USER MOD reduce.3.24.130724 H: found=0, std=0, add=912, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 915 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 10 GLN : amide:sc= -0.937 K(o=-0.94,f=-3.2!) USER MOD Set 1.2: A 83 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 3 SER OG : rot 163:sc= 1.06 USER MOD Set 2.2: A 79 SER OG : rot -140:sc= -0.356 USER MOD Set 2.3: A 101 HIS :FLIP no HE2:sc= -2.04! F(o=-2.3,f=-1.3!) USER MOD Set 3.1: A 33 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 36 THR OG1 : rot -80:sc= -0.588 USER MOD Set 4.1: A 25 ASN : amide:sc= -1.77 K(o=-1.8,f=-8.2!) USER MOD Set 4.2: A 27 ASN :FLIP amide:sc= 0 F(o=-2.6,f=-1.8) USER MOD Set 5.1: A 15 THR OG1 : rot 132:sc= 0.247 USER MOD Set 5.2: A 63 ASN :FLIP amide:sc= -0.14 F(o=-4.1!,f=0.11) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 180:sc=-0.00511 USER MOD Single : A 26 SER OG : rot 90:sc= -0.55 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 44 GLN :FLIP amide:sc= -1.91 F(o=-2.8,f=-1.9) USER MOD Single : A 53 GLN : amide:sc= -1.97 K(o=-2,f=-8.6!) USER MOD Single : A 56 TYR OH : rot 98:sc= 0.0384 USER MOD Single : A 58 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00228) USER MOD Single : A 60 CYS SG : rot 160:sc= -5.13! USER MOD Single : A 64 SER OG : rot 140:sc= -1.08 USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0.262 USER MOD Single : A 84 CYS SG : rot -118:sc= 0.773 USER MOD Single : A 87 HIS : no HD1:sc= 0 X(o=0,f=-0.0038) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 LYS NZ :NH3+ -141:sc= -1.3 (180deg=-3.6!) USER MOD Single : A 124 CYS SG : rot 32:sc= -0.101 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 131 HIS :FLIP no HE2:sc= -2.01 F(o=-4.7!,f=-2) USER MOD Single : A 140 TYR OH : rot 140:sc= -1.31 USER MOD Single : A 146 SER OG : rot -143:sc= 1.08 USER MOD ----------------------------------------------------------------- ATOM 32 N SER A 3 6.054 5.087 10.996 1.00 0.00 N ATOM 33 CA SER A 3 4.955 4.774 10.090 1.00 0.00 C ATOM 34 C SER A 3 4.163 3.571 10.589 1.00 0.00 C ATOM 35 O SER A 3 4.717 2.669 11.219 1.00 0.00 O ATOM 36 CB SER A 3 5.491 4.502 8.683 1.00 0.00 C ATOM 37 OG SER A 3 6.394 3.409 8.683 1.00 0.00 O ATOM 0 HA SER A 3 4.287 5.634 10.057 1.00 0.00 H new ATOM 0 HB2 SER A 3 4.661 4.292 8.009 1.00 0.00 H new ATOM 0 HB3 SER A 3 5.993 5.392 8.303 1.00 0.00 H new ATOM 0 HG SER A 3 6.515 3.085 7.766 1.00 0.00 H new ATOM 43 N GLY A 4 2.863 3.559 10.304 1.00 0.00 N ATOM 44 CA GLY A 4 2.021 2.457 10.736 1.00 0.00 C ATOM 45 C GLY A 4 0.685 2.424 10.020 1.00 0.00 C ATOM 46 O GLY A 4 0.045 3.459 9.840 1.00 0.00 O ATOM 0 H GLY A 4 2.379 4.291 9.783 1.00 0.00 H new ATOM 0 HA2 GLY A 4 2.544 1.516 10.563 1.00 0.00 H new ATOM 0 HA3 GLY A 4 1.851 2.535 11.810 1.00 0.00 H new ATOM 50 N LEU A 5 0.261 1.234 9.610 1.00 0.00 N ATOM 51 CA LEU A 5 -1.009 1.077 8.910 1.00 0.00 C ATOM 52 C LEU A 5 -2.176 1.502 9.792 1.00 0.00 C ATOM 53 O LEU A 5 -2.381 0.953 10.875 1.00 0.00 O ATOM 54 CB LEU A 5 -1.196 -0.375 8.466 1.00 0.00 C ATOM 55 CG LEU A 5 -1.947 -0.559 7.146 1.00 0.00 C ATOM 56 CD1 LEU A 5 -3.413 -0.192 7.313 1.00 0.00 C ATOM 57 CD2 LEU A 5 -1.308 0.277 6.046 1.00 0.00 C ATOM 0 H LEU A 5 0.777 0.365 9.750 1.00 0.00 H new ATOM 0 HA LEU A 5 -0.989 1.721 8.031 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -0.214 -0.840 8.375 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -1.732 -0.912 9.249 1.00 0.00 H new ATOM 0 HG LEU A 5 -1.885 -1.608 6.858 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -3.933 -0.329 6.365 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -3.865 -0.833 8.070 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -3.494 0.849 7.624 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -1.856 0.133 5.115 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -1.338 1.330 6.326 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -0.272 -0.033 5.909 1.00 0.00 H new ATOM 69 N GLU A 6 -2.940 2.481 9.320 1.00 0.00 N ATOM 70 CA GLU A 6 -4.090 2.978 10.065 1.00 0.00 C ATOM 71 C GLU A 6 -5.343 2.965 9.195 1.00 0.00 C ATOM 72 O GLU A 6 -5.277 3.208 7.991 1.00 0.00 O ATOM 73 CB GLU A 6 -3.822 4.395 10.575 1.00 0.00 C ATOM 74 CG GLU A 6 -3.201 4.436 11.962 1.00 0.00 C ATOM 75 CD GLU A 6 -4.139 3.925 13.036 1.00 0.00 C ATOM 76 OE1 GLU A 6 -5.097 4.649 13.383 1.00 0.00 O ATOM 77 OE2 GLU A 6 -3.919 2.800 13.533 1.00 0.00 O ATOM 0 H GLU A 6 -2.784 2.946 8.426 1.00 0.00 H new ATOM 0 HA GLU A 6 -4.253 2.320 10.918 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -3.160 4.905 9.875 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -4.760 4.950 10.590 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -2.290 3.838 11.966 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -2.911 5.460 12.196 1.00 0.00 H new ATOM 84 N VAL A 7 -6.484 2.680 9.813 1.00 0.00 N ATOM 85 CA VAL A 7 -7.749 2.635 9.093 1.00 0.00 C ATOM 86 C VAL A 7 -8.264 4.041 8.806 1.00 0.00 C ATOM 87 O VAL A 7 -8.841 4.692 9.677 1.00 0.00 O ATOM 88 CB VAL A 7 -8.819 1.859 9.884 1.00 0.00 C ATOM 89 CG1 VAL A 7 -10.067 1.653 9.038 1.00 0.00 C ATOM 90 CG2 VAL A 7 -8.267 0.526 10.365 1.00 0.00 C ATOM 0 H VAL A 7 -6.558 2.477 10.810 1.00 0.00 H new ATOM 0 HA VAL A 7 -7.561 2.119 8.152 1.00 0.00 H new ATOM 0 HB VAL A 7 -9.095 2.449 10.758 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -10.811 1.103 9.615 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -10.475 2.622 8.750 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -9.810 1.086 8.143 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -9.038 -0.007 10.922 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -7.960 -0.072 9.507 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -7.407 0.700 11.012 1.00 