 H new ATOM 0 HB2 GLN A 100 10.164 9.537 0.600 1.00 44.30 H new ATOM 0 HB3 GLN A 100 11.336 10.407 1.569 1.00 44.30 H new ATOM 0 HG2 GLN A 100 10.736 7.491 2.158 1.00 23.14 H new ATOM 0 HG3 GLN A 100 11.815 7.921 0.845 1.00 23.14 H new ATOM 0 HE21 GLN A 100 11.590 9.642 4.028 1.00 22.21 H new ATOM 0 HE22 GLN A 100 13.195 9.153 4.582 1.00 22.21 H new ATOM 1575 N ALA A 101 10.071 12.318 2.653 1.00 10.53 N ATOM 1576 CA ALA A 101 10.128 13.672 3.244 1.00 70.01 C ATOM 1577 C ALA A 101 9.077 14.581 2.599 1.00 34.44 C ATOM 1578 O ALA A 101 8.005 14.822 3.160 1.00 11.22 O ATOM 1579 CB ALA A 101 11.548 14.257 3.104 1.00 52.43 C ATOM 0 H ALA A 101 10.269 12.290 1.653 1.00 10.53 H new ATOM 0 HA ALA A 101 9.899 13.606 4.308 1.00 70.01 H new ATOM 0 HB1 ALA A 101 11.576 15.254 3.543 1.00 52.43 H new ATOM 0 HB2 ALA A 101 12.259 13.613 3.621 1.00 52.43 H new ATOM 0 HB3 ALA A 101 11.814 14.318 2.049 1.00 52.43 H new ATOM 1585 N ALA A 102 9.378 15.020 1.371 1.00 14.15 N ATOM 1586 CA ALA A 102 8.635 16.076 0.674 1.00 12.01 C ATOM 1587 C ALA A 102 8.284 15.642 -0.752 1.00 53.34 C ATOM 1588 O ALA A 102 8.329 16.459 -1.681 1.00 31.12 O ATOM 1589 CB ALA A 102 9.465 17.378 0.700 1.00 15.30 C ATOM 0 H ALA A 102 10.155 14.646 0.826 1.00 14.15 H new ATOM 0 HA ALA A 102 7.690 16.262 1.184 1.00 12.01 H new ATOM 0 HB1 ALA A 102 8.919 18.168 0.184 1.00 15.30 H new ATOM 0 HB2 ALA A 102 9.643 17.676 1.733 1.00 15.30 H new ATOM 0 HB3 ALA A 102 10.420 17.211 0.201 1.00 15.30 H new ATOM 1595 N ASP A 103 7.909 14.357 -0.919 1.00 2.11 N ATOM 1596 CA ASP A 103 7.641 13.766 -2.251 1.00 35.04 C ATOM 1597 C ASP A 103 6.503 14.513 -2.967 1.00 63.10 C ATOM 1598 O ASP A 103 5.507 14.885 -2.343 1.00 13.30 O ATOM 1599 CB ASP A 103 7.282 12.258 -2.128 1.00 43.23 C ATOM 1600 CG ASP A 103 6.829 11.635 -3.466 1.00 23.14 C ATOM 1601 OD1 ASP A 103 7.692 11.314 -4.305 1.00 64.12 O ATOM 1602 OD2 ASP A 103 5.605 11.508 -3.698 1.00 72.51 O ATOM 0 H ASP A 103 7.784 13.704 -0.145 1.00 2.11 H new ATOM 0 HA ASP A 103 8.552 13.864 -2.842 1.00 35.04 H new ATOM 0 HB2 ASP A 103 8.149 11.713 -1.755 1.00 43.23 H new ATOM 0 HB3 ASP A 103 6.488 12.138 -1.390 1.00 43.23 H new ATOM 1607 N GLU A 104 6.680 14.739 -4.272 1.00 52.13 N ATOM 1608 CA GLU A 104 5.697 15.429 -5.127 1.00 74.10 C ATOM 1609 C GLU A 104 5.471 14.626 -6.424 1.00 10.20 C ATOM 1610 O GLU A 104 4.844 15.121 -7.365 1.00 61.25 O ATOM 1611 CB GLU A 104 6.157 16.886 -5.420 1.00 43.01 C ATOM 1612 CG GLU A 104 6.247 17.783 -4.160 1.00 12.41 C ATOM 1613 CD GLU A 104 6.562 19.253 -4.473 1.00 0.45 C ATOM 1614 OE1 GLU A 104 7.747 19.597 -4.632 1.00 24.32 O ATOM 1615 OE2 GLU A 104 5.621 20.071 -4.566 1.00 52.40 O ATOM 0 H GLU A 104 7.518 14.446 -4.775 1.00 52.13 H new ATOM 0 HA GLU A 104 4.744 15.490 -4.602 1.00 74.10 H new ATOM 0 HB2 GLU A 104 7.133 16.858 -5.904 1.00 43.01 H new ATOM 0 HB3 GLU A 104 5.463 17.340 -6.128 1.00 43.01 H new ATOM 0 HG2 GLU A 104 5.303 17.730 -3.618 1.00 12.41 H new ATOM 0 HG3 GLU A 104 7.017 17.388 -3.497 1.00 12.41 H new ATOM 1622 N SER A 105 5.945 13.360 -6.436 1.00 11.14 N ATOM 1623 CA SER A 105 5.744 12.420 -7.557 1.00 2.34 C ATOM 1624 C SER A 105 4.439 11.598 -7.373 1.00 20.32 C ATOM 1625 O SER A 105 4.246 10.570 -8.037 1.00 60.35 O ATOM 1626 CB SER A 105 6.986 11.494 -7.665 1.00 21.43 C ATOM 1627 OG SER A 105 6.955 10.698 -8.839 1.00 31.43 O ATOM 0 H SER A 105 6.480 12.962 -5.664 1.00 11.14 H new ATOM 0 HA SER A 105 5.634 12.981 -8.485 1.00 2.34 H new ATOM 0 HB2 SER A 105 7.892 12.100 -7.662 1.00 21.43 H new ATOM 0 HB3 SER A 105 7.033 10.847 -6.789 1.00 21.43 H new ATOM 0 HG SER A 105 6.040 10.384 -8.998 1.00 31.43 H new ATOM 1633 N ARG A 106 3.556 12.080 -6.454 1.00 3.23 N ATOM 1634 CA ARG A 106 2.210 11.497 -6.183 1.00 4.52 C ATOM 1635 C ARG A 106 2.321 10.123 -5.486 1.00 33.24 C ATOM 1636 O ARG A 106 1.330 9.412 -5.350 1.00 75.31 O ATOM 1637 CB ARG A 106 1.355 11.407 -7.489 1.00 4.52 C ATOM 1638 CG ARG A 106 1.200 12.747 -8.246 1.00 61.12 C ATOM 1639 CD ARG A 106 0.342 13.774 -7.488 1.00 31.11 C ATOM 1640 NE ARG A 106 0.424 15.124 -8.085 1.00 73.42 N ATOM 1641 CZ ARG A 106 -0.151 15.513 -9.238 1.00 34.22 C ATOM 1642 NH1 ARG A 106 -0.860 14.666 -9.974 1.00 12.32 N ATOM 1643 NH2 ARG A 106 -0.021 16.769 -9.637 1.00 65.23 N ATOM 0 H ARG A 106 3.761 12.894 -5.874 1.00 3.23 H new ATOM 0 HA ARG A 106 1.693 12.170 -5.499 1.00 4.52 H new ATOM 0 HB2 ARG A 106 1.811 10.677 -8.158 1.00 4.52 H new ATOM 0 HB3 ARG A 106 0.364 11.031 -7.235 1.00 4.52 H new ATOM 0 HG2 ARG A 106 2.188 13.171 -8.427 1.00 61.12 H new ATOM 0 HG3 ARG A 106 0.751 12.557 -9.221 1.00 61.12 H new ATOM 0 HD2 ARG A 106 -0.697 13.444 -7.484 1.00 31.11 H new ATOM 0 HD3 ARG A 106 0.667 13.819 -6.448 1.00 31.11 H new ATOM 0 HE ARG A 106 0.965 15.824 -7.577 1.00 73.42 H new ATOM 0 HH11 ARG A 106 -0.977 13.700 -9.669 1.00 12.32 H new ATOM 0 HH12 ARG A 106 -1.288 14.981 -10.845 1.00 12.32 H new ATOM 0 HH21 ARG A 106 0.511 17.431 -9.072 1.00 65.23 H new ATOM 0 HH22 ARG A 106 -0.453 17.074 -10.509 1.00 65.23 H new ATOM 1657 N THR A 107 3.526 9.801 -4.997 1.00 33.23 N ATOM 1658 CA THR A 107 3.828 8.504 -4.393 1.00 15.52 C ATOM 1659 C THR A 107 3.373 8.509 -2.916 1.00 22.40 C ATOM 1660 O THR A 107 4.086 8.989 -2.024 1.00 43.41 O ATOM 1661 CB THR A 107 5.356 8.190 -4.533 1.00 30.11 C ATOM 1662 OG1 THR A 107 5.743 8.271 -5.922 1.00 62.33 O ATOM 1663 CG2 THR A 107 5.728 6.803 -3.986 1.00 12.14 C ATOM 0 H THR A 107 4.321 10.440 -5.011 1.00 33.23 H new ATOM 0 HA THR A 107 3.285 7.714 -4.912 1.00 15.52 H new ATOM 0 HB THR A 107 5.891 8.932 -3.940 1.00 30.11 H new ATOM 0 HG1 THR A 107 6.700 8.076 -6.007 1.00 62.33 H new ATOM 0 HG21 THR A 107 6.799 6.639 -4.109 1.00 12.14 H new ATOM 0 HG22 THR A 107 5.471 6.748 -2.928 1.00 12.14 H new ATOM 0 HG23 THR A 107 5.178 6.037 -4.533 1.00 12.14 H new ATOM 1671 N LEU A 108 2.133 8.048 -2.703 1.00 23.25 N ATOM 1672 CA LEU A 108 1.497 7.973 -1.380 1.00 61.33 C ATOM 1673 C LEU A 108 1.515 6.531 -0.887 1.00 74.12 C ATOM 1674 O LEU A 108 0.958 5.648 -1.534 1.00 73.23 O ATOM 1675 CB LEU A 108 0.041 8.493 -1.461 1.00 61.44 C ATOM 1676 CG LEU A 108 -0.097 9.982 -1.897 1.00 42.13 C ATOM 1677 CD1 LEU A 108 -1.559 10.347 -2.170 1.00 35.20 C ATOM 1678 CD2 LEU A 108 0.529 10.915 -0.841 1.00 54.32 C ATOM 0 H LEU A 108 1.534 7.711 -3.457 1.00 23.25 H new ATOM 0 HA LEU A 108 2.050 8.597 -0.678 1.00 61.33 H new ATOM 0 HB2 LEU A 108 -0.514 7.871 -2.163 1.00 61.44 H new ATOM 0 HB3 LEU A 108 -0.429 8.370 -0.485 1.00 61.44 H new ATOM 0 HG LEU A 108 0.449 10.116 -2.831 1.00 42.13 H new ATOM 0 HD11 LEU A 108 -1.623 11.392 -2.472 1.00 35.20 H new ATOM 0 HD12 LEU A 108 -1.949 9.714 -2.967 1.00 35.20 H new ATOM 0 HD13 LEU A 108 -2.147 10.194 -1.265 1.00 35.20 H new ATOM 0 HD21 LEU A 108 0.423 11.951 -1.163 1.00 54.32 H new ATOM 0 HD22 LEU A 108 0.020 10.777 0.113 1.00 54.32 H new ATOM 0 HD23 LEU A 108 1.586 10.677 -0.726 1.00 54.32 H new ATOM 1690 N PHE A 109 2.143 6.309 0.261 1.00 1.32 N ATOM 1691 CA PHE A 109 2.286 4.983 0.855 1.00 44.55 C ATOM 1692 C PHE A 109 1.291 4.863 2.016 1.00 63.02 C ATOM 1693 O PHE A 109 1.406 5.587 3.014 1.00 23.21 O ATOM 1694 CB PHE A 109 3.752 4.773 1.330 1.00 40.45 C ATOM 1695 CG PHE A 109 4.051 3.376 1.887 1.00 23.01 C ATOM 1696 CD1 PHE A 109 3.951 2.246 1.069 1.00 53.22 C ATOM 1697 CD2 PHE A 109 4.435 3.190 3.221 1.00 42.01 C ATOM 1698 CE1 PHE A 109 4.217 0.981 1.569 1.00 12.24 C ATOM 1699 CE2 PHE A 109 4.701 1.925 3.716 1.00 51.15 C ATOM 1700 CZ PHE A 109 4.590 0.825 2.891 1.00 34.53 C ATOM 0 H PHE A 109 2.572 7.052 0.813 1.00 1.32 H new ATOM 0 HA PHE A 109 2.067 4.206 0.122 1.00 44.55 H new ATOM 0 HB2 PHE A 109 4.422 4.966 0.492 1.00 40.45 H new ATOM 0 HB3 PHE A 109 3.980 5.512 2.098 1.00 40.45 H new ATOM 0 HD1 PHE A 109 3.663 2.361 0.034 1.00 53.22 H new ATOM 0 HD2 PHE A 109 4.525 4.046 3.873 1.00 42.01 H new ATOM 0 HE1 PHE A 109 4.133 0.117 0.926 1.00 12.24 H new ATOM 0 HE2 PHE A 109 4.995 1.799 4.748 1.00 51.15 H new ATOM 0 HZ PHE A 109 4.795 -0.162 3.279 1.00 34.53 H new ATOM 1710 N VAL A 110 0.292 3.977 1.858 1.00 73.52 N ATOM 1711 CA VAL A 110 -0.660 3.629 2.928 1.00 71.25 C ATOM 1712 C VAL A 110 -0.374 2.188 3.420 1.00 73.23 C ATOM 1713 O VAL A 110 -0.759 1.199 2.777 1.00 42.44 O ATOM 1714 CB VAL A 110 -2.187 3.785 2.502 1.00 12.42 C ATOM 1715 CG1 VAL A 110 -2.589 5.266 2.353 1.00 13.34 C ATOM 1716 CG2 VAL A 110 -2.518 3.013 1.205 1.00 14.53 C ATOM 0 H VAL A 110 0.122 3.481 0.983 1.00 73.52 H new ATOM 0 HA VAL A 110 -0.507 4.343 3.737 1.00 71.25 H new ATOM 0 HB VAL A 110 -2.772 3.346 3.310 1.00 12.42 H new ATOM 0 HG11 VAL A 110 -3.637 5.331 2.062 1.00 13.34 H new ATOM 0 HG12 VAL A 110 -2.444 5.780 3.303 1.00 