0.00 H new ATOM 100 N LEU A 8 -8.052 4.502 7.577 1.00 0.00 N ATOM 101 CA LEU A 8 -8.495 5.832 7.172 1.00 0.00 C ATOM 102 C LEU A 8 -9.878 5.771 6.533 1.00 0.00 C ATOM 103 O LEU A 8 -10.455 4.695 6.379 1.00 0.00 O ATOM 104 CB LEU A 8 -7.494 6.449 6.193 1.00 0.00 C ATOM 105 CG LEU A 8 -6.105 6.724 6.773 1.00 0.00 C ATOM 106 CD1 LEU A 8 -5.104 6.984 5.658 1.00 0.00 C ATOM 107 CD2 LEU A 8 -6.155 7.906 7.731 1.00 0.00 C ATOM 0 H LEU A 8 -7.577 3.975 6.845 1.00 0.00 H new ATOM 0 HA LEU A 8 -8.553 6.457 8.063 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -7.388 5.782 5.337 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -7.906 7.386 5.818 1.00 0.00 H new ATOM 0 HG LEU A 8 -5.781 5.843 7.327 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -4.122 7.178 6.089 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -5.049 6.111 5.007 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -5.423 7.850 5.078 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -5.159 8.089 8.135 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -6.499 8.792 7.198 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -6.843 7.684 8.547 1.00 0.00 H new ATOM 119 N PHE A 9 -10.405 6.933 6.162 1.00 0.00 N ATOM 120 CA PHE A 9 -11.720 7.009 5.538 1.00 0.00 C ATOM 121 C PHE A 9 -11.725 8.017 4.395 1.00 0.00 C ATOM 122 O PHE A 9 -10.996 9.008 4.424 1.00 0.00 O ATOM 123 CB PHE A 9 -12.779 7.388 6.575 1.00 0.00 C ATOM 124 CG PHE A 9 -13.460 6.200 7.195 1.00 0.00 C ATOM 125 CD1 PHE A 9 -12.767 5.353 8.045 1.00 0.00 C ATOM 126 CD2 PHE A 9 -14.794 5.931 6.928 1.00 0.00 C ATOM 127 CE1 PHE A 9 -13.390 4.260 8.617 1.00 0.00 C ATOM 128 CE2 PHE A 9 -15.422 4.839 7.497 1.00 0.00 C ATOM 129 CZ PHE A 9 -14.719 4.003 8.344 1.00 0.00 C ATOM 0 H PHE A 9 -9.942 7.834 6.283 1.00 0.00 H new ATOM 0 HA PHE A 9 -11.957 6.026 5.130 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -12.311 7.980 7.361 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -13.529 8.022 6.102 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -11.728 5.549 8.263 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -15.348 6.582 6.268 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -12.838 3.607 9.277 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -16.461 4.639 7.280 1.00 0.00 H new ATOM 0 HZ PHE A 9 -15.208 3.150 8.791 1.00 0.00 H new ATOM 139 N GLN A 10 -12.550 7.755 3.387 1.00 0.00 N ATOM 140 CA GLN A 10 -12.650 8.638 2.230 1.00 0.00 C ATOM 141 C GLN A 10 -13.761 9.666 2.421 1.00 0.00 C ATOM 142 O GLN A 10 -14.622 9.512 3.286 1.00 0.00 O ATOM 143 CB GLN A 10 -12.908 7.825 0.961 1.00 0.00 C ATOM 144 CG GLN A 10 -11.805 6.830 0.642 1.00 0.00 C ATOM 145 CD GLN A 10 -11.565 6.683 -0.849 1.00 0.00 C ATOM 146 OE1 GLN A 10 -12.505 6.520 -1.627 1.00 0.00 O ATOM 147 NE2 GLN A 10 -10.302 6.740 -1.254 1.00 0.00 N ATOM 0 H GLN A 10 -13.159 6.938 3.348 1.00 0.00 H new ATOM 0 HA GLN A 10 -11.703 9.168 2.129 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -13.850 7.288 1.069 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -13.025 8.508 0.119 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -10.882 7.150 1.125 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -12.065 5.858 1.062 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -9.554 6.877 -0.574 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -10.080 6.647 -2.245 1.00 0.00 H new ATOM 156 N GLY A 11 -13.734 10.713 1.603 1.00 0.00 N ATOM 157 CA GLY A 11 -14.742 11.751 1.691 1.00 0.00 C ATOM 158 C GLY A 11 -15.034 12.388 0.344 1.00 0.00 C ATOM 159 O GLY A 11 -16.070 12.115 -0.261 1.00 0.00 O ATOM 0 H GLY A 11 -13.030 10.860 0.880 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -15.661 11.328 2.097 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -14.409 12.519 2.389 1.00 0.00 H new ATOM 163 N PRO A 12 -14.127 13.245 -0.155 1.00 0.00 N ATOM 164 CA PRO A 12 -14.302 13.914 -1.448 1.00 0.00 C ATOM 165 C PRO A 12 -14.173 12.948 -2.621 1.00 0.00 C ATOM 166 O PRO A 12 -14.171 11.731 -2.436 1.00 0.00 O ATOM 167 CB PRO A 12 -13.168 14.941 -1.473 1.00 0.00 C ATOM 168 CG PRO A 12 -12.123 14.373 -0.576 1.00 0.00 C ATOM 169 CD PRO A 12 -12.861 13.625 0.500 1.00 0.00 C ATOM 0 HA PRO A 12 -15.294 14.353 -1.549 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -12.786 15.085 -2.484 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -13.507 15.914 -1.119 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -11.456 13.709 -1.126 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -11.505 15.162 -0.148 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -12.304 12.750 0.836 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -13.034 14.249 1.377 1.00 0.00 H new ATOM 177 N GLY A 13 -14.066 13.497 -3.826 1.00 0.00 N ATOM 178 CA GLY A 13 -13.937 12.666 -5.008 1.00 0.00 C ATOM 179 C GLY A 13 -12.688 11.809 -4.983 1.00 0.00 C ATOM 180 O GLY A 13 -11.603 12.268 -5.340 1.00 0.00 O ATOM 0 H GLY A 13 -14.066 14.501 -4.005 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -14.813 12.023 -5.093 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -13.920 13.301 -5.894 1.00 0.00 H new ATOM 184 N SER A 14 -12.838 10.558 -4.557 1.00 0.00 N ATOM 185 CA SER A 14 -11.712 9.634 -4.484 1.00 0.00 C ATOM 186 C SER A 14 -11.105 9.407 -5.864 1.00 0.00 C ATOM 187 O SER A 14 -11.816 9.362 -6.868 1.00 0.00 O ATOM 188 CB SER A 14 -12.159 8.299 -3.886 1.00 0.00 C ATOM 189 OG SER A 14 -13.136 7.675 -4.701 1.00 0.00 O ATOM 0 H SER A 14 -13.729 10.161 -4.257 1.00 0.00 H new ATOM 0 HA SER A 14 -10.952 10.077 -3.840 1.00 0.00 H new ATOM 0 HB2 SER A 14 -11.298 7.640 -3.776 1.00 0.00 H new ATOM 0 HB3 SER A 14 -12.565 8.462 -2.888 1.00 0.00 H new ATOM 0 HG SER A 14 -13.403 6.823 -4.297 1.00 0.00 H new ATOM 195 N