13.34 H new ATOM 0 HG13 VAL A 110 -1.970 5.736 1.589 1.00 13.34 H new ATOM 0 HG21 VAL A 110 -3.571 3.151 0.958 1.00 14.53 H new ATOM 0 HG22 VAL A 110 -1.901 3.390 0.390 1.00 14.53 H new ATOM 0 HG23 VAL A 110 -2.316 1.952 1.352 1.00 14.53 H new ATOM 1726 N PRO A 111 0.388 2.029 4.540 1.00 21.52 N ATOM 1727 CA PRO A 111 0.431 0.755 5.247 1.00 21.24 C ATOM 1728 C PRO A 111 -0.882 0.595 6.032 1.00 54.30 C ATOM 1729 O PRO A 111 -1.305 1.516 6.740 1.00 75.34 O ATOM 1730 CB PRO A 111 1.677 0.890 6.164 1.00 10.14 C ATOM 1731 CG PRO A 111 1.816 2.364 6.418 1.00 25.41 C ATOM 1732 CD PRO A 111 1.250 3.060 5.185 1.00 52.12 C ATOM 0 HA PRO A 111 0.514 -0.128 4.613 1.00 21.24 H new ATOM 0 HB2 PRO A 111 1.543 0.340 7.095 1.00 10.14 H new ATOM 0 HB3 PRO A 111 2.567 0.487 5.681 1.00 10.14 H new ATOM 0 HG2 PRO A 111 1.272 2.658 7.316 1.00 25.41 H new ATOM 0 HG3 PRO A 111 2.860 2.636 6.574 1.00 25.41 H new ATOM 0 HD2 PRO A 111 0.675 3.945 5.457 1.00 52.12 H new ATOM 0 HD3 PRO A 111 2.044 3.390 4.515 1.00 52.12 H new ATOM 1740 N PHE A 112 -1.558 -0.536 5.834 1.00 54.33 N ATOM 1741 CA PHE A 112 -2.714 -0.940 6.639 1.00 13.45 C ATOM 1742 C PHE A 112 -2.422 -2.287 7.297 1.00 24.21 C ATOM 1743 O PHE A 112 -1.291 -2.755 7.259 1.00 60.24 O ATOM 1744 CB PHE A 112 -4.028 -0.950 5.811 1.00 61.43 C ATOM 1745 CG PHE A 112 -4.138 -1.924 4.634 1.00 1.05 C ATOM 1746 CD1 PHE A 112 -3.549 -1.638 3.403 1.00 13.25 C ATOM 1747 CD2 PHE A 112 -4.900 -3.095 4.740 1.00 10.21 C ATOM 1748 CE1 PHE A 112 -3.714 -2.487 2.326 1.00 61.30 C ATOM 1749 CE2 PHE A 112 -5.056 -3.947 3.662 1.00 61.24 C ATOM 1750 CZ PHE A 112 -4.464 -3.638 2.454 1.00 31.40 C ATOM 0 H PHE A 112 -1.317 -1.206 5.103 1.00 54.33 H new ATOM 0 HA PHE A 112 -2.875 -0.202 7.424 1.00 13.45 H new ATOM 0 HB2 PHE A 112 -4.850 -1.161 6.495 1.00 61.43 H new ATOM 0 HB3 PHE A 112 -4.185 0.057 5.425 1.00 61.43 H new ATOM 0 HD1 PHE A 112 -2.957 -0.742 3.290 1.00 13.25 H new ATOM 0 HD2 PHE A 112 -5.374 -3.336 5.680 1.00 10.21 H new ATOM 0 HE1 PHE A 112 -3.253 -2.249 1.379 1.00 61.30 H new ATOM 0 HE2 PHE A 112 -5.639 -4.851 3.765 1.00 61.24 H new ATOM 0 HZ PHE A 112 -4.588 -4.298 1.608 1.00 31.40 H new ATOM 1760 N ARG A 113 -3.416 -2.852 7.979 1.00 25.14 N ATOM 1761 CA ARG A 113 -3.335 -4.222 8.515 1.00 50.42 C ATOM 1762 C ARG A 113 -4.742 -4.768 8.687 1.00 73.52 C ATOM 1763 O ARG A 113 -5.566 -4.122 9.319 1.00 40.51 O ATOM 1764 CB ARG A 113 -2.560 -4.250 9.865 1.00 75.45 C ATOM 1765 CG ARG A 113 -2.375 -5.665 10.447 1.00 50.13 C ATOM 1766 CD ARG A 113 -1.562 -5.680 11.746 1.00 71.33 C ATOM 1767 NE ARG A 113 -1.356 -7.058 12.229 1.00 52.31 N ATOM 1768 CZ ARG A 113 -0.191 -7.720 12.218 1.00 24.04 C ATOM 1769 NH1 ARG A 113 0.920 -7.146 11.755 1.00 10.03 N ATOM 1770 NH2 ARG A 113 -0.145 -8.967 12.653 1.00 30.42 N ATOM 0 H ARG A 113 -4.299 -2.382 8.178 1.00 25.14 H new ATOM 0 HA ARG A 113 -2.785 -4.850 7.814 1.00 50.42 H new ATOM 0 HB2 ARG A 113 -1.580 -3.796 9.720 1.00 75.45 H new ATOM 0 HB3 ARG A 113 -3.092 -3.635 10.591 1.00 75.45 H new ATOM 0 HG2 ARG A 113 -3.354 -6.105 10.633 1.00 50.13 H new ATOM 0 HG3 ARG A 113 -1.879 -6.293 9.708 1.00 50.13 H new ATOM 0 HD2 ARG A 113 -0.597 -5.202 11.580 1.00 71.33 H new ATOM 0 HD3 ARG A 113 -2.079 -5.098 12.509 1.00 71.33 H new ATOM 0 HE ARG A 113 -2.169 -7.548 12.603 1.00 52.31 H new ATOM 0 HH11 ARG A 113 0.891 -6.189 11.402 1.00 10.03 H new ATOM 0 HH12 ARG A 113 1.799 -7.664 11.754 1.00 10.03 H new ATOM 0 HH21 ARG A 113 -0.993 -9.420 12.994 1.00 30.42 H new ATOM 0 HH22 ARG A 113 0.738 -9.477 12.647 1.00 30.42 H new ATOM 1784 N ASP A 114 -5.018 -5.953 8.126 1.00 21.15 N ATOM 1785 CA ASP A 114 -6.351 -6.570 8.172 1.00 35.12 C ATOM 1786 C ASP A 114 -6.249 -7.939 8.886 1.00 25.43 C ATOM 1787 O ASP A 114 -5.221 -8.237 9.518 1.00 34.15 O ATOM 1788 CB ASP A 114 -6.912 -6.677 6.727 1.00 52.42 C ATOM 1789 CG ASP A 114 -6.237 -7.760 5.873 1.00 4.01 C ATOM 1790 OD1 ASP A 114 -5.033 -7.627 5.548 1.00 41.40 O ATOM 1791 OD2 ASP A 114 -6.905 -8.760 5.551 1.00 24.13 O ATOM 0 H ASP A 114 -4.324 -6.511 7.628 1.00 21.15 H new ATOM 0 HA ASP A 114 -7.051 -5.960 8.743 1.00 35.12 H new ATOM 0 HB2 ASP A 114 -7.981 -6.883 6.778 1.00 52.42 H new ATOM 0 HB3 ASP A 114 -6.796 -5.713 6.231 1.00 52.42 H new ATOM 1796 N LYS A 115 -7.304 -8.767 8.782 1.00 23.24 N ATOM 1797 CA LYS A 115 -7.383 -10.064 9.483 1.00 4.05 C ATOM 1798 C LYS A 115 -6.520 -11.162 8.825 1.00 51.42 C ATOM 1799 O LYS A 115 -6.117 -12.111 9.516 1.00 25.52 O ATOM 1800 CB LYS A 115 -8.861 -10.524 9.592 1.00 64.53 C ATOM 1801 CG LYS A 115 -9.775 -9.693 10.539 1.00 73.54 C ATOM 1802 CD LYS A 115 -9.492 -9.891 12.056 1.00 42.43 C ATOM 1803 CE LYS A 115 -8.373 -8.990 12.609 1.00 70.34 C ATOM 1804 NZ LYS A 115 -8.022 -9.354 14.003 1.00 4.22 N ATOM 0 H LYS A 115 -8.124 -8.558 8.212 1.00 23.24 H new ATOM 0 HA LYS A 115 -6.974 -9.909 10.482 1.00 4.05 H new ATOM 0 HB2 LYS A 115 -9.299 -10.508 8.594 1.00 64.53 H new ATOM 0 HB3 LYS A 115 -8.873 -11.561 9.929 1.00 64.53 H new ATOM 0 HG2 LYS A 115 -9.660 -8.636 10.297 1.00 73.54 H new ATOM 0 HG3 LYS A 115 -10.814 -9.955 10.340 1.00 73.54 H new ATOM 0 HD2 LYS A 115 -10.408 -9.698 12.614 1.00 42.43 H new ATOM 0 HD3 LYS A 115 -9.225 -10.933 12.232 1.00 42.43 H new ATOM 0 HE2 LYS A 115 -7.490 -9.075 11.976 1.00 70.34 H new ATOM 0 HE3 LYS A 115 -8.692 -7.948 12.573 1.00 70.34 H new ATOM 0 HZ1 LYS A 115 -7.265 -8.728 14.345 1.00 4.22 H new ATOM 0 HZ2 LYS A 115 -8.860 -9.249 14.611 1.00 4.22 H new ATOM 0 HZ3 LYS A 115 -7.695 -10.341 14.032 1.00 4.22 H new ATOM 1818 N THR A 116 -6.221 -11.040 7.514 1.00 3.33 N ATOM 1819 CA THR A 116 -5.415 -12.056 6.808 1.00 51.00 C ATOM 1820 C THR A 116 -3.949 -11.964 7.264 1.00 75.31 C ATOM 1821 O THR A 116 -3.270 -12.992 7.415 1.00 72.32 O ATOM 1822 CB THR A 116 -5.475 -11.904 5.246 1.00 30.20 C ATOM 1823 OG1 THR A 116 -4.848 -10.674 4.839 1.00 11.21 O ATOM 1824 CG2 THR A 116 -6.923 -11.968 4.710 1.00 62.13 C ATOM 0 H THR A 116 -6.521 -10.259 6.931 1.00 3.33 H new ATOM 0 HA THR A 116 -5.840 -13.028 7.061 1.00 51.00 H new ATOM 0 HB THR A 116 -4.931 -12.746 4.817 1.00 30.20 H new ATOM 0 HG1 THR A 116 -5.494 -9.940 4.906 1.00 11.21 H new ATOM 0 HG21 THR A 116 -6.915 -11.858 3.626 1.00 62.13 H new ATOM 0 HG22 THR A 116 -7.367 -12.928 4.974 1.00 62.13 H new ATOM 0 HG23 THR A 116 -7.510 -11.163 5.152 1.00 62.13 H new ATOM 1832 N THR A 117 -3.500 -10.709 7.498 1.00 62.22 N ATOM 1833 CA THR A 117 -2.110 -10.372 7.850 1.00 24.51 C ATOM 1834 C THR A 117 -1.685 -11.075 9.161 1.00 45.42 C ATOM 1835 O THR A 117 -2.370 -10.965 10.180 1.00 33.32 O ATOM 1836 CB THR A 117 -1.949 -8.819 7.980 1.00 4.55 C ATOM 1837 OG1 THR A 117 -2.266 -8.188 6.725 1.00 0.14 O ATOM 1838 CG2 THR A 117 -0.524 -8.404 8.405 1.00 14.24 C ATOM 0 H THR A 117 -4.108 -9.892 7.445 1.00 62.22 H new ATOM 0 HA THR A 117 -1.457 -10.727 7.053 1.00 24.51 H new ATOM 0 HB THR A 117 -2.638 -8.493 8.759 1.00 4.55 H new ATOM 0 HG1 THR A 117 -3.239 -8.118 6.631 1.00 0.14 H new ATOM 0 HG21 THR A 117 -0.468 -7.318 8.480 1.00 14.24 H new ATOM 0 HG22 THR A 117 -0.290 -8.847 9.373 1.00 14.24 H new ATOM 0 HG23 THR A 117 0.193 -8.754 7.663 1.00 14.24 H new ATOM 1846 N GLY A 118 -0.560 -11.809 9.101 1.00 55.21 N ATOM 1847 CA GLY A 118 -0.076 -12.612 10.229 1.00 35.12 C ATOM 1848 C GLY A 118 -0.565 -14.062 10.198 1.00 70.01 C ATOM 1849 O GLY A 118 0.149 -14.970 10.642 1.00 41.44 O ATOM 0 H GLY A 118 0.033 -11.860 8.273 1.00 55.21 H new ATOM 0 HA2 GLY A 118 1.014 -12.604 10.230 1.00 35.12 H new ATOM 0 HA3 GLY A 118 -0.399 -12.148 11.161 1.00 35.12 H new ATOM 1853 N GLN A 119 -1.799 -14.279 9.684 1.00 24.31 N ATOM 1854 CA GLN A 119 -2.465 -15.601 9.684 1.00 65.34 C ATOM 1855 C GLN A 119 -2.175 -16.360 8.357 1.00 61.13 C ATOM 1856 O GLN A 119 -1.277 -17.209 8.294 1.00 25.04 O ATOM 1857 CB GLN A 119 -4.007 -15.412 9.905 1.00 41.41 C ATOM 1858 CG GLN A 119 -4.397 -14.553 11.134 1.00 53.21 C ATOM 1859 CD GLN A 119 -3.898 -15.101 12.480 1.00 44.31 C ATOM 1860 OE1 GLN A 119 -3.771 -16.311 12.678 1.00 31.53 O ATOM 1861 NE2 GLN A 119 -3.626 -14.211 13.426 1.00 31.53 N ATOM 0 H GLN A 119 -2.360 -13.541 9.258 1.00 24.31 H new ATOM 0 HA GLN A 119 -2.068 -16.204 10.501 1.00 65.34 H new ATOM 0 HB2 GLN A 119 -4.432 -14.954 9.012 1.00 41.41 H new ATOM 0 HB3 GLN A 119 -4.466 -16.395 10.009 1.00 41.41 H new ATOM 0 HG2 GLN A 119 -4.002 -13.546 10.997 1.00 53.21 H new ATOM 0 HG3 GLN A 119 -5.483 -14.467 11.171 1.00 53.21 H new ATOM 0 HE21 GLN A 119 -3.739 -13.215 13.237 1.00 31.53 H new ATOM 0 HE22 GLN A 119 -3.304 -14.523 14.342 1.00 31.53 H new ATOM 1870 N GLN A 120 -2.937 -16.019 7.300 1.00 53.14 N ATOM 1871 CA GLN A 120 -2.818 -16.619 5.938 1.00 43.32 C ATOM 1872 C