THR A 15 -9.784 9.266 -5.907 1.00 0.00 N ATOM 196 CA THR A 15 -9.080 9.044 -7.166 1.00 0.00 C ATOM 197 C THR A 15 -8.621 7.599 -7.287 1.00 0.00 C ATOM 198 O THR A 15 -7.581 7.224 -6.748 1.00 0.00 O ATOM 199 CB THR A 15 -7.876 9.982 -7.270 1.00 0.00 C ATOM 200 OG1 THR A 15 -8.282 11.334 -7.158 1.00 0.00 O ATOM 201 CG2 THR A 15 -7.112 9.836 -8.569 1.00 0.00 C ATOM 0 H THR A 15 -9.180 9.301 -5.086 1.00 0.00 H new ATOM 0 HA THR A 15 -9.772 9.255 -7.982 1.00 0.00 H new ATOM 0 HB THR A 15 -7.218 9.699 -6.448 1.00 0.00 H new ATOM 0 HG1 THR A 15 -7.711 11.794 -6.508 1.00 0.00 H new ATOM 0 HG21 THR A 15 -6.271 10.530 -8.577 1.00 0.00 H new ATOM 0 HG22 THR A 15 -6.741 8.815 -8.660 1.00 0.00 H new ATOM 0 HG23 THR A 15 -7.773 10.058 -9.407 1.00 0.00 H new ATOM 209 N VAL A 16 -9.391 6.794 -8.014 1.00 0.00 N ATOM 210 CA VAL A 16 -9.040 5.395 -8.215 1.00 0.00 C ATOM 211 C VAL A 16 -8.076 5.261 -9.385 1.00 0.00 C ATOM 212 O VAL A 16 -8.448 5.470 -10.540 1.00 0.00 O ATOM 213 CB VAL A 16 -10.283 4.516 -8.468 1.00 0.00 C ATOM 214 CG1 VAL A 16 -9.883 3.056 -8.645 1.00 0.00 C ATOM 215 CG2 VAL A 16 -11.285 4.664 -7.335 1.00 0.00 C ATOM 0 H VAL A 16 -10.256 7.085 -8.470 1.00 0.00 H new ATOM 0 HA VAL A 16 -8.564 5.046 -7.299 1.00 0.00 H new ATOM 0 HB VAL A 16 -10.757 4.854 -9.389 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -10.774 2.454 -8.822 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -9.208 2.964 -9.496 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -9.381 2.705 -7.744 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -12.154 4.036 -7.533 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -10.822 4.357 -6.397 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -11.599 5.705 -7.261 1.00 0.00 H new ATOM 225 N VAL A 17 -6.838 4.914 -9.073 1.00 0.00 N ATOM 226 CA VAL A 17 -5.805 4.752 -10.087 1.00 0.00 C ATOM 227 C VAL A 17 -5.501 3.278 -10.320 1.00 0.00 C ATOM 228 O VAL A 17 -5.025 2.889 -11.385 1.00 0.00 O ATOM 229 CB VAL A 17 -4.506 5.486 -9.694 1.00 0.00 C ATOM 230 CG1 VAL A 17 -4.488 6.890 -10.276 1.00 0.00 C ATOM 231 CG2 VAL A 17 -4.353 5.532 -8.181 1.00 0.00 C ATOM 0 H VAL A 17 -6.521 4.738 -8.120 1.00 0.00 H new ATOM 0 HA VAL A 17 -6.188 5.192 -11.008 1.00 0.00 H new ATOM 0 HB VAL A 17 -3.662 4.933 -10.107 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -3.564 7.392 -9.988 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -4.547 6.834 -11.363 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -5.340 7.453 -9.895 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -3.431 6.054 -7.924 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -5.202 6.059 -7.745 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -4.317 4.516 -7.788 1.00 0.00 H new ATOM 241 N ALA A 18 -5.797 2.466 -9.315 1.00 0.00 N ATOM 242 CA ALA A 18 -5.577 1.031 -9.399 1.00 0.00 C ATOM 243 C ALA A 18 -6.764 0.276 -8.819 1.00 0.00 C ATOM 244 O ALA A 18 -7.332 0.683 -7.806 1.00 0.00 O ATOM 245 CB ALA A 18 -4.296 0.639 -8.676 1.00 0.00 C ATOM 0 H ALA A 18 -6.192 2.779 -8.428 1.00 0.00 H new ATOM 0 HA ALA A 18 -5.474 0.763 -10.450 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -4.151 -0.439 -8.751 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -3.449 1.152 -9.132 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -4.369 0.923 -7.626 1.00 0.00 H new ATOM 251 N THR A 19 -7.136 -0.824 -9.458 1.00 0.00 N ATOM 252 CA THR A 19 -8.252 -1.625 -8.991 1.00 0.00 C ATOM 253 C THR A 19 -7.945 -3.110 -9.101 1.00 0.00 C ATOM 254 O THR A 19 -7.915 -3.672 -10.197 1.00 0.00 O ATOM 255 CB THR A 19 -9.518 -1.298 -9.781 1.00 0.00 C ATOM 256 OG1 THR A 19 -9.785 0.093 -9.751 1.00 0.00 O ATOM 257 CG2 THR A 19 -10.746 -2.014 -9.260 1.00 0.00 C ATOM 0 H THR A 19 -6.681 -1.179 -10.299 1.00 0.00 H new ATOM 0 HA THR A 19 -8.416 -1.382 -7.941 1.00 0.00 H new ATOM 0 HB THR A 19 -9.321 -1.638 -10.798 1.00 0.00 H new ATOM 0 HG1 THR A 19 -10.599 0.281 -10.264 1.00 0.00 H new ATOM 0 HG21 THR A 19 -11.611 -1.739 -9.864 1.00 0.00 H new ATOM 0 HG22 THR A 19 -10.591 -3.091 -9.318 1.00 0.00 H new ATOM 0 HG23 THR A 19 -10.922 -1.728 -8.223 1.00 0.00 H new ATOM 265 N ALA A 20 -7.727 -3.742 -7.957 1.00 0.00 N ATOM 266 CA ALA A 20 -7.437 -5.173 -7.918 1.00 0.00 C ATOM 267 C ALA A 20 -8.695 -5.953 -7.557 1.00 0.00 C ATOM 268 O ALA A 20 -9.282 -5.738 -6.498 1.00 0.00 O ATOM 269 CB ALA A 20 -6.321 -5.465 -6.924 1.00 0.00 C ATOM 0 H ALA A 20 -7.745 -3.290 -7.043 1.00 0.00 H new ATOM 0 HA ALA A 20 -7.103 -5.489 -8.906 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -6.119 -6.536 -6.908 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -5.419 -4.930 -7.222 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -6.625 -5.139 -5.929 1.00 0.00 H new ATOM 275 N ARG A 21 -9.126 -6.847 -8.446 1.00 0.00 N ATOM 276 CA ARG A 21 -10.334 -7.631 -8.200 1.00 0.00 C ATOM 277 C ARG A 21 -10.143 -9.104 -8.541 1.00 0.00 C ATOM 278 O ARG A 21 -9.564 -9.446 -9.573 1.00 0.00 O ATOM 279 CB ARG A 21 -11.509 -7.075 -9.013 1.00 0.00 C ATOM 280 CG ARG A 21 -11.493 -5.564 -9.168 1.00 0.00 C ATOM 281 CD ARG A 21 -10.551 -5.130 -10.275 1.00 0.00 C ATOM 282 NE ARG A 21 -11.269 -4.738 -11.486 1.00 0.00 N ATOM 283 CZ ARG A 21 -10.706 -4.662 -12.691 1.00 0.00 C ATOM 284 NH1 ARG A 21 -9.420 -4.948 -12.849 1.00 0.00 N ATOM 285 NH2 ARG A 21 -11.432 -4.297 -13.739 1.00 0.00 N ATOM 0 H ARG A 21 -8.663 -7.045 -9.333 1.00 0.00 H new ATOM 0 HA ARG A 21 -10.549 -7.553 -7.134 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -11.501 -7.532 -10.003 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -12.442 -7.371 -8.533 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -12.500 -5.209 -9.385 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -11.188 -5.104 -8.228 