GLN A 120 -1.972 -15.713 5.016 1.00 4.24 C ATOM 1873 O GLN A 120 -1.632 -16.089 3.895 1.00 51.41 O ATOM 1874 CB GLN A 120 -4.242 -16.848 5.340 1.00 21.54 C ATOM 1875 CG GLN A 120 -5.205 -15.653 5.531 1.00 72.32 C ATOM 1876 CD GLN A 120 -6.536 -15.787 4.795 1.00 50.44 C ATOM 1877 OE1 GLN A 120 -6.595 -16.317 3.693 1.00 34.34 O ATOM 1878 NE2 GLN A 120 -7.618 -15.335 5.418 1.00 21.12 N ATOM 0 H GLN A 120 -3.667 -15.309 7.359 1.00 53.14 H new ATOM 0 HA GLN A 120 -2.311 -17.581 6.015 1.00 43.32 H new ATOM 0 HB2 GLN A 120 -4.148 -17.059 4.275 1.00 21.54 H new ATOM 0 HB3 GLN A 120 -4.681 -17.732 5.802 1.00 21.54 H new ATOM 0 HG2 GLN A 120 -5.404 -15.530 6.596 1.00 72.32 H new ATOM 0 HG3 GLN A 120 -4.707 -14.744 5.193 1.00 72.32 H new ATOM 0 HE21 GLN A 120 -7.533 -14.898 6.336 1.00 21.12 H new ATOM 0 HE22 GLN A 120 -8.534 -15.424 4.979 1.00 21.12 H new ATOM 1887 N SER A 121 -1.632 -14.535 5.542 1.00 73.15 N ATOM 1888 CA SER A 121 -0.798 -13.521 4.879 1.00 63.44 C ATOM 1889 C SER A 121 0.354 -13.165 5.829 1.00 61.32 C ATOM 1890 O SER A 121 0.278 -13.456 7.030 1.00 3.25 O ATOM 1891 CB SER A 121 -1.657 -12.284 4.512 1.00 22.31 C ATOM 1892 OG SER A 121 -0.872 -11.191 4.064 1.00 23.31 O ATOM 0 H SER A 121 -1.938 -14.247 6.472 1.00 73.15 H new ATOM 0 HA SER A 121 -0.383 -13.902 3.946 1.00 63.44 H new ATOM 0 HB2 SER A 121 -2.369 -12.558 3.734 1.00 22.31 H new ATOM 0 HB3 SER A 121 -2.237 -11.978 5.382 1.00 22.31 H new ATOM 0 HG SER A 121 -1.457 -10.437 3.843 1.00 23.31 H new ATOM 1898 N TYR A 122 1.426 -12.580 5.288 1.00 1.13 N ATOM 1899 CA TYR A 122 2.660 -12.302 6.042 1.00 63.42 C ATOM 1900 C TYR A 122 2.531 -11.034 6.912 1.00 70.11 C ATOM 1901 O TYR A 122 1.760 -10.115 6.594 1.00 31.05 O ATOM 1902 CB TYR A 122 3.855 -12.198 5.063 1.00 10.41 C ATOM 1903 CG TYR A 122 4.116 -13.495 4.273 1.00 5.02 C ATOM 1904 CD1 TYR A 122 3.367 -13.810 3.130 1.00 22.41 C ATOM 1905 CD2 TYR A 122 5.098 -14.405 4.677 1.00 13.21 C ATOM 1906 CE1 TYR A 122 3.591 -14.977 2.426 1.00 42.30 C ATOM 1907 CE2 TYR A 122 5.323 -15.573 3.970 1.00 21.24 C ATOM 1908 CZ TYR A 122 4.568 -15.854 2.847 1.00 31.34 C ATOM 1909 OH TYR A 122 4.793 -17.012 2.142 1.00 4.41 O ATOM 0 H TYR A 122 1.467 -12.284 4.313 1.00 1.13 H new ATOM 0 HA TYR A 122 2.837 -13.130 6.729 1.00 63.42 H new ATOM 0 HB2 TYR A 122 3.670 -11.385 4.361 1.00 10.41 H new ATOM 0 HB3 TYR A 122 4.752 -11.936 5.624 1.00 10.41 H new ATOM 0 HD1 TYR A 122 2.601 -13.127 2.794 1.00 22.41 H new ATOM 0 HD2 TYR A 122 5.690 -14.193 5.555 1.00 13.21 H new ATOM 0 HE1 TYR A 122 3.003 -15.202 1.549 1.00 42.30 H new ATOM 0 HE2 TYR A 122 6.087 -16.264 4.295 1.00 21.24 H new ATOM 0 HH TYR A 122 5.515 -17.520 2.568 1.00 4.41 H new ATOM 1919 N ASP A 123 3.319 -11.016 8.003 1.00 74.30 N ATOM 1920 CA ASP A 123 3.248 -10.001 9.078 1.00 61.12 C ATOM 1921 C ASP A 123 4.087 -8.741 8.713 1.00 22.03 C ATOM 1922 O ASP A 123 4.442 -8.539 7.541 1.00 21.14 O ATOM 1923 CB ASP A 123 3.718 -10.654 10.424 1.00 72.45 C ATOM 1924 CG ASP A 123 2.923 -10.163 11.654 1.00 11.12 C ATOM 1925 OD1 ASP A 123 3.155 -9.035 12.132 1.00 11.22 O ATOM 1926 OD2 ASP A 123 2.050 -10.902 12.149 1.00 44.10 O ATOM 0 H ASP A 123 4.039 -11.720 8.168 1.00 74.30 H new ATOM 0 HA ASP A 123 2.219 -9.661 9.197 1.00 61.12 H new ATOM 0 HB2 ASP A 123 3.622 -11.737 10.347 1.00 72.45 H new ATOM 0 HB3 ASP A 123 4.776 -10.438 10.574 1.00 72.45 H new ATOM 1931 N GLY A 124 4.372 -7.868 9.715 1.00 63.21 N ATOM 1932 CA GLY A 124 4.978 -6.546 9.476 1.00 61.23 C ATOM 1933 C GLY A 124 3.915 -5.474 9.224 1.00 54.34 C ATOM 1934 O GLY A 124 4.114 -4.294 9.533 1.00 45.33 O ATOM 0 H GLY A 124 4.188 -8.065 10.699 1.00 63.21 H new ATOM 0 HA2 GLY A 124 5.584 -6.262 10.336 1.00 61.23 H new ATOM 0 HA3 GLY A 124 5.648 -6.603 8.618 1.00 61.23 H new ATOM 1938 N GLY A 125 2.787 -5.918 8.653 1.00 70.43 N ATOM 1939 CA GLY A 125 1.676 -5.069 8.269 1.00 75.10 C ATOM 1940 C GLY A 125 1.164 -5.491 6.907 1.00 65.43 C ATOM 1941 O GLY A 125 1.428 -6.619 6.455 1.00 74.55 O ATOM 0 H GLY A 125 2.628 -6.904 8.445 1.00 70.43 H new ATOM 0 HA2 GLY A 125 0.878 -5.141 9.008 1.00 75.10 H new ATOM 0 HA3 GLY A 125 1.993 -4.027 8.243 1.00 75.10 H new ATOM 1945 N ARG A 126 0.439 -4.604 6.247 1.00 63.33 N ATOM 1946 CA ARG A 126 -0.009 -4.808 4.872 1.00 61.14 C ATOM 1947 C ARG A 126 0.358 -3.542 4.105 1.00 55.13 C ATOM 1948 O ARG A 126 0.054 -2.446 4.543 1.00 22.34 O ATOM 1949 CB ARG A 126 -1.538 -5.125 4.802 1.00 33.15 C ATOM 1950 CG ARG A 126 -1.987 -5.890 3.523 1.00 20.01 C ATOM 1951 CD ARG A 126 -1.754 -7.427 3.595 1.00 52.31 C ATOM 1952 NE ARG A 126 -0.405 -7.787 4.070 1.00 65.11 N ATOM 1953 CZ ARG A 126 0.719 -7.754 3.337 1.00 31.52 C ATOM 1954 NH1 ARG A 126 0.703 -7.384 2.054 1.00 33.20 N ATOM 1955 NH2 ARG A 126 1.870 -8.017 3.923 1.00 44.15 N ATOM 0 H ARG A 126 0.141 -3.715 6.649 1.00 63.33 H new ATOM 0 HA ARG A 126 0.478 -5.675 4.427 1.00 61.14 H new ATOM 0 HB2 ARG A 126 -1.813 -5.715 5.677 1.00 33.15 H new ATOM 0 HB3 ARG A 126 -2.092 -4.188 4.862 1.00 33.15 H new ATOM 0 HG2 ARG A 126 -3.047 -5.700 3.351 1.00 20.01 H new ATOM 0 HG3 ARG A 126 -1.448 -5.490 2.664 1.00 20.01 H new ATOM 0 HD2 ARG A 126 -2.496 -7.870 4.259 1.00 52.31 H new ATOM 0 HD3 ARG A 126 -1.912 -7.859 2.607 1.00 52.31 H new ATOM 0 HE ARG A 126 -0.319 -8.087 5.041 1.00 65.11 H new ATOM 0 HH11 ARG A 126 -0.176 -7.119 1.611 1.00 33.20 H new ATOM 0 HH12 ARG A 126 1.570 -7.367 1.517 1.00 33.20 H new ATOM 0 HH21 ARG A 126 1.896 -8.241 4.918 1.00 44.15 H new ATOM 0 HH22 ARG A 126 2.734 -7.997 3.382 1.00 44.15 H new ATOM 1969 N TYR A 127 1.028 -3.702 2.964 1.00 61.43 N ATOM 1970 CA TYR A 127 1.706 -2.591 2.272 1.00 52.03 C ATOM 1971 C TYR A 127 0.926 -2.241 1.013 1.00 22.23 C ATOM 1972 O TYR A 127 0.614 -3.134 0.233 1.00 54.44 O ATOM 1973 CB TYR A 127 3.176 -3.012 1.923 1.00 65.30 C ATOM 1974 CG TYR A 127 4.041 -3.405 3.151 1.00 24.24 C ATOM 1975 CD1 TYR A 127 3.682 -4.482 3.973 1.00 63.11 C ATOM 1976 CD2 TYR A 127 5.198 -2.697 3.498 1.00 43.33 C ATOM 1977 CE1 TYR A 127 4.426 -4.833 5.073 1.00 32.31 C ATOM 1978 CE2 TYR A 127 5.949 -3.057 4.603 1.00 23.05 C ATOM 1979 CZ TYR A 127 5.556 -4.127 5.385 1.00 70.35 C ATOM 1980 OH TYR A 127 6.302 -4.495 6.484 1.00 60.34 O ATOM 0 H TYR A 127 1.120 -4.600 2.489 1.00 61.43 H new ATOM 0 HA TYR A 127 1.745 -1.712 2.916 1.00 52.03 H new ATOM 0 HB2 TYR A 127 3.145 -3.854 1.232 1.00 65.30 H new ATOM 0 HB3 TYR A 127 3.662 -2.188 1.400 1.00 65.30 H new ATOM 0 HD1 TYR A 127 2.796 -5.052 3.735 1.00 63.11 H new ATOM 0 HD2 TYR A 127 5.509 -1.857 2.894 1.00 43.33 H new ATOM 0 HE1 TYR A 127 4.120 -5.665 5.690 1.00 32.31 H new ATOM 0 HE2 TYR A 127 6.841 -2.503 4.854 1.00 23.05 H new ATOM 0 HH TYR A 127 7.246 -4.287 6.323 1.00 60.34 H new ATOM 1990 N MET A 128 0.608 -0.957 0.826 1.00 64.14 N ATOM 1991 CA MET A 128 -0.168 -0.492 -0.339 1.00 73.33 C ATOM 1992 C MET A 128 0.298 0.922 -0.707 1.00 12.21 C ATOM 1993 O MET A 128 0.695 1.692 0.173 1.00 72.22 O ATOM 1994 CB MET A 128 -1.708 -0.543 -0.018 1.00 23.42 C ATOM 1995 CG MET A 128 -2.582 -1.064 -1.178 1.00 53.02 C ATOM 1996 SD MET A 128 -2.698 0.096 -2.559 1.00 0.41 S ATOM 1997 CE MET A 128 -3.883 1.279 -1.915 1.00 3.03 C ATOM 0 H MET A 128 0.876 -0.212 1.469 1.00 64.14 H new ATOM 0 HA MET A 128 0.001 -1.145 -1.196 1.00 73.33 H new ATOM 0 HB2 MET A 128 -1.865 -1.179 0.853 1.00 23.42 H new ATOM 0 HB3 MET A 128 -2.044 0.458 0.253 1.00 23.42 H new ATOM 0 HG2 MET A 128 -2.172 -2.008 -1.538 1.00 53.02 H new ATOM 0 HG3 MET A 128 -3.584 -1.274 -0.803 1.00 53.02 H new ATOM 0 HE1 MET A 128 -4.439 1.723 -2.741 1.00 3.03 H new ATOM 0 HE2 MET A 128 -4.575 0.772 -1.243 1.00 3.03 H new ATOM 0 HE3 MET A 128 -3.356 2.062 -1.370 1.00 3.03 H new ATOM 2007 N GLU A 129 0.268 1.248 -2.005 1.00 34.12 N ATOM 2008 CA GLU A 129 0.747 2.542 -2.515 1.00 22.04 C ATOM 2009 C GLU A 129 -0.139 3.017 -3.685 1.00 23.03 C ATOM 2010 O GLU A 129 -0.459 2.235 -4.589 1.00 5.31 O ATOM 2011 CB GLU A 129 2.231 2.403 -2.951 1.00 31.32 C ATOM 2012 CG GLU A 129 2.907 3.703 -3.437 1.00 34.22 C ATOM 2013 CD GLU A 129 4.354 3.474 -3.889 1.00 35.41 C ATOM 2014 OE1 GLU A 129 5.282 3.535 -3.042 1.00 21.21 O ATOM 2015 OE2 GLU A 129 4.570 3.195 -5.088 1.00 40.35 O ATOM 0 H GLU A 129 -0.088 0.626 -2.731 1.00 34.12 H new ATOM 0 HA GLU A 129 0.684 3.293 -1.728 1.00 22.04 H new ATOM 0 HB2 GLU A 129 2.803 2.009 -2.111 1.00 31.32 H new ATOM 0 HB3 GLU A 129 2.289 1.664 -3.750 1.00 31.32 H new ATOM 0 HG2 GLU A 129 2.333 4.121 -4.264 1.00 34.22 H new ATOM 0 HG3 GLU A 129 2.892 4.440 -2.634 1.00 34.22 H new ATOM 2022 N LEU A 130 -0.537 4.304 -3.636 1.00 61.44 N ATOM 2023 CA LEU A 130 -1.366 4.956 -4.666 1.00 12.30 C ATOM 2024 C LEU A 130 -0.524 6.040 -5.341 1.00 31.32 C ATOM 2025 O LEU A 130 0.281 6.702 -4.677 1.00 5.23 O ATOM 2026 CB LEU A 130 -2.661 5.615 -4.059 1.00 61.11 C ATOM 2027 CG LEU A 130 -3.321 4.886 -2.840 1.00 3.21 C ATOM 2028 CD1 LEU A 130 -2.637 5.280 -1.512 1.00 4.41 C ATOM 2029 CD2 LEU A 130 -4.836 5.137 -2.776 1.00 65.30 C ATOM 0 H LEU A 130 -0.287 4.927 -2.868 1.00 61.44 H new ATOM 0 HA LEU A 130 -1.688 4.197 -5.379 1.00 12.30 H new ATOM 0 HB2 LEU A 130 -2.413 6.631 -3.753 1.00 61.11 H new ATOM 0 HB3 LEU A 130 -3.405 5.693 -4.851 1.00 61.11 H new ATOM 0 HG LEU A 130 -3.174 3.816 -2.989 1.00 3.21 H new ATOM 0 HD11 LEU A 130 -3.118 4.757 -0.686 1.00 4.41 H new ATOM 0 HD12 LEU A 130 -1.583 5.005 -1.550 1.00 4.41 H new ATOM 0 HD13 LEU A 130 -2.727 6.356 -1.362 1.00 4.41 H new ATOM 0 HD21 LEU A 130 -5.255 4.614 -1.917 1.00 65.30 H new ATOM 0 HD22 LEU A 130 -5.024 6.206 -2.677 1.00 65.30 H new ATOM 0 HD23 LEU A 130 -5.305 4.769 -3.689 1.00 65.30 H new ATOM 2041 N GLU A 131 -0.726 6.223 -6.647 1.00 64.32 N ATOM 2042 CA GLU A 131 -0.105 7.301 -7.430 1.00 44.25 C ATOM 2043 C GLU A 131 -1.224 8.014 -8.220 1.00 65.11 C ATOM 2044 O GLU A 131 -1.455 7.697 -9.392 1.00 25.43 O ATOM 2045 CB GLU A 131 1.003 6.716 -8.356 1.00 73.11 C ATOM 2046 CG GLU A 131 2.206 6.100 -7.599 1.00 75.24 C ATOM 2047 CD GLU A 131 3.114 5.246 -8.492 1.00 42.10 C ATOM 2048 OE1 GLU A 131 3.807 5.811 -9.365 1.00 4.44 O ATOM 2049 OE2 GLU A 131 3.131 4.003 -8.332 1.00 32.34 O ATOM 0 H GLU A 131 -1.334 5.620 -7.201 1.00 64.32 H new ATOM 0 HA GLU A 131 0.386 8.030 -6.785 1.00 44.25 H new ATOM 0 HB2 GLU A 131 0.560 5.952 -8.995 1.00 73.11 H new ATOM 0 HB3 GLU A 131 1.367 7.507 -9.011 1.00 73.11 H new ATOM 0 HG2 GLU A 131 2.796 6.902 -7.155 1.00 75.24 H new ATOM 0 HG3 GLU A 131 1.834 5.486 -6.779 1.00 75.24 H new ATOM 2056 N PRO A 132 -1.995 8.945 -7.552 1.00 14.13 N ATOM 2057 CA PRO A 132 -3.159 9.632 -8.172 1.00 41.13 C ATOM 2058 C PRO A 132 -2.746 10.587 -9.318 1.00 53.15 C ATOM 2059 O PRO A 132 -1.707 11.257 -9.243 1.00 13.13 O ATOM 2060 CB PRO A 132 -3.787 10.404 -6.976 1.00 12.53 C ATOM 2061 CG PRO A 132 -2.641 10.637 -6.037 1.00 72.30 C ATOM 2062 CD PRO A 132 -1.798 9.387 -6.137 1.00 51.24 C ATOM 0 HA PRO A 132 -3.850 8.936 -8.648 1.00 41.13 H new ATOM 0 HB2 PRO A 132 -4.232 11.345 -7.300 1.00 12.53 H new ATOM 0 HB3 PRO A 132 -4.578 9.824 -6.501 1.00 12.53 H new ATOM 0 HG2 PRO A 132 -2.071 11.522 -6.321 1.00 72.30 H new ATOM 0 HG3 PRO A 132 -2.992 10.797 -5.017 1.00 72.30 H new ATOM 0 HD2 PRO A 132 -0.749 9.592 -5.923 1.00 51.24 H new ATOM 0 HD3 PRO A 132 -2.125 8.625 -5.429 1.00 51.24 H new ATOM 2070 N ASP A 133 -3.583 10.632 -10.375 1.00 53.50 N ATOM 2071 CA ASP A 133 -3.409 11.541 -11.535 1.00 3.15 C ATOM 2072 C ASP A 133 -3.457 13.034 -11.128 1.00 24.21 C ATOM 2073 O ASP A 133 -2.928 13.894 -11.832 1.00 3.25 O ATOM 2074 CB ASP A 133 -4.496 11.226 -12.594 1.00 73.24 C ATOM 2075 CG ASP A 133 -4.385 12.082 -13.872 1.00 43.11 C ATOM 2076 OD1 ASP A 133 -3.511 11.800 -14.720 1.00 51.24 O ATOM 2077 OD2 ASP A 133 -5.159 13.051 -14.030 1.00 35.34 O ATOM 0 H ASP A 133 -4.406 10.035 -10.451 1.00 53.50 H new ATOM 0 HA ASP A 133 -2.419 11.368 -11.956 1.00 3.15 H new ATOM 0 HB2 ASP A 133 -4.430 10.173 -12.866 1.00 73.24 H new ATOM 0 HB3 ASP A 133 -5.479 11.380 -12.149 1.00 73.24 H new ATOM 2082 N ARG A 134 -4.039 13.312 -9.955 1.00 62.11 N ATOM 2083 CA ARG A 134 -4.124 14.668 -9.383 1.00 3.51 C ATOM 2084 C ARG A 134 -3.649 14.626 -7.923 1.00 10.20 C ATOM 2085 O ARG A 134 -3.771 13.591 -7.259 1.00 22.30 O ATOM 2086 CB ARG A 134 -5.562 15.258 -9.548 1.00 14.14 C ATOM 2087 CG ARG A 134 -6.745 14.327 -9.156 1.00 22.02 C ATOM 2088 CD ARG A 134 -6.971 14.188 -7.636 1.00 64.21 C ATOM 2089 NE ARG A 134 -8.174 13.405 -7.321 1.00 41.54 N ATOM 2090 CZ ARG A 134 -9.435 13.877 -7.330 1.00 60.21 C ATOM 2091 NH1 ARG A 134 -9.698 15.144 -7.647 1.00 63.41 N ATOM 2092 NH2 ARG A 134 -10.428 13.078 -6.984 1.00 64.43 N ATOM 0 H ARG A 134 -4.469 12.597 -9.368 1.00 62.11 H new ATOM 0 HA ARG A 134 -3.466 15.346 -9.927 1.00 3.51 H new ATOM 0 HB2 ARG A 134 -5.629 16.165 -8.948 1.00 14.14 H new ATOM 0 HB3 ARG A 134 -5.692 15.554 -10.589 1.00 14.14 H new ATOM 0 HG2 ARG A 134 -7.658 14.708 -9.613 1.00 22.02 H new ATOM 0 HG3 ARG A 134 -6.567 13.337 -9.576 1.00 22.02 H new ATOM 0 HD2 ARG A 134 -6.101 13.712 -7.184 1.00 64.21 H new ATOM 0 HD3 ARG A 134 -7.059 15.179 -7.192 1.00 64.21 H new ATOM 0 HE ARG A 134 -8.043 12.424 -7.075 1.00 41.54 H new ATOM 0 HH11 ARG A 134 -8.936 15.778 -7.889 1.00 63.41 H new ATOM 0 HH12 ARG A 134 -10.661 15.480 -7.647 1.00 63.41 H new ATOM 0 HH21 ARG A 134 -10.236 12.113 -6.713 1.00 64.43 H new ATOM 0 HH22 ARG A 134 -11.387 13.425 -6.987 1.00 64.43 H new ATOM 2106 N ASP A 135 -3.094 15.738 -7.434 1.00 12.42 N ATOM 2107 CA ASP A 135 -2.586 15.828 -6.057 1.00 54.42 C ATOM 2108 C ASP A 135 -3.749 15.997 -5.062 1.00 2.41 C ATOM 2109 O ASP A 135 -4.671 16.779 -5.312 1.00 40.34 O ATOM 2110 CB ASP A 135 -1.572 16.991 -5.927 1.00 11.15 C ATOM 2111 CG ASP A 135 -0.983 17.109 -4.514 1.00 42.44 C ATOM 2112 OD1 ASP A 135 -0.419 16.107 -4.022 1.00 15.31 O ATOM 2113 OD2 ASP A 135 -1.073 18.190 -3.888 1.00 44.20 O ATOM 0 H ASP A 135 -2.983 16.596 -7.974 1.00 12.42 H new ATOM 0 HA ASP A 135 -2.068 14.899 -5.817 1.00 54.42 H new ATOM 0 HB2 ASP A 135 -0.763 16.844 -6.642 1.00 11.15 H new ATOM 0 HB3 ASP A 135 -2.064 17.927 -6.191 1.00 11.15 H new ATOM 2118 N LEU A 136 -3.682 15.272 -3.936 1.00 52.31 N ATOM 2119 CA LEU A 136 -4.786 15.197 -2.965 1.00 34.42 C ATOM 2120 C LEU A 136 -4.690 16.330 -1.918 1.00 14.54 C ATOM 2121 O LEU A 136 -3.620 16.558 -1.333 1.00 65.44 O ATOM 2122 CB LEU A 136 -4.781 13.811 -2.267 1.00 55.53 C ATOM 2123 CG LEU A 136 -4.840 12.555 -3.200 1.00 30.31 C ATOM 2124 CD1 LEU A 136 -4.920 11.260 -2.371 1.00 43.44 C ATOM 2125 CD2 LEU A 136 -6.003 12.631 -4.212 1.00 63.30 C ATOM 0 H LEU A 136 -2.864 14.722 -3.672 1.00 52.31 H new ATOM 0 HA LEU A 136 -5.725 15.323 -3.504 1.00 34.42 H new ATOM 0 HB2 LEU A 136 -3.880 13.740 -1.657 1.00 55.53 H new ATOM 0 HB3 LEU A 136 -5.631 13.770 -1.586 1.00 55.53 H new ATOM 0 HG LEU A 136 -3.915 12.543 -3.777 1.00 30.31 H new ATOM 0 HD11 LEU A 136 -4.960 10.401 -3.041 1.00 43.44 H new ATOM 0 HD12 LEU A 136 -4.040 11.182 -1.733 1.00 43.44 H new ATOM 0 HD13 LEU A 136 -5.817 11.279 -1.752 1.00 43.44 H new ATOM 0 HD21 LEU A 136 -6.001 11.737 -4.836 1.00 63.30 H new ATOM 0 HD22 LEU A 136 -6.949 12.697 -3.675 1.00 63.30 H new ATOM 0 HD23 LEU A 136 -5.881 13.513 -4.841 1.00 63.30 H new ATOM 2137 N SER A 137 -5.813 17.034 -1.714 1.00 41.14 N ATOM 2138 CA SER A 137 -5.979 18.072 -0.670 1.00 51.32 C ATOM 2139 C SER A 137 -6.992 17.613 0.404 1.00 65.30 C ATOM 2140 O SER A 137 -7.515 16.499 0.337 1.00 32.41 O ATOM 2141 CB SER A 137 -6.427 19.385 -1.340 1.00 60.13 C ATOM 2142 OG SER A 137 -5.466 19.803 -2.297 1.00 31.23 O ATOM 0 H SER A 137 -6.652 16.900 -2.278 1.00 41.14 H new ATOM 0 HA SER A 137 -5.028 18.238 -0.163 1.00 51.32 H new ATOM 0 HB2 SER A 137 -7.394 19.243 -1.823 1.00 60.13 H new ATOM 0 HB3 SER A 137 -6.559 20.160 -0.585 1.00 60.13 H new ATOM 0 HG SER A 137 -5.764 20.637 -2.716 1.00 31.23 H new ATOM 2148 N ASP A 138 -7.230 18.459 1.425 1.00 24.11 N ATOM 2149 CA ASP A 138 -8.162 18.144 2.527 1.00 23.41 C ATOM 2150 C ASP A 138 -9.616 18.336 2.050 1.00 1.33 C ATOM 2151 O ASP A 138 -10.072 19.468 1.835 1.00 43.43 O ATOM 2152 CB ASP A 138 -7.853 19.030 3.762 1.00 14.10 C ATOM 2153 CG ASP A 138 -8.702 18.678 5.004 1.00 11.10 C ATOM 2154 OD1 ASP A 138 -8.376 17.693 5.698 1.00 44.21 O ATOM 2155 OD2 ASP A 138 -9.691 19.387 5.293 1.00 50.43 O ATOM 0 H ASP A 138 -6.786 19.373 1.510 1.00 24.11 H new ATOM 0 HA ASP A 138 -8.033 17.103 2.824 1.00 23.41 H new ATOM 0 HB2 ASP A 138 -6.797 18.932 4.014 1.00 14.10 H new ATOM 0 HB3 ASP A 138 -8.022 20.075 3.501 1.00 14.10 H new ATOM 2160 N GLY A 139 -10.324 17.212 1.874 1.00 44.14 N ATOM 2161 CA GLY A 139 -11.675 17.190 1.295 1.00 54.04 C ATOM 2162 C GLY A 139 -11.687 16.642 -0.131 1.00 60.25 C ATOM 2163 O GLY A 139 -12.743 16.612 -0.774 1.00 32.40 O ATOM 0 H GLY A 139 -9.975 16.289 2.130 1.00 44.14 H new ATOM 0 HA2 GLY A 139 -12.326 16.580 1.921 1.00 54.04 H new ATOM 0 HA3 GLY A 139 -12.085 18.200 1.297 1.00 54.04 H new ATOM 2167 N ASP A 140 -10.508 16.214 -0.622 1.00 30.34 N ATOM 2168 CA ASP A 140 -10.337 15.639 -1.978 1.00 31.10 C ATOM 2169 C ASP A 140 -10.808 14.165 -1.972 1.00 54.13 C ATOM 2170 O ASP A 140 -11.054 13.594 -0.905 1.00 54.50 O ATOM 2171 CB ASP A 140 -8.838 15.747 -2.378 1.00 24.24 C ATOM 2172 CG ASP A 140 -8.553 15.660 -3.887 1.00 64.21 C ATOM 2173 OD1 ASP A 140 -8.590 14.559 -4.440 1.00 40.24 O ATOM 2174 OD2 ASP A 140 -8.263 