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -9.944 -4.294 -9.927 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -9.866 -5.945 -10.508 1.00 0.00 H new ATOM 0 HE ARG A 21 -12.260 -4.509 -11.404 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -8.857 -5.228 -12.046 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -8.994 -4.888 -13.774 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -12.421 -4.075 -13.622 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -11.002 -4.239 -14.662 1.00 0.00 H new ATOM 299 N GLY A 22 -10.653 -9.971 -7.670 1.00 0.00 N ATOM 300 CA GLY A 22 -10.550 -11.397 -7.897 1.00 0.00 C ATOM 301 C GLY A 22 -11.495 -12.193 -7.018 1.00 0.00 C ATOM 302 O GLY A 22 -11.506 -12.029 -5.795 1.00 0.00 O ATOM 0 H GLY A 22 -11.136 -9.708 -6.811 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -10.765 -11.612 -8.944 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -9.526 -11.719 -7.709 1.00 0.00 H new ATOM 306 N ILE A 23 -12.281 -13.066 -7.638 1.00 0.00 N ATOM 307 CA ILE A 23 -13.216 -13.899 -6.895 1.00 0.00 C ATOM 308 C ILE A 23 -12.455 -15.019 -6.203 1.00 0.00 C ATOM 309 O ILE A 23 -11.708 -15.761 -6.842 1.00 0.00 O ATOM 310 CB ILE A 23 -14.312 -14.495 -7.806 1.00 0.00 C ATOM 311 CG1 ILE A 23 -15.260 -13.386 -8.283 1.00 0.00 C ATOM 312 CG2 ILE A 23 -15.077 -15.593 -7.073 1.00 0.00 C ATOM 313 CD1 ILE A 23 -16.567 -13.313 -7.517 1.00 0.00 C ATOM 0 H ILE A 23 -12.289 -13.214 -8.647 1.00 0.00 H new ATOM 0 HA ILE A 23 -13.712 -13.269 -6.157 1.00 0.00 H new ATOM 0 HB ILE A 23 -13.840 -14.943 -8.681 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -14.749 -12.427 -8.200 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -15.479 -13.540 -9.340 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -15.845 -16.002 -7.730 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -14.387 -16.386 -6.784 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -15.546 -15.177 -6.181 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -17.178 -12.504 -7.917 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -17.102 -14.257 -7.620 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -16.361 -13.126 -6.463 1.00 0.00 H new ATOM 325 N PHE A 24 -12.625 -15.122 -4.893 1.00 0.00 N ATOM 326 CA PHE A 24 -11.922 -16.134 -4.123 1.00 0.00 C ATOM 327 C PHE A 24 -12.886 -17.058 -3.389 1.00 0.00 C ATOM 328 O PHE A 24 -13.928 -16.633 -2.891 1.00 0.00 O ATOM 329 CB PHE A 24 -10.953 -15.448 -3.161 1.00 0.00 C ATOM 330 CG PHE A 24 -10.160 -14.361 -3.836 1.00 0.00 C ATOM 331 CD1 PHE A 24 -9.670 -14.547 -5.122 1.00 0.00 C ATOM 332 CD2 PHE A 24 -9.917 -13.152 -3.204 1.00 0.00 C ATOM 333 CE1 PHE A 24 -8.957 -13.554 -5.760 1.00 0.00 C ATOM 334 CE2 PHE A 24 -9.201 -12.154 -3.839 1.00 0.00 C ATOM 335 CZ PHE A 24 -8.722 -12.358 -5.118 1.00 0.00 C ATOM 0 H PHE A 24 -13.240 -14.521 -4.345 1.00 0.00 H new ATOM 0 HA PHE A 24 -11.355 -16.767 -4.806 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -11.511 -15.024 -2.326 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -10.271 -16.189 -2.745 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -9.850 -15.483 -5.630 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -10.291 -12.987 -2.204 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -8.584 -13.714 -6.761 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -9.017 -11.216 -3.336 1.00 0.00 H new ATOM 0 HZ PHE A 24 -8.163 -11.579 -5.615 1.00 0.00 H new ATOM 345 N ASN A 25 -12.523 -18.332 -3.352 1.00 0.00 N ATOM 346 CA ASN A 25 -13.326 -19.366 -2.715 1.00 0.00 C ATOM 347 C ASN A 25 -12.580 -19.976 -1.538 1.00 0.00 C ATOM 348 O ASN A 25 -11.383 -19.746 -1.368 1.00 0.00 O ATOM 349 CB ASN A 25 -13.694 -20.453 -3.724 1.00 0.00 C ATOM 350 CG ASN A 25 -12.473 -21.138 -4.310 1.00 0.00 C ATOM 351 OD1 ASN A 25 -11.379 -20.575 -4.321 1.00 0.00 O ATOM 352 ND2 ASN A 25 -12.658 -22.358 -4.800 1.00 0.00 N ATOM 0 H ASN A 25 -11.658 -18.680 -3.766 1.00 0.00 H new ATOM 0 HA ASN A 25 -14.242 -18.906 -2.344 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -14.326 -21.197 -3.238 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -14.282 -20.013 -4.530 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -11.874 -22.868 -5.207 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -13.584 -22.785 -4.769 1.00 0.00 H new ATOM 359 N SER A 26 -13.294 -20.741 -0.715 1.00 0.00 N ATOM 360 CA SER A 26 -12.694 -21.373 0.461 1.00 0.00 C ATOM 361 C SER A 26 -11.320 -21.957 0.139 1.00 0.00 C ATOM 362 O SER A 26 -10.447 -22.016 1.005 1.00 0.00 O ATOM 363 CB SER A 26 -13.604 -22.480 0.988 1.00 0.00 C ATOM 364 OG SER A 26 -14.013 -23.348 -0.056 1.00 0.00 O ATOM 0 H SER A 26 -14.287 -20.939 -0.839 1.00 0.00 H new ATOM 0 HA SER A 26 -12.573 -20.603 1.223 1.00 0.00 H new ATOM 0 HB2 SER A 26 -13.080 -23.051 1.755 1.00 0.00 H new ATOM 0 HB3 SER A 26 -14.481 -22.039 1.462 1.00 0.00 H new ATOM 0 HG SER A 26 -13.368 -24.081 -0.144 1.00 0.00 H new ATOM 370 N ASN A 27 -11.119 -22.365 -1.113 1.00 0.00 N ATOM 371 CA ASN A 27 -9.830 -22.911 -1.530 1.00 0.00 C ATOM 372 C ASN A 27 -8.718 -21.945 -1.136 1.00 0.00 C ATOM 373 O ASN A 27 -7.694 -22.344 -0.581 1.00 0.00 O ATOM 374 CB ASN A 27 -9.812 -23.152 -3.042 1.00 0.00 C ATOM 375 CG ASN A 27 -10.045 -24.609 -3.397 1.00 0.00 C ATOM 376 OD1 ASN A 27 -11.297 -24.960 -3.661 1.00 0.00 O flip ATOM 377 ND2 ASN A 27 -9.109 -25.407 -3.434 1.00 0.00 N flip ATOM 0 H ASN A 27 -11.824 -22.328 -1.849 1.00 0.00 H new ATOM 0 HA ASN A 27 -9.671 -23.867 -1.031 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -10.579 -22.538 -3.514 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -8.852 -22.831 -3.447 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -8.162 -25.092 -3.223 