16.703 -4.519 1.00 73.23 O ATOM 0 H ASP A 140 -9.640 16.256 -0.089 1.00 30.34 H new ATOM 0 HA ASP A 140 -10.937 16.185 -2.707 1.00 31.10 H new ATOM 0 HB2 ASP A 140 -8.447 16.693 -2.005 1.00 24.24 H new ATOM 0 HB3 ASP A 140 -8.286 14.953 -1.874 1.00 24.24 H new ATOM 2179 N GLU A 141 -10.977 13.563 -3.154 1.00 62.51 N ATOM 2180 CA GLU A 141 -11.362 12.139 -3.287 1.00 3.30 C ATOM 2181 C GLU A 141 -10.220 11.278 -3.871 1.00 14.45 C ATOM 2182 O GLU A 141 -9.429 11.742 -4.697 1.00 74.11 O ATOM 2183 CB GLU A 141 -12.625 12.063 -4.177 1.00 63.52 C ATOM 2184 CG GLU A 141 -13.866 12.742 -3.547 1.00 21.23 C ATOM 2185 CD GLU A 141 -15.060 12.830 -4.503 1.00 22.31 C ATOM 2186 OE1 GLU A 141 -15.759 11.811 -4.695 1.00 32.41 O ATOM 2187 OE2 GLU A 141 -15.299 13.915 -5.080 1.00 13.12 O ATOM 0 H GLU A 141 -10.853 14.040 -4.047 1.00 62.51 H new ATOM 0 HA GLU A 141 -11.571 11.732 -2.298 1.00 3.30 H new ATOM 0 HB2 GLU A 141 -12.412 12.533 -5.137 1.00 63.52 H new ATOM 0 HB3 GLU A 141 -12.856 11.017 -4.378 1.00 63.52 H new ATOM 0 HG2 GLU A 141 -14.162 12.187 -2.657 1.00 21.23 H new ATOM 0 HG3 GLU A 141 -13.596 13.746 -3.221 1.00 21.23 H new ATOM 2194 N ILE A 142 -10.183 10.002 -3.455 1.00 35.01 N ATOM 2195 CA ILE A 142 -9.167 9.018 -3.889 1.00 32.51 C ATOM 2196 C ILE A 142 -9.786 7.605 -3.839 1.00 14.42 C ATOM 2197 O ILE A 142 -10.677 7.346 -3.032 1.00 21.23 O ATOM 2198 CB ILE A 142 -7.873 9.087 -2.983 1.00 15.24 C ATOM 2199 CG1 ILE A 142 -6.750 8.094 -3.458 1.00 45.43 C ATOM 2200 CG2 ILE A 142 -8.222 8.855 -1.492 1.00 51.21 C ATOM 2201 CD1 ILE A 142 -6.189 8.340 -4.860 1.00 21.44 C ATOM 0 H ILE A 142 -10.863 9.616 -2.800 1.00 35.01 H new ATOM 0 HA ILE A 142 -8.861 9.253 -4.909 1.00 32.51 H new ATOM 0 HB ILE A 142 -7.471 10.094 -3.090 1.00 15.24 H new ATOM 0 HG12 ILE A 142 -5.927 8.140 -2.745 1.00 45.43 H new ATOM 0 HG13 ILE A 142 -7.149 7.080 -3.420 1.00 45.43 H new ATOM 0 HG21 ILE A 142 -7.313 8.908 -0.893 1.00 51.21 H new ATOM 0 HG22 ILE A 142 -8.922 9.622 -1.159 1.00 51.21 H new ATOM 0 HG23 ILE A 142 -8.678 7.872 -1.374 1.00 51.21 H new ATOM 0 HD11 ILE A 142 -5.423 7.597 -5.081 1.00 21.44 H new ATOM 0 HD12 ILE A 142 -6.993 8.262 -5.592 1.00 21.44 H new ATOM 0 HD13 ILE A 142 -5.751 9.337 -4.907 1.00 21.44 H new ATOM 2213 N THR A 143 -9.326 6.704 -4.713 1.00 4.54 N ATOM 2214 CA THR A 143 -9.785 5.310 -4.737 1.00 41.24 C ATOM 2215 C THR A 143 -8.729 4.405 -4.062 1.00 52.04 C ATOM 2216 O THR A 143 -7.547 4.468 -4.412 1.00 54.32 O ATOM 2217 CB THR A 143 -10.049 4.844 -6.207 1.00 15.41 C ATOM 2218 OG1 THR A 143 -10.728 5.880 -6.941 1.00 72.23 O ATOM 2219 CG2 THR A 143 -10.899 3.569 -6.247 1.00 40.34 C ATOM 0 H THR A 143 -8.626 6.919 -5.423 1.00 4.54 H new ATOM 0 HA THR A 143 -10.722 5.235 -4.186 1.00 41.24 H new ATOM 0 HB THR A 143 -9.081 4.634 -6.663 1.00 15.41 H new ATOM 0 HG1 THR A 143 -10.887 5.579 -7.860 1.00 72.23 H new ATOM 0 HG21 THR A 143 -11.063 3.273 -7.283 1.00 40.34 H new ATOM 0 HG22 THR A 143 -10.380 2.769 -5.719 1.00 40.34 H new ATOM 0 HG23 THR A 143 -11.859 3.757 -5.767 1.00 40.34 H new ATOM 2227 N LEU A 144 -9.162 3.578 -3.088 1.00 72.52 N ATOM 2228 CA LEU A 144 -8.280 2.701 -2.289 1.00 50.21 C ATOM 2229 C LEU A 144 -8.358 1.259 -2.818 1.00 21.24 C ATOM 2230 O LEU A 144 -9.337 0.541 -2.559 1.00 3.22 O ATOM 2231 CB LEU A 144 -8.683 2.759 -0.773 1.00 21.31 C ATOM 2232 CG LEU A 144 -8.015 3.868 0.103 1.00 3.31 C ATOM 2233 CD1 LEU A 144 -6.511 3.578 0.317 1.00 34.54 C ATOM 2234 CD2 LEU A 144 -8.245 5.269 -0.497 1.00 31.14 C ATOM 0 H LEU A 144 -10.146 3.499 -2.831 1.00 72.52 H new ATOM 0 HA LEU A 144 -7.252 3.051 -2.382 1.00 50.21 H new ATOM 0 HB2 LEU A 144 -9.764 2.889 -0.716 1.00 21.31 H new ATOM 0 HB3 LEU A 144 -8.454 1.792 -0.326 1.00 21.31 H new ATOM 0 HG LEU A 144 -8.493 3.854 1.083 1.00 3.31 H new ATOM 0 HD11 LEU A 144 -6.072 4.366 0.930 1.00 34.54 H new ATOM 0 HD12 LEU A 144 -6.394 2.618 0.821 1.00 34.54 H new ATOM 0 HD13 LEU A 144 -6.006 3.545 -0.648 1.00 34.54 H new ATOM 0 HD21 LEU A 144 -7.768 6.018 0.135 1.00 31.14 H new ATOM 0 HD22 LEU A 144 -7.815 5.311 -1.498 1.00 31.14 H new ATOM 0 HD23 LEU A 144 -9.315 5.469 -0.553 1.00 31.14 H new ATOM 2246 N ASP A 145 -7.337 0.862 -3.592 1.00 50.33 N ATOM 2247 CA ASP A 145 -7.195 -0.499 -4.120 1.00 21.22 C ATOM 2248 C ASP A 145 -6.351 -1.366 -3.161 1.00 72.21 C ATOM 2249 O ASP A 145 -5.127 -1.444 -3.293 1.00 51.24 O ATOM 2250 CB ASP A 145 -6.537 -0.445 -5.526 1.00 43.23 C ATOM 2251 CG ASP A 145 -7.471 0.083 -6.621 1.00 5.21 C ATOM 2252 OD1 ASP A 145 -8.170 -0.743 -7.230 1.00 3.24 O ATOM 2253 OD2 ASP A 145 -7.508 1.312 -6.885 1.00 0.13 O ATOM 0 H ASP A 145 -6.579 1.485 -3.871 1.00 50.33 H new ATOM 0 HA ASP A 145 -8.182 -0.952 -4.206 1.00 21.22 H new ATOM 0 HB2 ASP A 145 -5.651 0.188 -5.479 1.00 43.23 H new ATOM 0 HB3 ASP A 145 -6.200 -1.445 -5.799 1.00 43.23 H new ATOM 2258 N PHE A 146 -7.019 -2.018 -2.191 1.00 51.03 N ATOM 2259 CA PHE A 146 -6.360 -2.957 -1.230 1.00 4.21 C ATOM 2260 C PHE A 146 -5.899 -4.239 -1.946 1.00 42.35 C ATOM 2261 O PHE A 146 -5.108 -5.024 -1.417 1.00 64.31 O ATOM 2262 CB PHE A 146 -7.334 -3.340 -0.090 1.00 35.00 C ATOM 2263 CG PHE A 146 -8.008 -2.161 0.591 1.00 32.42 C ATOM 2264 CD1 PHE A 146 -7.297 -1.003 0.879 1.00 21.21 C ATOM 2265 CD2 PHE A 146 -9.361 -2.208 0.928 1.00 41.11 C ATOM 2266 CE1 PHE A 146 -7.914 0.062 1.479 1.00 51.14 C ATOM 2267 CE2 PHE A 146 -9.975 -1.138 1.531 1.00 2.12 C ATOM 2268 CZ PHE A 146 -9.249 -0.003 1.805 1.00 61.13 C ATOM 0 H PHE A 146 -8.023 -1.918 -2.042 1.00 51.03 H new ATOM 0 HA PHE A 146 -5.492 -2.447 -0.812 1.00 4.21 H new ATOM 0 HB2 PHE A 146 -8.104 -3.998 -0.494 1.00 35.00 H new ATOM 0 HB3 PHE A 146 -6.787 -3.912 0.660 1.00 35.00 H new ATOM 0 HD1 PHE A 146 -6.248 -0.942 0.628 1.00 21.21 H new ATOM 0 HD2 PHE A 146 -9.933 -3.098 0.712 1.00 41.11 H new ATOM 0 HE1 PHE A 146 -7.350 0.957 1.697 1.00 51.14 H new ATOM 0 HE2 PHE A 146 -11.023 -1.188 1.789 1.00 2.12 H new ATOM 0 HZ PHE A 146 -9.729 0.841 2.278 1.00 61.13 H new ATOM 2278 N ASN A 147 -6.438 -4.415 -3.152 1.00 24.14 N ATOM 2279 CA ASN A 147 -6.210 -5.571 -4.017 1.00 11.25 C ATOM 2280 C ASN A 147 -4.831 -5.492 -4.710 1.00 2.23 C ATOM 2281 O ASN A 147 -4.454 -6.397 -5.451 1.00 4.54 O ATOM 2282 CB ASN A 147 -7.349 -5.638 -5.075 1.00 4.13 C ATOM 2283 CG ASN A 147 -8.772 -5.392 -4.517 1.00 60.15 C ATOM 2284 OD1 ASN A 147 -9.024 -4.462 -3.749 1.00 12.53 O ATOM 2285 ND2 ASN A 147 -9.703 -6.248 -4.860 1.00 31.42 N ATOM 0 H ASN A 147 -7.069 -3.730 -3.569 1.00 24.14 H new ATOM 0 HA ASN A 147 -6.215 -6.476 -3.409 1.00 11.25 H new ATOM 0 HB2 ASN A 147 -7.147 -4.901 -5.852 1.00 4.13 H new ATOM 0 HB3 ASN A 147 -7.326 -6.618 -5.551 1.00 4.13 H new ATOM 0 HD21 ASN A 147 -10.648 -6.148 -4.490 1.00 31.42 H new ATOM 0 HD22 ASN A 147 -9.482 -7.014 -5.497 1.00 31.42 H new ATOM 2292 N LEU A 148 -4.115 -4.369 -4.488 1.00 74.52 N ATOM 2293 CA LEU A 148 -2.750 -4.135 -4.996 1.00 13.31 C ATOM 2294 C LEU A 148 -1.757 -4.131 -3.814 1.00 2.30 C ATOM 2295 O LEU A 148 -0.729 -3.444 -3.857 1.00 43.41 O ATOM 2296 CB LEU A 148 -2.712 -2.769 -5.750 1.00 62.12 C ATOM 2297 CG LEU A 148 -3.790 -2.562 -6.861 1.00 33.21 C ATOM 2298 CD1 LEU A 148 -3.615 -1.197 -7.560 1.00 11.35 C ATOM 2299 CD2 LEU A 148 -3.805 -3.729 -7.871 1.00 21.03 C ATOM 0 H LEU A 148 -4.477 -3.588 -3.941 1.00 74.52 H new ATOM 0 HA LEU A 148 -2.466 -4.928 -5.687 1.00 13.31 H new ATOM 0 HB2 LEU A 148 -2.819 -1.970 -5.016 1.00 62.12 H new ATOM 0 HB3 LEU A 148 -1.727 -2.656 -6.203 1.00 62.12 H new ATOM 0 HG LEU A 148 -4.765 -2.557 -6.375 1.00 33.21 H new ATOM 0 HD11 LEU A 148 -4.379 -1.081 -8.328 1.00 11.35 H new ATOM 0 HD12 LEU A 148 -3.714 -0.397 -6.826 1.00 11.35 H new ATOM 0 HD13 LEU A 148 -2.628 -1.148 -8.020 1.00 11.35 H new ATOM 0 HD21 LEU A 148 -4.569 -3.546 -8.627 1.00 21.03 H new ATOM 0 HD22 LEU A 148 -2.830 -3.807 -8.352 1.00 21.03 H new ATOM 0 HD23 LEU A 148 -4.027 -4.659 -7.349 1.00 21.03 H new ATOM 2311 N ALA A 149 -2.079 -4.905 -2.754 1.00 62.42 N ATOM 2312 CA ALA A 149 -1.257 -4.971 -1.537 1.00 44.23 C ATOM 2313 C ALA A 149 0.025 -5.800 -1.782 1.00 22.40 C ATOM 2314 O ALA A 149 -0.043 -7.009 -2.033 1.00 14.10 O ATOM 2315 CB ALA A 149 -2.072 -5.529 -0.352 1.00 33.43 C ATOM 0 H ALA A 149 -2.910 -5.495 -2.723 1.00 62.42 H new ATOM 0 HA ALA A 149 -0.950 -3.958 -1.278 1.00 44.23 H new ATOM 0 HB1 ALA A 149 -1.442 -5.568 0.537 1.00 33.43 H new ATOM 0 HB2 ALA A 149 -2.928 -4.881 -0.162 1.00 33.43 H new ATOM 0 HB3 ALA A 149 -2.423 -6.533 -0.592 1.00 33.43 H new ATOM 2321 N TYR A 150 1.183 -5.125 -1.681 1.00 32.42 N ATOM 2322 CA TYR A 150 2.504 -5.690 -2.008 1.00 1.02 C ATOM 2323 C TYR A 150 3.052 -6.527 -0.840 1.00 73.14 C ATOM 2324 O TYR A 150 2.679 -6.306 0.327 1.00 41.44 O ATOM 2325 CB TYR A 150 3.508 -4.543 -2.322 1.00 33.44 C ATOM 2326 CG TYR A 150 2.986 -3.472 -3.292 1.00 42.12 C ATOM 2327 CD1 TYR A 150 2.444 -3.819 -4.531 1.00 70.14 C ATOM 2328 CD2 TYR A 150 3.045 -2.110 -2.967 1.00 2.33 C ATOM 2329 CE1 TYR A 150 1.983 -2.854 -5.403 1.00 72.10 C ATOM 2330 CE2 TYR A 150 2.584 -1.148 -3.839 1.00 4.03 C ATOM 2331 CZ TYR A 150 2.056 -1.523 -5.052 1.00 34.20 C ATOM 2332 OH TYR A 150 1.611 -0.559 -5.927 1.00 55.42 O ATOM 0 H TYR A 150 1.228 -4.156 -1.365 1.00 32.42 H new ATOM 0 HA TYR A 150 2.387 -6.334 -2.880 1.00 1.02 H new ATOM 0 HB2 TYR A 150 3.788 -4.059 -1.386 1.00 33.44 H new ATOM 0 HB3 TYR A 150 4.416 -4.979 -2.740 1.00 33.44 H new ATOM 0 HD1 TYR A 150 2.385 -4.860 -4.812 1.00 70.14 H new ATOM 0 HD2 TYR A 150 3.459 -1.809 -2.016 1.00 2.33 H new ATOM 0 HE1 TYR A 150 1.566 -3.141 -6.357 1.00 72.10 H new ATOM 0 HE2 TYR A 150 2.637 -0.103 -3.571 1.00 4.03 H new ATOM 0 HH TYR A 150 1.732 0.327 -5.527 1.00 55.42 H new ATOM 2342 N SER A 151 3.905 -7.507 -1.180 1.00 3.25 N ATOM 2343 CA SER A 151 4.689 -8.288 -0.220 1.00 22.45 C ATOM 2344 C SER A 151 5.519 -7.401 0.767 1.00 73.45 C ATOM 2345 O SER A 151 6.076 -6.372 0.361 1.00 45.34 O ATOM 2346 CB SER A 151 5.620 -9.242 -1.005 1.00 5.15 C ATOM 2347 OG SER A 151 4.870 -10.082 -1.877 1.00 72.32 O ATOM 0 H SER A 151 4.069 -7.781 -2.149 1.00 3.25 H new ATOM 0 HA SER A 151 3.993 -8.852 0.401 1.00 22.45 H new ATOM 0 HB2 SER A 151 6.339 -8.661 -1.583 1.00 5.15 H new ATOM 0 HB3 SER A 151 6.192 -9.854 -0.307 1.00 5.15 H new ATOM 0 HG SER A 151 4.124 -10.483 -1.384 1.00 72.32 H new ATOM 2353 N PRO A 152 5.567 -7.793 2.085 1.00 23.11 N ATOM 2354 CA PRO A 152 6.419 -7.149 3.120 1.00 65.31 C ATOM 2355 C PRO A 152 7.931 -7.287 2.850 1.00 3.44 C ATOM 2356 O PRO A 152 8.360 -7.935 1.889 1.00 53.20 O ATOM 2357 CB PRO A 152 6.006 -7.851 4.446 1.00 74.42 C ATOM 2358 CG PRO A 152 5.392 -9.143 4.027 1.00 24.03 C ATOM 2359 CD PRO A 152 4.756 -8.891 2.680 1.00 21.43 C ATOM 0 HA PRO A 152 6.261 -6.071 3.141 1.00 65.31 H new ATOM 0 HB2 PRO A 152 6.870 -8.016 5.090 1.00 74.42 H new ATOM 0 HB3 PRO A 152 5.299 -7.243 5.010 1.00 74.42 H new ATOM 0 HG2 PRO A 152 6.145 -9.928 3.961 1.00 24.03 H new ATOM 0 HG3 PRO A 152 4.649 -9.474 4.752 1.00 24.03 H new ATOM 0 HD2 PRO A 152 4.780 -9.785 2.056 1.00 21.43 H new ATOM 0 HD3 PRO A 152 3.710 -8.601 2.783 1.00 21.43 H new ATOM 2367 N PHE A 153 8.726 -6.639 3.715 1.00 63.41 N ATOM 2368 CA PHE A 153 10.195 -6.638 3.620 1.00 64.22 C ATOM 2369 C PHE A 153 10.759 -7.281 4.897 1.00 10.23 C ATOM 2370 O PHE A 153 11.536 -8.243 4.828 1.00 30.22 O ATOM 2371 CB PHE A 153 10.735 -5.199 3.410 1.00 61.05 C ATOM 2372 CG PHE A 153 10.189 -4.519 2.153 1.00 74.02 C ATOM 2373 CD1 PHE A 153 10.787 -4.731 0.908 1.00 23.12 C ATOM 2374 CD2 PHE A 153 9.057 -3.697 2.211 1.00 42.54 C ATOM 2375 CE1 PHE A 153 10.282 -4.136 -0.229 1.00 34.03 C ATOM 2376 CE2 PHE A 153 8.551 -3.104 1.066 1.00 53.33 C ATOM 2377 CZ PHE A 153 9.163 -3.328 -0.154 1.00 23.22 C ATOM 0 H PHE A 153 8.368 -6.099 4.503 1.00 63.41 H new ATOM 0 HA PHE A 153 10.517 -7.217 2.755 1.00 64.22 H new ATOM 0 HB2 PHE A 153 10.481 -4.594 4.280 1.00 61.05 H new ATOM 0 HB3 PHE A 153 11.823 -5.233 3.352 1.00 61.05 H new ATOM 0 HD1 PHE A 153 11.656 -5.369 0.835 1.00 23.12 H new ATOM 0 HD2 PHE A 153 8.572 -3.523 3.160 1.00 42.54 H new ATOM 0 HE1 PHE A 153 10.763 -4.302 -1.182 1.00 34.03 H new ATOM 0 HE2 PHE A 153 7.680 -2.468 1.126 1.00 53.33 H new ATOM 0 HZ PHE A 153 8.766 -2.871 -1.049 1.00 23.22 H new ATOM 2387 N CYS A 154 10.314 -6.756 6.067 1.00 54.24 N ATOM 2388 CA CYS A 154 10.743 -7.235 7.403 1.00 41.03 C ATOM 2389 C CYS A 154 10.320 -8.689 7.682 1.00 21.23 C ATOM 2390 O CYS A 154 11.080 -9.451 8.295 1.00 3.41 O ATOM 2391 CB CYS A 154 10.198 -6.321 8.515 1.00 72.01 C ATOM 2392 SG CYS A 154 10.809 -6.712 10.167 1.00 61.10 S ATOM 0 H CYS A 154 9.646 -5.987 6.109 1.00 54.24 H new ATOM 0 HA CYS A 154 11.833 -7.202 7.400 1.00 41.03 H new ATOM 0 HB2 CYS A 154 10.457 -5.289 8.280 1.00 72.01 H new ATOM 0 HB3 CYS A 154 9.110 -6.383 8.519 1.00 72.01 H new ATOM 0 HG CYS A 154 11.979 -6.171 10.336 1.00 61.10 H new ATOM 2398 N ALA A 155 9.100 -9.065 7.241 1.00 52.32 N ATOM 2399 CA ALA A 155 8.554 -10.424 7.459 1.00 3.43 C ATOM 2400 C ALA A 155 9.418 -11.502 6.795 1.00 14.30 C ATOM 2401 O ALA A 155 9.622 -12.580 7.361 1.00 63.13 O ATOM 2402 CB ALA A 155 7.112 -10.520 6.960 1.00 51.12 C ATOM 0 H ALA A 155 8.472 -8.445 6.730 1.00 52.32 H new ATOM 0 HA ALA A 155 8.567 -10.604 8.534 1.00 3.43 H new ATOM 0 HB1 ALA A 155 6.734 -11.528 7.132 1.00 51.12 H new ATOM 0 HB2 ALA A 155 6.492 -9.803 7.499 1.00 51.12 H new ATOM 0 HB3 ALA A 155 7.080 -10.297 5.893 1.00 51.12 H new ATOM 2408 N TYR A 156 9.939 -11.190 5.605 1.00 43.13 N ATOM 2409 CA TYR A 156 10.784 -12.117 4.838 1.00 1.13 C ATOM 2410 C TYR A 156 12.256 -12.026 5.286 1.00 51.44 C ATOM 2411 O TYR A 156 12.989 -13.019 5.228 1.00 4.25 O ATOM 2412 CB TYR A 156 10.671 -11.808 3.334 1.00 63.24 C ATOM 2413 CG TYR A 156 9.284 -12.058 2.721 1.00 35.04 C ATOM 2414 CD1 TYR A 156 8.832 -13.350 2.431 1.00 73.01 C ATOM 2415 CD2 TYR A 156 8.447 -11.001 2.391 1.00 11.22 C ATOM 2416 CE1 TYR A 156 7.598 -13.565 1.843 1.00 35.10 C ATOM 2417 CE2 TYR A 156 7.221 -11.214 1.800 1.00 11.32 C ATOM 2418 CZ TYR A 156 6.796 -12.488 1.528 1.00 13.41 C ATOM 2419 OH TYR A 156 5.576 -12.680 0.913 1.00 31.30 O ATOM 0 H TYR A 156 9.789 -10.292 5.145 1.00 43.13 H new ATOM 0 HA TYR A 156 10.434 -13.132 5.026 1.00 1.13 H new ATOM 0 HB2 TYR A 156 10.940 -10.764 3.172 1.00 63.24 H new ATOM 0 HB3 TYR A 156 11.403 -12.413 2.798 1.00 63.24 H new ATOM 0 HD1 TYR A 156 9.459 -14.196 2.671 1.00 73.01 H new ATOM 0 HD2 TYR A 156 8.764 -9.990 2.602 1.00 11.22 H new ATOM 0 HE1 TYR A 156 7.265 -14.570 1.632 1.00 35.10 H new ATOM 0 HE2 TYR A 156 6.592 -10.373 1.550 1.00 11.32 H new ATOM 0 HH TYR A 156 4.970 -13.146 1.526 1.00 31.30 H new ATOM 2429 N SER A 157 12.684 -10.828 5.721 1.00 33.24 N ATOM 2430 CA SER A 157 14.076 -10.566 6.118 1.00 3.12 C ATOM 2431 C SER A 157 14.116 -9.672 7.376 1.00 35.23 C ATOM 2432 O SER A 157 13.736 -8.498 7.323 1.00 3.25 O ATOM 2433 CB SER A 157 14.847 -9.897 4.951 1.00 20.31 C ATOM 2434 OG SER A 157 14.897 -10.723 3.794 1.00 64.25 O ATOM 0 H SER A 157 12.074 -10.015 5.807 1.00 33.24 H new ATOM 0 HA SER A 157 14.558 -11.515 6.355 1.00 3.12 H new ATOM 0 HB2 SER A 157 14.370 -8.950 4.699 1.00 20.31 H new ATOM 0 HB3 SER A 157 15.862 -9.666 5.274 1.00 20.31 H new ATOM 0 HG SER A 157 14.011 -10.755 3.377 1.00 64.25 H new ATOM 2440 N ASP A 158 14.613 -10.234 8.496 1.00 70.35 N ATOM 2441 CA ASP A 158 14.663 -9.554 9.817 1.00 72.23 C ATOM 2442 C ASP A 158 15.679 -8.385 9.841 1.00 30.22 C ATOM 2443 O ASP A 158 15.734 -7.626 10.818 1.00 65.31 O ATOM 2444 CB ASP A 158 15.009 -10.579 10.934 1.00 72.41 C ATOM 2445 CG ASP A 158 13.968 -11.704 11.064 1.00 31.54 C ATOM 2446 OD1 ASP A 158 12.882 -11.454 11.629 1.00 34.43 O ATOM 2447 OD2 ASP A 158 14.222 -12.836 10.595 1.00 1.35 O ATOM 0 H ASP A 158 14.995 -11.180 8.515 1.00 70.35 H new ATOM 0 HA ASP A 158 13.675 -9.131 9.998 1.00 72.23 H new ATOM 0 HB2 ASP A 158 15.985 -11.018 10.727 1.00 72.41 H new ATOM 0 HB3 ASP A 158 15.090 -10.056 11.887 1.00 72.41 H new ATOM 2452 N THR A 159 16.474 -8.255 8.765 1.00 70.13 N ATOM 2453 CA THR A 159 17.453 -7.164 8.599 1.00 60.32 C ATOM 2454 C THR A 159 16.767 -5.787 8.389 1.00 64.02 C ATOM 2455 O THR A 159 17.430 -4.745 8.483 1.00 23.33 O ATOM 2456 CB THR A 159 18.426 -7.472 7.409 1.00 32.42 C ATOM 2457 OG1 THR A 159 19.465 -6.472 7.317 1.00 32.30 O ATOM 2458 CG2 THR A 159 17.684 -7.558 6.065 1.00 25.55 C ATOM 0 H THR A 159 16.456 -8.907 7.981 1.00 70.13 H new ATOM 0 HA THR A 159 18.027 -7.106 9.524 1.00 60.32 H new ATOM 0 HB THR A 159 18.874 -8.443 7.617 1.00 32.42 H new ATOM 0 HG1 THR A 159 19.119 -5.611 7.630 1.00 32.30 H new ATOM 0 HG21 THR A 159 18.397 -7.773 5.269 1.00 25.55 H new ATOM 0 HG22 THR A 159 16.940 -8.353 6.110 1.00 25.55 H new ATOM 0 HG23 THR A 159 17.188 -6.609 5.862 1.00 25.55 H new ATOM 2466 N PHE A 160 15.446 -5.792 8.118 1.00 72.11 N ATOM 2467 CA PHE A 160 14.641 -4.562 8.013 1.00 51.45 C ATOM 2468 C PHE A 160 13.994 -4.288 9.382 1.00 33.53 C ATOM 2469 O PHE A 160 13.526 -5.229 10.046 1.00 44.44 O ATOM 2470 CB PHE A 160 13.521 -4.710 6.948 1.00 72.55 C ATOM 2471 CG PHE A 160 13.986 -4.919 5.508 1.00 22.40 C ATOM 2472 CD1 PHE A 160 14.209 -6.201 5.004 1.00 1.23 C ATOM 2473 CD2 PHE A 160 14.163 -3.838 4.645 1.00 72.13 C ATOM 2474 CE1 PHE A 160 14.599 -6.397 3.692 1.00 30.35 C ATOM 2475 CE2 PHE A 160 14.548 -4.036 3.332 1.00 13.11 C ATOM 2476 CZ PHE A 160 14.768 -5.314 2.857 1.00 5.45 C ATOM 0 H PHE A 160 14.910 -6.647 7.967 1.00 72.11 H new ATOM 0 HA PHE A 160 15.292 -3.741 7.713 1.00 51.45 H new ATOM 0 HB2 PHE A 160 12.889 -5.552 7.230 1.00 72.55 H new ATOM 0 HB3 PHE A 160 12.896 -3.817 6.981 1.00 72.55 H new ATOM 0 HD1 PHE A 160 14.075 -7.056 5.650 1.00 1.23 H new ATOM 0 HD2 PHE A 160 13.997 -2.834 5.007 1.00 72.13 H new ATOM 0 HE1 PHE A 160 14.771 -7.397 3.322 1.00 30.35 H new ATOM 0 HE2 PHE A 160 14.677 -3.188 2.675 1.00 13.11 H new ATOM 0 HZ PHE A 160 15.072 -5.464 1.832 1.00 5.45 H new ATOM 2486 N SER A 161 13.989 -3.021 9.816 1.00 10.30 N ATOM 2487 CA SER A 161 13.244 -2.597 11.005 1.00 1.25 C ATOM 2488 C SER A 161 11.796 -2.334 10.563 1.00 53.31 C ATOM 2489 O SER A 161 11.566 -1.502 9.676 1.00 4.12 O ATOM 2490 CB SER A 161 13.890 -1.341 11.641 1.00 65.14 C ATOM 2491 OG SER A 161 13.207 -0.933 12.823 1.00 65.31 O ATOM 0 H SER A 161 14.498 -2.267 9.355 1.00 10.30 H new ATOM 0 HA SER A 161 13.263 -3.370 11.773 1.00 1.25 H new ATOM 0 HB2 SER A 161 14.933 -1.550 11.878 1.00 65.14 H new ATOM 0 HB3 SER A 161 13.885 -0.525 10.919 1.00 65.14 H new ATOM 0 HG SER A 161 13.644 -0.139 13.196 1.00 65.31 H new ATOM 2497 N CYS A 162 10.841 -3.051 11.174 1.00 14.20 N ATOM 2498 CA CYS A 162 9.435 -3.086 10.738 1.00 42.31 C ATOM 2499 C CYS A 162 8.776 -1.689 10.810 1.00 33.34 C ATOM 2500 O CYS A 162 9.154 -0.878 11.666 1.00 44.10 O ATOM 2501 CB CYS A 162 8.676 -4.092 11.629 1.00 12.52 C ATOM 2502 SG CYS A 162 8.837 -3.759 13.403 1.00 35.12 S ATOM 0 H CYS A 162 11.024 -3.630 11.994 1.00 14.20 H new ATOM 0 HA CYS A 162 9.393 -3.398 9.695 1.00 42.31 H new ATOM 0 HB2 CYS A 162 7.620 -4.077 11.360 1.00 12.52 H new ATOM 0 HB3 CYS A 162 9.044 -5.097 11.422 1.00 12.52 H new ATOM 0 HG CYS A 162 8.168 -4.649 14.074 1.00 35.12 H new ATOM 2508 N PRO A 163 7.767 -1.385 9.930 1.00 21.33 N ATOM 2509 CA PRO A 163 7.098 -0.067 9.924 1.00 41.40 C ATOM 2510 C PRO A 163 6.147 0.061 11.128 1.00 41.44 C ATOM 2511 O PRO A 163 5.768 -0.955 11.728 1.00 0.15 O ATOM 2512 CB PRO A 163 6.343 -0.070 8.572 1.00 34.20 C ATOM 2513 CG PRO A 163 6.020 -1.515 8.316 1.00 50.31 C ATOM 2514 CD PRO A 163 7.166 -2.308 8.919 1.00 40.45 C ATOM 0 HA PRO A 163 7.779 0.779 10.015 1.00 41.40 H new ATOM 0 HB2 PRO A 163 5.438 0.535 8.623 1.00 34.20 H new ATOM 0 HB3 PRO A 163 6.959 0.345 7.774 1.00 34.20 H new ATOM 0 HG2 PRO A 163 5.070 -1.790 8.774 1.00 50.31 H new ATOM 0 HG3 PRO A 163 5.928 -1.712 7.248 1.00 50.31 H new ATOM 0 HD2 PRO A 163 6.811 -3.228 9.383 1.00 40.45 H new ATOM 0 HD3 PRO A 163 7.894 -2.594 8.160 1.00 40.45 H new ATOM 2522 N LEU A 164 5.762 1.294 11.488 1.00 31.51 N ATOM 2523 CA LEU A 164 4.838 1.548 12.599 1.00 74.41 C ATOM 2524 C LEU A 164 3.486 1.924 11.979 1.00 15.43 C ATOM 2525 O LEU A 164 3.324 3.052 11.497 1.00 24.52 O ATOM 2526 CB LEU A 164 5.389 2.671 13.550 1.00 64.40 C ATOM 2527 CG LEU A 164 4.648 2.902 14.931 1.00 3.24 C ATOM 2528 CD1 LEU A 164 3.298 3.651 14.788 1.00 51.43 C ATOM 2529 CD2 LEU A 164 4.465 1.570 15.690 1.00 21.24 C ATOM 0 H LEU A 164 6.082 2.140 11.017 1.00 31.51 H new ATOM 0 HA LEU A 164 4.726 0.663 13.225 1.00 74.41 H new ATOM 0 HB2 LEU A 164 6.433 2.445 13.765 1.00 64.40 H new ATOM 0 HB3 LEU A 164 5.373 3.612 13.000 1.00 64.40 H new ATOM 0 HG LEU A 164 5.295 3.554 15.517 1.00 3.24 H new ATOM 0 HD11 LEU A 164 2.845 3.775 15.772 1.00 51.43 H new ATOM 0 HD12 LEU A 164 3.471 4.630 14.342 1.00 51.43 H new ATOM 0 HD13 LEU A 164 2.628 3.075 14.150 1.00 51.43 H new ATOM 0 HD21 LEU A 164 3.954 1.757 16.634 1.00 21.24 H new ATOM 0 HD22 LEU A 164 3.871 0.885 15.085 1.00 21.24 H new ATOM 0 HD23 LEU A 164 5.441 1.127 15.887 1.00 21.24 H new ATOM 2541 N PRO A 165 2.508 0.968 11.916 1.00 62.20 N ATOM 2542 CA PRO A 165 1.137 1.282 11.517 1.00 15.12 C ATOM 2543 C PRO A 165 0.327 1.796 12.740 1.00 43.44 C ATOM 2544 O PRO A 165 0.237 1.090 13.754 1.00 70.04 O ATOM 2545 CB PRO A 165 0.608 -0.093 10.985 1.00 3.41 C ATOM 2546 CG PRO A 165 1.749 -1.074 11.135 1.00 32.21 C ATOM 2547 CD PRO A 165 2.648 -0.482 12.192 1.00 62.51 C ATOM 0 HA PRO A 165 1.055 2.072 10.770 1.00 15.12 H new ATOM 0 HB2 PRO A 165 -0.263 -0.420 11.553 1.00 3.41 H new ATOM 0 HB3 PRO A 165 0.298 -0.013 9.943 1.00 3.41 H new ATOM 0 HG2 PRO A 165 1.385 -2.057 11.434 1.00 32.21 H new ATOM 0 HG3 PRO A 165 2.282 -1.204 10.193 1.00 32.21 H new ATOM 0 HD2 PRO A 165 2.323 -0.742 13.200 1.00 62.51 H new ATOM 0 HD3 PRO A 165 3.679 -0.822 12.092 1.00 62.51 H new ATOM 2555 N PRO A 166 -0.259 3.036 12.680 1.00 64.13 N ATOM 2556 CA PRO A 166 -1.150 3.545 13.754 1.00 42.13 C ATOM 2557 C PRO A 166 -2.441 2.698 13.807 1.00 35.00 C ATOM 2558 O PRO A 166 -3.070 2.507 12.774 1.00 41.30 O ATOM 2559 CB PRO A 166 -1.434 5.009 13.318 1.00 61.43 C ATOM 2560 CG PRO A 166 -1.217 5.014 11.833 1.00 25.12 C ATOM 2561 CD PRO A 166 -0.084 4.040 11.585 1.00 21.45 C ATOM 0 HA PRO A 166 -0.718 3.492 14.754 1.00 42.13 H new ATOM 0 HB2 PRO A 166 -2.452 5.307 13.570 1.00 61.43 H new ATOM 0 HB3 PRO A 166 -0.764 5.708 13.818 1.00 61.43 H new ATOM 0 HG2 PRO A 166 -2.120 4.709 11.304 1.00 25.12 H new ATOM 0 HG3 PRO A 166 -0.961 6.012 11.477 1.00 25.12 H new ATOM 0 HD2 PRO A 166 -0.156 3.579 10.600 1.00 21.45 H new ATOM 0 HD3 PRO A 166 0.888 4.530 11.638 1.00 21.45 H new ATOM 2569 N GLU A 167 -2.838 2.248 15.017 1.00 61.13 N ATOM 2570 CA GLU A 167 -3.933 1.255 15.239 1.00 74.42 C ATOM 2571 C GLU A 167 -5.286 1.624 14.568 1.00 4.44 C ATOM 2572 O GLU A 167 -6.157 0.760 14.420 1.00 4.44 O ATOM 2573 CB GLU A 167 -4.136 1.035 16.758 1.00 20.43 C ATOM 2574 CG GLU A 167 -2.856 0.619 17.518 1.00 12.20 C ATOM 2575 CD GLU A 167 -3.098 0.386 19.018 1.00 70.34 C ATOM 2576 OE1 GLU A 167 -3.492 1.344 19.720 1.00 11.41 O ATOM 2577 OE2 GLU A 167 -2.924 -0.755 19.501 1.00 65.24 O ATOM 0 H GLU A 167 -2.406 2.564 15.885 1.00 61.13 H new ATOM 0 HA GLU A 167 -3.607 0.335 14.753 1.00 74.42 H new ATOM 0 HB2 GLU A 167 -4.523 1.954 17.198 1.00 20.43 H new ATOM 0 HB3 GLU A 167 -4.896 0.268 16.904 1.00 20.43 H new ATOM 0 HG2 GLU A 167 -2.456 -0.293 17.074 1.00 12.20 H new ATOM 0 HG3 GLU A 167 -2.098 1.393 17.394 1.00 12.20 H new ATOM 2584 N SER A 168 -5.434 2.897 14.149 1.00 25.30 N ATOM 2585 CA SER A 168 -6.621 3.403 13.428 1.00 31.15 C ATOM 2586 C SER A 168 -6.791 2.756 12.023 1.00 34.23 C ATOM 2587 O SER A 168 -7.893 2.778 11.451 1.00 14.42 O ATOM 2588 CB SER A 168 -6.501 4.939 13.284 1.00 50.20 C ATOM 2589 OG SER A 168 -6.370 5.560 14.552 1.00 5.04 O ATOM 0 H SER A 168 -4.724 3.612 14.304 1.00 25.30 H new ATOM 0 HA SER A 168 -7.503 3.135 14.009 1.00 31.15 H new ATOM 0 HB2 SER A 168 -5.638 5.183 12.665 1.00 50.20 H new ATOM 0 HB3 SER A 168 -7.381 5.330 12.773 1.00 50.20 H new ATOM 0 HG SER A 168 -6.294 6.530 14.435 1.00 5.04 H new ATOM 2595 N ASN A 169 -5.704 2.150 11.504 1.00 54.31 N ATOM 2596 CA ASN A 169 -5.654 1.596 10.131 1.00 44.52 C ATOM 2597 C ASN A 169 -6.016 0.094 10.107 1.00 24.22 C ATOM 2598 O ASN A 169 -6.000 -0.538 9.038 1.00 74.10 O ATOM 2599 CB ASN A 169 -4.234 1.831 9.534 1.00 52.30 C ATOM 2600 CG ASN A 169 -3.140 0.892 10.088 1.00 35.51 C ATOM 2601 OD1 ASN A 169 -3.199 0.394 11.207 1.00 20.41 O ATOM 2602 ND2 ASN A 169 -2.113 0.671 9.315 1.00 21.31 N ATOM 0 H ASN A 169 -4.834 2.030 12.023 1.00 54.31 H new ATOM 0 HA ASN A 169 -6.396 2.112 9.522 1.00 44.52 H new ATOM 0 HB2 ASN A 169 -4.285 1.710 8.452 1.00 52.30 H new ATOM 0 HB3 ASN A 169 -3.940 2.863 9.726 1.00 52.30 H new ATOM 0 HD21 ASN A 169 -1.349 0.079 9.639 1.00 21.31 H new ATOM 0 HD22 ASN A 169 -2.074 1.090 8.386 1.00 21.31 H new ATOM 2609 N TRP A 170 -6.318 -0.466 11.293 1.00 11.35 N ATOM 2610 CA TRP A 170 -6.641 -1.888 11.443 1.00 53.14 C ATOM 2611 C TRP A 170 -8.064 -2.161 10.925 1.00 51.03 C ATOM 2612 O TRP A 170 -9.048 -1.680 11.494 1.00 32.24 O ATOM 2613 CB TRP A 170 -6.504 -2.339 12.920 1.00 14.33 C ATOM 2614 CG TRP A 170 -5.084 -2.390 13.452 1.00 4.32 C ATOM 2615 CD1 TRP A 170 -3.922 -2.196 12.757 1.00 1.50 C ATOM 2616 CD2 TRP A 170 -4.689 -2.692 14.801 1.00 32.34 C ATOM 2617 NE1 TRP A 170 -2.846 -2.343 13.587 1.00 21.42 N ATOM 2618 CE2 TRP A 170 -3.285 -2.647 14.844 1.00 45.21 C ATOM 2619 CE3 TRP A 170 -5.389 -2.986 15.977 1.00 61.40 C ATOM 2620 CZ2 TRP A 170 -2.566 -2.890 16.013 1.00 13.41 C ATOM 2621 CZ3 TRP A 170 -4.673 -3.227 17.137 1.00 60.23 C ATOM 2622 CH2 TRP A 170 -3.275 -3.177 17.148 1.00 41.03 C ATOM 0 H TRP A 170 -6.344 0.057 12.169 1.00 11.35 H new ATOM 0 HA TRP A 170 -5.931 -2.466 10.851 1.00 53.14 H new ATOM 0 HB2 TRP A 170 -7.085 -1.661 13.545 1.00 14.33 H new ATOM 0 HB3 TRP A 170 -6.949 -3.328 13.024 1.00 14.33 H new ATOM 0 HD1 TRP A 170 -3.863 -1.961 11.705 1.00 1.50 H new ATOM 0 HE1 TRP A 170 -1.869 -2.242 13.311 1.00 21.42 H new ATOM 0 HE3 TRP A 170 -6.468 -3.024 15.979 1.00 61.40 H new ATOM 0 HZ2 TRP A 170 -1.487 -2.853 16.023 1.00 13.41 H new ATOM 0 HZ3 TRP A 170 -5.203 -3.458 18.049 1.00 60.23 H new ATOM 0 HH2 TRP A 170 -2.745 -3.368 18.069 1.00 41.03 H new ATOM 2633 N LEU A 171 -8.151 -2.948 9.851 1.00 12.04 N ATOM 2634 CA LEU A 171 -9.414 -3.362 9.251 1.00 1.53 C ATOM 2635 C LEU A 171 -9.798 -4.682 9.935 1.00 4.24 C ATOM 2636 O LEU A 171 -9.123 -5.695 9.711 1.00 52.34 O ATOM 2637 CB LEU A 171 -9.245 -3.566 7.705 1.00 51.43 C ATOM 2638 CG LEU A 171 -8.427 -2.475 6.927 1.00 10.12 C ATOM 2639 CD1 LEU A 171 -8.320 -2.821 5.426 1.00 3.12 C ATOM 2640 CD2 LEU A 171 -9.013 -1.063 7.135 1.00 53.42 C ATOM 0 H LEU A 171 -7.332 -3.319 9.369 1.00 12.04 H new ATOM 0 HA LEU A 171 -10.188 -2.607 9.389 1.00 1.53 H new ATOM 0 HB2 LEU A 171 -8.764 -4.531 7.541 1.00 51.43 H new ATOM 0 HB3 LEU A 171 -10.239 -3.625 7.261 1.00 51.43 H new ATOM 0 HG LEU A 171 -7.419 -2.470 7.341 1.00 10.12 H new ATOM 0 HD11 LEU A 171 -7.748 -2.047 4.914 1.00 3.12 H new ATOM 0 HD12 LEU A 171 -7.817 -3.781 5.309 1.00 3.12 H new ATOM 0 HD13 LEU A 171 -9.319 -2.880 4.994 1.00 3.12 H new ATOM 0 HD21 LEU A 171 -8.419 -0.337 6.580 1.00 53.42 H new ATOM 0 HD22 LEU A 171 -10.042 -1.040 6.776 1.00 53.42 H new ATOM 0 HD23 LEU A 171 -8.993 -0.813 8.196 1.00 53.42 H new ATOM 2652 N GLU A 172 -10.825 -4.678 10.806 1.00 2.40 N ATOM 2653 CA GLU A 172 -11.237 -5.895 11.539 1.00 50.41 C ATOM 2654 C GLU A 172 -12.217 -6.706 10.657 1.00 3.14 C ATOM 2655 O GLU A 172 -13.389 -6.929 10.984 1.00 53.12 O ATOM 2656 CB GLU A 172 -11.812 -5.527 12.936 1.00 13.20 C ATOM 2657 CG GLU A 172 -11.922 -6.714 13.926 1.00 20.32 C ATOM 2658 CD GLU A 172 -12.231 -6.277 15.371 1.00 13.10 C ATOM 2659 OE1 GLU A 172 -11.352 -5.633 15.998 1.00 74.43 O ATOM 2660 OE2 GLU A 172 -13.327 -6.588 15.895 1.00 32.12 O ATOM 0 H GLU A 172 -11.383 -3.852 11.020 1.00 2.40 H new ATOM 0 HA GLU A 172 -10.375 -6.532 11.738 1.00 50.41 H new ATOM 0 HB2 GLU A 172 -11.182 -4.758 13.382 1.00 13.20 H new ATOM 0 HB3 GLU A 172 -12.802 -5.090 12.803 1.00 13.20 H new ATOM 0 HG2 GLU A 172 -12.704 -7.392 13.584 1.00 20.32 H new ATOM 0 HG3 GLU A 172 -10.987 -7.274 13.915 1.00 20.32 H new ATOM 2667 N THR A 173 -11.661 -7.122 9.509 1.00 10.12 N ATOM 2668 CA THR A 173 -12.325 -7.865 8.445 1.00 25.14 C ATOM 2669 C THR A 173 -11.229 -8.434 7.519 1.00 35.41 C ATOM 2670 O THR A 173 -10.083 -7.944 7.523 1.00 12.53 O ATOM 2671 CB THR A 173 -13.314 -6.961 7.632 1.00 74.01 C ATOM 2672 OG1 THR A 173 -14.047 -7.758 6.689 1.00 32.40 O ATOM 2673 CG2 THR A 173 -12.595 -5.808 6.895 1.00 3.22 C ATOM 0 H THR A 173 -10.682 -6.935 9.293 1.00 10.12 H new ATOM 0 HA THR A 173 -12.922 -8.667 8.879 1.00 25.14 H new ATOM 0 HB THR A 173 -13.998 -6.510 8.350 1.00 74.01 H new ATOM 0 HG1 THR A 173 -15.008 -7.636 6.835 1.00 32.40 H new ATOM 0 HG21 THR A 173 -13.327 -5.214 6.348 1.00 3.22 H new ATOM 0 HG22 THR A 173 -12.083 -5.176 7.620 1.00 3.22 H new ATOM 0 HG23 THR A 173 -11.867 -6.221 6.196 1.00 3.22 H new ATOM 2681 N ALA A 174 -11.561 -9.464 6.740 1.00 62.41 N ATOM 2682 CA ALA A 174 -10.601 -10.102 5.830 1.00 54.15 C ATOM 2683 C ALA A 174 -10.645 -9.395 4.470 1.00 63.31 C ATOM 2684 O ALA A 174 -11.731 -9.177 3.913 1.00 42.44 O ATOM 2685 CB ALA A 174 -10.901 -11.599 5.681 1.00 75.33 C ATOM 0 H ALA A 174 -12.493 -9.878 6.719 1.00 62.41 H new ATOM 0 HA ALA A 174 -9.598 -10.010 6.246 1.00 54.15 H new ATOM 0 HB1 ALA A 174 -10.177 -12.049 5.002 1.00 75.33 H new ATOM 0 HB2 ALA A 174 -10.834 -12.082 6.656 1.00 75.33 H new ATOM 0 HB3 ALA A 174 -11.906 -11.731 5.279 1.00 75.33 H new ATOM 2691 N VAL A 175 -9.470 -9.013 3.962 1.00 24.11 N ATOM 2692 CA VAL A 175 -9.317 -8.498 2.601 1.00 51.44 C ATOM 2693 C VAL A 175 -8.871 -9.672 1.720 1.00 74.22 C ATOM 2694 O VAL A 175 -7.682 -9.977 1.639 1.00 55.15 O ATOM 2695 CB VAL A 175 -8.275 -7.309 2.520 1.00 13.30 C ATOM 2696 CG1 VAL A 175 -8.101 -6.800 1.064 1.00 73.52 C ATOM 2697 CG2 VAL A 175 -8.674 -6.156 3.477 1.00 55.20 C ATOM 0 H VAL A 175 -8.596 -9.053 4.486 1.00 24.11 H new ATOM 0 HA VAL A 175 -10.266 -8.086 2.258 1.00 51.44 H new ATOM 0 HB VAL A 175 -7.308 -7.694 2.844 1.00 13.30 H new ATOM 0 HG11 VAL A 175 -7.378 -5.984 1.048 1.00 73.52 H new ATOM 0 HG12 VAL A 175 -7.743 -7.614 0.434 1.00 73.52 H new ATOM 0 HG13 VAL A 175 -9.059 -6.444 0.686 1.00 73.52 H new ATOM 0 HG21 VAL A 175 -7.942 -5.352 3.403 1.00 55.20 H new ATOM 0 HG22 VAL A 175 -9.658 -5.778 3.201 1.00 55.20 H new ATOM 0 HG23 VAL A 175 -8.702 -6.527 4.502 1.00 55.20 H new ATOM 2707 N THR A 176 -9.843 -10.379 1.130 1.00 63.13 N ATOM 2708 CA THR A 176 -9.581 -11.471 0.186 1.00 53.23 C ATOM 2709 C THR A 176 -10.058 -11.027 -1.200 1.00 61.32 C ATOM 2710 O THR A 176 -11.249 -10.758 -1.403 1.00 12.43 O ATOM 2711 CB THR A 176 -10.259 -12.819 0.630 1.00 4.15 C ATOM 2712 OG1 THR A 176 -11.668 -12.643 0.868 1.00 51.34 O ATOM 2713 CG2 THR A 176 -9.602 -13.402 1.900 1.00 45.33 C ATOM 0 H THR A 176 -10.835 -10.209 1.295 1.00 63.13 H new ATOM 0 HA THR A 176 -8.511 -11.677 0.162 1.00 53.23 H new ATOM 0 HB THR A 176 -10.117 -13.520 -0.192 1.00 4.15 H new ATOM 0 HG1 THR A 176 -12.027 -11.986 0.236 1.00 51.34 H new ATOM 0 HG21 THR A 176 -10.100 -14.333 2.173 1.00 45.33 H new ATOM 0 HG22 THR A 176 -8.547 -13.598 1.707 1.00 45.33 H new ATOM 0 HG23 THR A 176 -9.695 -12.688 2.718 1.00 45.33 H new ATOM 2721 N ALA A 177 -9.105 -10.922 -2.125 1.00 22.54 N ATOM 2722 CA ALA A 177 -9.317 -10.377 -3.467 1.00 1.11 C ATOM 2723 C ALA A 177 -8.455 -11.156 -4.455 1.00 0.34 C ATOM 2724 O ALA A 177 -7.281 -11.407 -4.160 1.00 53.15 O ATOM 2725 CB ALA A 177 -8.956 -8.892 -3.467 1.00 74.32 C ATOM 0 H ALA A 177 -8.143 -11.219 -1.960 1.00 22.54 H new ATOM 0 HA ALA A 177 -10.361 -10.475 -3.764 1.00 1.11 H new ATOM 0 HB1 ALA A 177 -9.112 -8.480 -4.464 1.00 74.32 H new ATOM 0 HB2 ALA A 177 -9.588 -8.364 -2.753 1.00 74.32 H new ATOM 0 HB3 ALA A 177 -7.910 -8.772 -3.184 1.00 74.32 H new ATOM 2731 N GLY A 178 -9.033 -11.533 -5.620 1.00 52.12 N ATOM 2732 CA GLY A 178 -8.358 -12.445 -6.544 1.00 34.04 C ATOM 2733 C GLY A 178 -8.059 -13.795 -5.893 1.00 61.42 C ATOM 2734 O GLY A 178 -8.896 -14.320 -5.140 1.00 44.41 O ATOM 0 H GLY A 178 -9.953 -11.219 -5.930 1.00 52.12 H new ATOM 0 HA2 GLY A 178 -8.981 -12.597 -7.425 1.00 34.04 H new ATOM 0 HA3 GLY A 178 -7.427 -11.992 -6.886 1.00 34.04 H new ATOM 2738 N GLU A 179 -6.905 -14.389 -6.225 1.00 44.41 N ATOM 2739 CA GLU A 179 -6.359 -15.524 -5.463 1.00 4.20 C ATOM 2740 C GLU A 179 -5.880 -15.045 -4.061 1.00 1.42 C ATOM 2741 O GLU A 179 -5.479 -13.887 -3.886 1.00 60.42 O ATOM 2742 CB GLU A 179 -5.196 -16.200 -6.249 1.00 74.03 C ATOM 2743 CG GLU A 179 -4.624 -17.488 -5.599 1.00 53.31 C ATOM 2744 CD GLU A 179 -5.676 -18.605 -5.413 1.00 51.12 C ATOM 2745 OE1 GLU A 179 -5.970 -19.334 -6.385 1.00 33.31 O ATOM 2746 OE2 GLU A 179 -6.222 -18.757 -4.297 1.00 35.12 O ATOM 0 H GLU A 179 -6.330 -14.103 -7.017 1.00 44.41 H new ATOM 0 HA GLU A 179 -7.145 -16.266 -5.323 1.00 4.20 H new ATOM 0 HB2 GLU A 179 -5.549 -16.443 -7.251 1.00 74.03 H new ATOM 0 HB3 GLU A 179 -4.387 -15.478 -6.362 1.00 74.03 H new ATOM 0 HG2 GLU A 179 -3.810 -17.866 -6.217 1.00 53.31 H new ATOM 0 HG3 GLU A 179 -4.197 -17.237 -4.628 1.00 53.31 H new ATOM 2753 N ARG A 180 -5.923 -15.960 -3.081 1.00 53.22 N ATOM 2754 CA ARG A 180 -5.544 -15.688 -1.681 1.00 75.25 C ATOM 2755 C ARG A 180 -4.373 -16.599 -1.284 1.00 21.54 C ATOM 2756 O ARG A 180 -4.387 -17.802 -1.572 1.00 70.42 O ATOM 2757 CB ARG A 180 -6.760 -15.944 -0.733 1.00 73.54 C ATOM 2758 CG ARG A 180 -7.452 -17.316 -0.948 1.00 52.24 C ATOM 2759 CD ARG A 180 -8.516 -17.648 0.112 1.00 13.00 C ATOM 2760 NE ARG A 180 -7.927 -18.073 1.395 1.00 73.11 N ATOM 2761 CZ ARG A 180 -8.625 -18.339 2.519 1.00 40.23 C ATOM 2762 NH1 ARG A 180 -9.949 -18.229 2.549 1.00 32.11 N ATOM 2763 NH2 ARG A 180 -7.988 -18.752 3.603 1.00 34.53 N ATOM 0 H ARG A 180 -6.225 -16.922 -3.237 1.00 53.22 H new ATOM 0 HA ARG A 180 -5.242 -14.645 -1.588 1.00 75.25 H new ATOM 0 HB2 ARG A 180 -6.421 -15.878 0.301 1.00 73.54 H new ATOM 0 HB3 ARG A 180 -7.494 -15.152 -0.879 1.00 73.54 H new ATOM 0 HG2 ARG A 180 -7.918 -17.327 -1.933 1.00 52.24 H new ATOM 0 HG3 ARG A 180 -6.694 -18.099 -0.946 1.00 52.24 H new ATOM 0 HD2 ARG A 180 -9.144 -16.773 0.277 1.00 13.00 H new ATOM 0 HD3 ARG A 180 -9.165 -18.439 -0.265 1.00 13.00 H new ATOM 0 HE ARG A 180 -6.913 -18.174 1.436 1.00 73.11 H new ATOM 0 HH11 ARG A 180 -10.456 -17.939 1.713 1.00 32.11 H new ATOM 0 HH12 ARG A 180 -10.458 -18.435 3.408 1.00 32.11 H new ATOM 0 HH21 ARG A 180 -6.975 -18.868 3.586 1.00 34.53 H new ATOM 0 HH22 ARG A 180 -8.510 -18.955 4.455 1.00 34.53 H new