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -9.280 -26.383 -3.675 1.00 0.00 H new ATOM 384 N GLY A 28 -8.952 -20.663 -1.406 1.00 0.00 N ATOM 385 CA GLY A 28 -7.995 -19.635 -1.053 1.00 0.00 C ATOM 386 C GLY A 28 -7.151 -19.158 -2.217 1.00 0.00 C ATOM 387 O GLY A 28 -7.325 -19.597 -3.352 1.00 0.00 O ATOM 0 H GLY A 28 -9.795 -20.319 -1.866 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -8.530 -18.784 -0.631 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -7.337 -20.017 -0.272 1.00 0.00 H new ATOM 391 N GLY A 29 -6.239 -18.240 -1.915 1.00 0.00 N ATOM 392 CA GLY A 29 -5.362 -17.677 -2.924 1.00 0.00 C ATOM 393 C GLY A 29 -4.929 -16.274 -2.552 1.00 0.00 C ATOM 394 O GLY A 29 -5.172 -15.828 -1.432 1.00 0.00 O ATOM 0 H GLY A 29 -6.091 -17.872 -0.975 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -4.484 -18.312 -3.042 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -5.874 -17.659 -3.886 1.00 0.00 H new ATOM 398 N VAL A 30 -4.298 -15.567 -3.482 1.00 0.00 N ATOM 399 CA VAL A 30 -3.855 -14.204 -3.211 1.00 0.00 C ATOM 400 C VAL A 30 -4.179 -13.277 -4.374 1.00 0.00 C ATOM 401 O VAL A 30 -4.188 -13.691 -5.534 1.00 0.00 O ATOM 402 CB VAL A 30 -2.338 -14.124 -2.891 1.00 0.00 C ATOM 403 CG1 VAL A 30 -1.829 -15.438 -2.324 1.00 0.00 C ATOM 404 CG2 VAL A 30 -1.525 -13.721 -4.118 1.00 0.00 C ATOM 0 H VAL A 30 -4.083 -15.909 -4.419 1.00 0.00 H new ATOM 0 HA VAL A 30 -4.403 -13.878 -2.327 1.00 0.00 H new ATOM 0 HB VAL A 30 -2.208 -13.349 -2.135 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -0.764 -15.353 -2.109 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -2.367 -15.671 -1.405 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -1.990 -16.235 -3.050 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -0.468 -13.675 -3.855 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -1.671 -14.457 -4.909 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -1.854 -12.743 -4.467 1.00 0.00 H new ATOM 414 N LEU A 31 -4.428 -12.017 -4.050 1.00 0.00 N ATOM 415 CA LEU A 31 -4.736 -11.017 -5.056 1.00 0.00 C ATOM 416 C LEU A 31 -3.630 -9.975 -5.106 1.00 0.00 C ATOM 417 O LEU A 31 -3.504 -9.147 -4.204 1.00 0.00 O ATOM 418 CB LEU A 31 -6.071 -10.351 -4.741 1.00 0.00 C ATOM 419 CG LEU A 31 -6.683 -9.535 -5.886 1.00 0.00 C ATOM 420 CD1 LEU A 31 -6.680 -10.333 -7.180 1.00 0.00 C ATOM 421 CD2 LEU A 31 -8.096 -9.096 -5.530 1.00 0.00 C ATOM 0 H LEU A 31 -4.422 -11.664 -3.093 1.00 0.00 H new ATOM 0 HA LEU A 31 -4.808 -11.503 -6.029 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -6.782 -11.122 -4.446 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -5.937 -9.695 -3.881 1.00 0.00 H new ATOM 0 HG LEU A 31 -6.072 -8.645 -6.036 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -7.119 -9.734 -7.978 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -5.655 -10.594 -7.444 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -7.264 -11.244 -7.047 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -8.516 -8.518 -6.353 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -8.716 -9.975 -5.351 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -8.070 -8.480 -4.631 1.00 0.00 H new ATOM 433 N SER A 32 -2.821 -10.029 -6.154 1.00 0.00 N ATOM 434 CA SER A 32 -1.717 -9.095 -6.305 1.00 0.00 C ATOM 435 C SER A 32 -2.112 -7.911 -7.184 1.00 0.00 C ATOM 436 O SER A 32 -2.855 -8.066 -8.153 1.00 0.00 O ATOM 437 CB SER A 32 -0.500 -9.809 -6.897 1.00 0.00 C ATOM 438 OG SER A 32 -0.567 -9.848 -8.313 1.00 0.00 O ATOM 0 H SER A 32 -2.909 -10.708 -6.910 1.00 0.00 H new ATOM 0 HA SER A 32 -1.461 -8.712 -5.317 1.00 0.00 H new ATOM 0 HB2 SER A 32 0.411 -9.297 -6.587 1.00 0.00 H new ATOM 0 HB3 SER A 32 -0.444 -10.824 -6.505 1.00 0.00 H new ATOM 0 HG SER A 32 0.223 -10.308 -8.665 1.00 0.00 H new ATOM 444 N SER A 33 -1.600 -6.732 -6.846 1.00 0.00 N ATOM 445 CA SER A 33 -1.887 -5.526 -7.608 1.00 0.00 C ATOM 446 C SER A 33 -0.588 -4.849 -8.020 1.00 0.00 C ATOM 447 O SER A 33 -0.029 -4.050 -7.274 1.00 0.00 O ATOM 448 CB SER A 33 -2.738 -4.562 -6.780 1.00 0.00 C ATOM 449 OG SER A 33 -3.226 -3.495 -7.577 1.00 0.00 O ATOM 0 H SER A 33 -0.983 -6.588 -6.047 1.00 0.00 H new ATOM 0 HA SER A 33 -2.444 -5.804 -8.503 1.00 0.00 H new ATOM 0 HB2 SER A 33 -3.575 -5.101 -6.337 1.00 0.00 H new ATOM 0 HB3 SER A 33 -2.144 -4.163 -5.957 1.00 0.00 H new ATOM 0 HG SER A 33 -3.768 -2.895 -7.024 1.00 0.00 H new ATOM 455 N ILE A 34 -0.108 -5.184 -9.211 1.00 0.00 N ATOM 456 CA ILE A 34 1.131 -4.618 -9.724 1.00 0.00 C ATOM 457 C ILE A 34 1.010 -3.114 -9.947 1.00 0.00 C ATOM 458 O ILE A 34 1.992 -2.379 -9.840 1.00 0.00 O ATOM 459 CB ILE A 34 1.539 -5.297 -11.039 1.00 0.00 C ATOM 460 CG1 ILE A 34 2.886 -4.747 -11.526 1.00 0.00 C ATOM 461 CG2 ILE A 34 0.448 -5.124 -12.084 1.00 0.00 C ATOM 462 CD1 ILE A 34 2.784 -3.468 -12.336 1.00 0.00 C ATOM 0 H ILE A 34 -0.560 -5.847 -9.841 1.00 0.00 H new ATOM 0 HA ILE A 34 1.900 -4.797 -8.972 1.00 0.00 H new ATOM 0 HB ILE A 34 1.662 -6.366 -10.866 1.00 0.00 H new ATOM 0 HG12 ILE A 34 3.525 -4.565 -10.662 1.00 0.00 H new ATOM 0 HG13 ILE A 34 3.378 -5.508 -12.132 1.00 0.00 H new ATOM 0 HG21 ILE A 34 0.752 -5.611 -13.011 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -0.476 -5.575 -11.723 1.00 0.00 H new ATOM 0 HG23 ILE A 34 0.286 -4.062 -12.268 1.00 0.00 H new ATOM 0 HD11 ILE A 34 3.781 -3.149 -12.640 1.00 0.00 H new ATOM 0 HD12 ILE A 34 2.174 -3.646 -13.222 1.00 0.00 H new ATOM 0 HD13 ILE A 34 2.323 -2.689 -11.729 1.00 0.00 H new ATOM 474 N GLU A 35 -0.199 -2.662 -10.263 1.00 0.00 N ATOM 475 CA GLU A 35 -0.449 -1.244 -10.506 1.00 0.00 C ATOM 476 C GLU A 35 0.023 -0.385 -9.335 1.00 0.00 C ATOM 477 O GLU A 35 0.296 0.805 -9.499 1.00 0.00 O ATOM 478 CB GLU A 35 -1.939 -1.007 -10.758 1.00 0.00 C ATOM 479 CG GLU A 35 -2.496 -1.816 -11.918 1.00 0.00 C ATOM 480 CD GLU A 35 -3.345 -0.982 -12.858 1.00 0.00 C ATOM 481 OE1 GLU A 35 -2.768 -0.286 -13.721 1.00 0.00 O ATOM 482 OE2 GLU A 35 -4.588 -1.024 -12.732 1.00 0.00 O ATOM 0 H GLU A 35 -1.022 -3.257 -10.357 1.00 0.00 H new ATOM 0 HA GLU A 35 0.119 -0.952 -11.390 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -2.496 -1.253 -9.854 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -2.102 0.053 -10.954 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -1.671 -2.259 -12.476 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -3.095 -2.639 -11.528 1.00 0.00 H new ATOM 489 N THR A 36 0.113 -0.990 -8.156 1.00 0.00 N ATOM 490 CA THR A 36 0.546 -0.273 -6.962 1.00 0.00 C ATOM 491 C THR A 36 1.601 -1.062 -6.194 1.00 0.00 C ATOM 492 O THR A 36 2.575 -0.495 -5.697 1.00 0.00 O ATOM 493 CB THR A 36 -0.653 0.011 -6.059 1.00 0.00 C ATOM 494 OG1 THR A 36 -1.239 -1.198 -5.609 1.00 0.00 O ATOM 495 CG2 THR A 36 -1.732 0.818 -6.745 1.00 0.00 C ATOM 0 H THR A 36 -0.108 -1.974 -8.001 1.00 0.00 H new ATOM 0 HA THR A 36 0.993 0.670 -7.278 1.00 0.00 H new ATOM 0 HB THR A 36 -0.260 0.591 -5.224 1.00 0.00 H new ATOM 0 HG1 THR A 36 -1.814 -1.565 -6.313 1.00 0.00 H new ATOM 0 HG21 THR A 36 -2.556 0.987 -6.052 1.00 0.00 H new ATOM 0 HG22 THR A 36 -1.323 1.777 -7.062 1.00 0.00 H new ATOM 0 HG23 THR A 36 -2.096 0.273 -7.616 1.00 0.00 H new ATOM 503 N GLY A 37 1.399 -2.370 -6.097 1.00 0.00 N ATOM 504 CA GLY A 37 2.336 -3.217 -5.386 1.00 0.00 C ATOM 505 C GLY A 37 1.723 -3.849 -4.155 1.00 0.00 C ATOM 506 O GLY A 37 2.435 -4.282 -3.249 1.00 0.00 O ATOM 0 H GLY A 37 0.600 -2.860 -6.500 1.00 0.00 H new ATOM 0 HA2 GLY A 37 2.692 -4.001 -6.054 1.00 0.00 H new ATOM 0 HA3 GLY A 37 3.205 -2.628 -5.094 1.00 0.00 H new ATOM 510 N VAL A 38 0.398 -3.885 -4.115 1.00 0.00 N ATOM 511 CA VAL A 38 -0.317 -4.451 -2.984 1.00 0.00 C ATOM 512 C VAL A 38 -0.828 -5.855 -3.301 1.00 0.00 C ATOM 513 O VAL A 38 -1.447 -6.081 -4.340 1.00 0.00 O ATOM 514 CB VAL A 38 -1.499 -3.544 -2.595 1.00 0.00 C ATOM 515 CG1 VAL A 38 -2.345 -4.176 -1.500 1.00 0.00 C ATOM 516 CG2 VAL A 38 -0.998 -2.174 -2.170 1.00 0.00 C ATOM 0 H VAL A 38 -0.204 -3.527 -4.857 1.00 0.00 H new ATOM 0 HA VAL A 38 0.379 -4.519 -2.148 1.00 0.00 H new ATOM 0 HB VAL A 38 -2.135 -3.423 -3.472 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -3.171 -3.511 -1.248 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -2.741 -5.129 -1.851 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -1.730 -4.342 -0.615 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -1.846 -1.545 -1.898 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -0.334 -2.279 -1.312 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -0.454 -1.714 -2.995 1.00 0.00 H new ATOM 526 N SER A 39 -0.562 -6.793 -2.397 1.00 0.00 N ATOM 527 CA SER A 39 -0.992 -8.177 -2.579 1.00 0.00 C ATOM 528 C SER A 39 -1.705 -8.692 -1.333 1.00 0.00 C ATOM 529 O SER A 39 -1.216 -8.532 -0.216 1.00 0.00 O ATOM 530 CB SER A 39 0.208 -9.068 -2.901 1.00 0.00 C ATOM 531 OG SER A 39 1.313 -8.299 -3.345 1.00 0.00 O ATOM 0 H SER A 39 -0.051 -6.621 -1.531 1.00 0.00 H new ATOM 0 HA SER A 39 -1.691 -8.208 -3.415 1.00 0.00 H new ATOM 0 HB2 SER A 39 0.490 -9.637 -2.015 1.00 0.00 H new ATOM 0 HB3 SER A 39 -0.068 -9.790 -3.669 1.00 0.00 H new ATOM 0 HG SER A 39 2.067 -8.893 -3.542 1.00 0.00 H new ATOM 537 N ILE A 40 -2.864 -9.315 -1.533 1.00 0.00 N ATOM 538 CA ILE A 40 -3.641 -9.855 -0.423 1.00 0.00 C ATOM 539 C ILE A 40 -3.646 -11.379 -0.445 1.00 0.00 C ATOM 540 O ILE A 40 -4.232 -11.995 -1.331 1.00 0.00 O ATOM 541 CB ILE A 40 -5.098 -9.352 -0.459 1.00 0.00 C ATOM 542 CG1 ILE A 40 -5.131 -7.827 -0.561 1.00 0.00 C ATOM 543 CG2 ILE A 40 -5.854 -9.823 0.777 1.00 0.00 C ATOM 544 CD1 ILE A 40 -6.532 -7.255 -0.619 1.00 0.00 C ATOM 0 H ILE A 40 -3.284 -9.458 -2.452 1.00 0.00 H new ATOM 0 HA ILE A 40 -3.164 -9.507 0.493 1.00 0.00 H new ATOM 0 HB ILE A 40 -5.588 -9.767 -1.340 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -4.609 -7.402 0.296 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -4.584 -7.519 -1.452 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -6.881 -9.459 0.736 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -5.856 -10.913 0.809 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -5.367 -9.435 1.671 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -6.479 -6.169 -0.691 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -7.051 -7.651 -1.492 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -7.076 -7.533 0.284 1.00 0.00 H new ATOM 556 N ILE A 41 -2.997 -11.978 0.548 1.00 0.00 N ATOM 557 CA ILE A 41 -2.929 -13.429 0.657 1.00 0.00 C ATOM 558 C ILE A 41 -4.017 -13.946 1.593 1.00 0.00 C ATOM 559 O ILE A 41 -4.111 -13.522 2.745 1.00 0.00 O ATOM 560 CB ILE A 41 -1.546 -13.887 1.173 1.00 0.00 C ATOM 561 CG1 ILE A 41 -0.454 -13.508 0.173 1.00 0.00 C ATOM 562 CG2 ILE A 41 -1.535 -15.387 1.438 1.00 0.00 C ATOM 563 CD1 ILE A 41 -0.115 -12.034 0.177 1.00 0.00 C ATOM 0 H ILE A 41 -2.509 -11.478 1.291 1.00 0.00 H new ATOM 0 HA ILE A 41 -3.083 -13.841 -0.340 1.00 0.00 H new ATOM 0 HB ILE A 41 -1.346 -13.377 2.115 1.00 0.00 H new ATOM 0 HG12 ILE A 41 0.446 -14.080 0.397 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -0.774 -13.796 -0.828 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -0.551 -15.685 1.800 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -2.287 -15.629 2.189 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -1.759 -15.921 0.515 1.00 0.00 H new ATOM 0 HD11 ILE A 41 0.667 -11.839 -0.557 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -1.003 -11.456 -0.077 1.00 0.00 H new ATOM 0 HD13 ILE A 41 0.236 -11.744 1.167 1.00 0.00 H new ATOM 575 N ILE A 42 -4.840 -14.861 1.091 1.00 0.00 N ATOM 576 CA ILE A 42 -5.924 -15.427 1.885 1.00 0.00 C ATOM 577 C ILE A 42 -5.656 -16.890 2.230 1.00 0.00 C ATOM 578 O ILE A 42 -5.557 -17.737 1.342 1.00 0.00 O ATOM 579 CB ILE A 42 -7.274 -15.329 1.147 1.00 0.00 C ATOM 580 CG1 ILE A 42 -7.602 -13.868 0.830 1.00 0.00 C ATOM 581 CG2 ILE A 42 -8.383 -15.959 1.979 1.00 0.00 C ATOM 582 CD1 ILE A 42 -7.721 -13.591 -0.650 1.00 0.00 C ATOM 0 H ILE A 42 -4.777 -15.225 0.140 1.00 0.00 H new ATOM 0 HA ILE A 42 -5.974 -14.843 2.804 1.00 0.00 H new ATOM 0 HB ILE A 42 -7.197 -15.877 0.208 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -8.538 -13.598 1.320 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -6.826 -13.229 1.251 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -9.329 -15.881 1.443 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -8.152 -17.009 2.157 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -8.463 -15.438 2.933 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -7.955 -12.538 -0.805 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -6.778 -13.830 -1.142 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -8.516 -14.205 -1.072 1.00 0.00 H new ATOM 594 N PRO A 43 -5.548 -17.211 3.530 1.00 0.00 N ATOM 595 CA PRO A 43 -5.303 -18.581 3.984 1.00 0.00 C ATOM 596 C PRO A 43 -6.478 -19.500 3.678 1.00 0.00 C ATOM 597 O PRO A 43 -7.638 -19.112 3.819 1.00 0.00 O ATOM 598 CB PRO A 43 -5.124 -18.438 5.497 1.00 0.00 C ATOM 599 CG PRO A 43 -5.819 -17.168 5.847 1.00 0.00 C ATOM 600 CD PRO A 43 -5.659 -16.270 4.656 1.00 0.00 C ATOM 0 HA PRO A 43 -4.443 -19.027 3.484 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -5.558 -19.285 6.028 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -4.069 -18.399 5.768 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -6.872 -17.346 6.063 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -5.383 -16.717 6.738 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -6.513 -15.603 4.539 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -4.773 -15.642 4.743 1.00 0.00 H new ATOM 608 N GLN A 44 -6.170 -20.719 3.257 1.00 0.00 N ATOM 609 CA GLN A 44 -7.197 -21.699 2.927 1.00 0.00 C ATOM 610 C GLN A 44 -8.110 -21.958 4.125 1.00 0.00 C ATOM 611 O GLN A 44 -7.825 -22.816 4.960 1.00 0.00 O ATOM 612 CB GLN A 44 -6.554 -23.009 2.469 1.00 0.00 C ATOM 613 CG GLN A 44 -7.543 -23.997 1.874 1.00 0.00 C ATOM 614 CD GLN A 44 -8.278 -24.796 2.931 1.00 0.00 C ATOM 615 OE1 GLN A 44 -9.467 -24.336 3.301 1.00 0.00 O flip ATOM 616 NE2 GLN A 44 -7.783 -25.816 3.412 1.00 0.00 N flip ATOM 0 H GLN A 44 -5.214 -21.054 3.135 1.00 0.00 H new ATOM 0 HA GLN A 44 -7.800 -21.295 2.114 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -5.785 -22.787 1.729 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -6.054 -23.475 3.318 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -8.267 -23.457 1.263 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -7.013 -24.681 1.211 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -6.866 -26.134 3.099 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -8.290 -26.342 4.124 1.00 0.00 H new ATOM 625 N GLY A 45 -9.208 -21.213 4.199 1.00 0.00 N ATOM 626 CA GLY A 45 -10.143 -21.378 5.296 1.00 0.00 C ATOM 627 C GLY A 45 -10.910 -20.109 5.612 1.00 0.00 C ATOM 628 O GLY A 45 -11.986 -20.159 6.212 1.00 0.00 O ATOM 0 H GLY A 45 -9.467 -20.498 3.519 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -10.849 -22.171 5.049 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -9.600 -21.699 6.185 1.00 0.00 H new ATOM 632 N ALA A 46 -10.360 -18.966 5.213 1.00 0.00 N ATOM 633 CA ALA A 46 -11.000 -17.677 5.460 1.00 0.00 C ATOM 634 C ALA A 46 -12.410 -17.636 4.878 1.00 0.00 C ATOM 635 O ALA A 46 -13.275 -16.913 5.370 1.00 0.00 O ATOM 636 CB ALA A 46 -10.158 -16.551 4.885 1.00 0.00 C ATOM 0 H ALA A 46 -9.471 -18.906 4.716 1.00 0.00 H new ATOM 0 HA ALA A 46 -11.080 -17.544 6.539 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -10.648 -15.596 5.077 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -9.175 -16.555 5.355 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -10.047 -16.692 3.810 1.00 0.00 H new ATOM 642 N ILE A 47 -12.634 -18.418 3.827 1.00 0.00 N ATOM 643 CA ILE A 47 -13.933 -18.475 3.174 1.00 0.00 C ATOM 644 C ILE A 47 -14.538 -19.874 3.309 1.00 0.00 C ATOM 645 O ILE A 47 -13.834 -20.876 3.190 1.00 0.00 O ATOM 646 CB ILE A 47 -13.815 -18.090 1.677 1.00 0.00 C ATOM 647 CG1 ILE A 47 -13.486 -16.599 1.545 1.00 0.00 C ATOM 648 CG2 ILE A 47 -15.091 -18.427 0.909 1.00 0.00 C ATOM 649 CD1 ILE A 47 -13.532 -16.088 0.121 1.00 0.00 C ATOM 0 H ILE A 47 -11.927 -19.023 3.409 1.00 0.00 H new ATOM 0 HA ILE A 47 -14.590 -17.757 3.665 1.00 0.00 H new ATOM 0 HB ILE A 47 -13.006 -18.675 1.240 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -14.189 -16.026 2.150 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -12.492 -16.418 1.954 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -14.972 -18.143 -0.137 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -15.283 -19.498 0.975 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -15.930 -17.881 1.340 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -13.288 -15.026 0.108 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -12.809 -16.634 -0.485 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -14.532 -16.236 -0.287 1.00 0.00 H new ATOM 661 N PRO A 48 -15.858 -19.960 3.555 1.00 0.00 N ATOM 662 CA PRO A 48 -16.552 -21.238 3.698 1.00 0.00 C ATOM 663 C PRO A 48 -16.669 -21.970 2.366 1.00 0.00 C ATOM 664 O PRO A 48 -16.559 -21.364 1.301 1.00 0.00 O ATOM 665 CB PRO A 48 -17.934 -20.844 4.221 1.00 0.00 C ATOM 666 CG PRO A 48 -18.135 -19.445 3.754 1.00 0.00 C ATOM 667 CD PRO A 48 -16.768 -18.815 3.704 1.00 0.00 C ATOM 0 HA PRO A 48 -16.021 -21.923 4.359 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -18.707 -21.506 3.831 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -17.978 -20.908 5.308 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -18.607 -19.427 2.772 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -18.790 -18.899 4.433 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -16.678 -18.121 2.868 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -16.555 -18.250 4.611 1.00 0.00 H new ATOM 675 N GLU A 49 -16.877 -23.276 2.435 1.00 0.00 N ATOM 676 CA GLU A 49 -16.993 -24.098 1.236 1.00 0.00 C ATOM 677 C GLU A 49 -18.362 -23.946 0.583 1.00 0.00 C ATOM 678 O GLU A 49 -19.383 -23.853 1.266 1.00 0.00 O ATOM 679 CB GLU A 49 -16.739 -25.567 1.576 1.00 0.00 C ATOM 680 CG GLU A 49 -15.266 -25.908 1.738 1.00 0.00 C ATOM 681 CD GLU A 49 -15.024 -27.398 1.877 1.00 0.00 C ATOM 682 OE1 GLU A 49 -15.049 -28.102 0.847 1.00 0.00 O ATOM 683 OE2 GLU A 49 -14.806 -27.860 3.017 1.00 0.00 O ATOM 0 H GLU A 49 -16.969 -23.792 3.310 1.00 0.00 H new ATOM 0 HA GLU A 49 -16.241 -23.755 0.526 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -17.264 -25.814 2.499 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -17.164 -26.192 0.790 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -14.713 -25.533 0.877 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -14.873 -25.396 2.617 1.00 0.00 H new ATOM 690 N GLY A 50 -18.376 -23.929 -0.747 1.00 0.00 N ATOM 691 CA GLY A 50 -19.622 -23.796 -1.479 1.00 0.00 C ATOM 692 C GLY A 50 -20.036 -22.351 -1.681 1.00 0.00 C ATOM 693 O GLY A 50 -21.225 -22.053 -1.793 1.00 0.00 O ATOM 0 H GLY A 50 -17.544 -24.005 -1.332 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -19.520 -24.279 -2.451 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -20.411 -24.323 -0.942 1.00 0.00 H new ATOM 697 N VAL A 51 -19.058 -21.451 -1.726 1.00 0.00 N ATOM 698 CA VAL A 51 -19.342 -20.034 -1.913 1.00 0.00 C ATOM 699 C VAL A 51 -18.234 -19.341 -2.703 1.00 0.00 C ATOM 700 O VAL A 51 -17.097 -19.810 -2.747 1.00 0.00 O ATOM 701 CB VAL A 51 -19.521 -19.317 -0.560 1.00 0.00 C ATOM 702 CG1 VAL A 51 -18.299 -19.526 0.319 1.00 0.00 C ATOM 703 CG2 VAL A 51 -19.788 -17.834 -0.766 1.00 0.00 C ATOM 0 H VAL A 51 -18.067 -21.677 -1.636 1.00 0.00 H new ATOM 0 HA VAL A 51 -20.272 -19.972 -2.478 1.00 0.00 H new ATOM 0 HB VAL A 51 -20.385 -19.749 -0.056 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -18.443 -19.013 1.270 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -18.158 -20.592 0.499 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -17.418 -19.123 -0.181 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -19.911 -17.349 0.202 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -18.948 -17.383 -1.294 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -20.697 -17.706 -1.354 1.00 0.00 H new ATOM 713 N GLU A 52 -18.581 -18.214 -3.318 1.00 0.00 N ATOM 714 CA GLU A 52 -17.628 -17.436 -4.101 1.00 0.00 C ATOM 715 C GLU A 52 -17.757 -15.952 -3.775 1.00 0.00 C ATOM 716 O GLU A 52 -18.739 -15.308 -4.148 1.00 0.00 O ATOM 717 CB GLU A 52 -17.855 -17.667 -5.597 1.00 0.00 C ATOM 718 CG GLU A 52 -16.920 -18.701 -6.198 1.00 0.00 C ATOM 719 CD GLU A 52 -17.663 -19.841 -6.868 1.00 0.00 C ATOM 720 OE1 GLU A 52 -18.440 -20.532 -6.177 1.00 0.00 O ATOM 721 OE2 GLU A 52 -17.465 -20.044 -8.086 1.00 0.00 O ATOM 0 H GLU A 52 -19.521 -17.818 -3.288 1.00 0.00 H new ATOM 0 HA GLU A 52 -16.621 -17.764 -3.844 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -18.886 -17.985 -5.755 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -17.728 -16.722 -6.126 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -16.270 -18.217 -6.928 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -16.277 -19.102 -5.415 1.00 0.00 H new ATOM 728 N GLN A 53 -16.766 -15.414 -3.073 1.00 0.00 N ATOM 729 CA GLN A 53 -16.780 -14.005 -2.691 1.00 0.00 C ATOM 730 C GLN A 53 -15.821 -13.189 -3.551 1.00 0.00 C ATOM 731 O GLN A 53 -14.626 -13.477 -3.609 1.00 0.00 O ATOM 732 CB GLN A 53 -16.406 -13.849 -1.216 1.00 0.00 C ATOM 733 CG GLN A 53 -17.331 -14.595 -0.269 1.00 0.00 C ATOM 734 CD GLN A 53 -18.789 -14.241 -0.480 1.00 0.00 C ATOM 735 OE1 GLN A 53 -19.655 -15.115 -0.512 1.00 0.00 O ATOM 736 NE2 GLN A 53 -19.070 -12.950 -0.626 1.00 0.00 N ATOM 0 H GLN A 53 -15.945 -15.930 -2.757 1.00 0.00 H new ATOM 0 HA GLN A 53 -17.791 -13.630 -2.850 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -15.386 -14.205 -1.069 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -16.414 -12.790 -0.958 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -17.198 -15.668 -0.407 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -17.051 -14.369 0.760 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -18.321 -12.258 -0.593 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -20.034 -12.651 -0.771 1.00 0.00 H new ATOM 745 N GLU A 54 -16.349 -12.157 -4.206 1.00 0.00 N ATOM 746 CA GLU A 54 -15.528 -11.294 -5.046 1.00 0.00 C ATOM 747 C GLU A 54 -14.773 -10.290 -4.190 1.00 0.00 C ATOM 748 O GLU A 54 -15.341 -9.291 -3.747 1.00 0.00 O ATOM 749 CB GLU A 54 -16.390 -10.549 -6.069 1.00 0.00 C ATOM 750 CG GLU A 54 -15.615 -10.080 -7.289 1.00 0.00 C ATOM 751 CD GLU A 54 -16.399 -10.244 -8.578 1.00 0.00 C ATOM 752 OE1 GLU A 54 -17.623 -9.997 -8.564 1.00 0.00 O ATOM 753 OE2 GLU A 54 -15.787 -10.620 -9.601 1.00 0.00 O ATOM 0 H GLU A 54 -17.336 -11.901 -4.171 1.00 0.00 H new ATOM 0 HA GLU A 54 -14.815 -11.922 -5.580 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -17.201 -11.201 -6.393 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -16.848 -9.686 -5.586 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -15.346 -9.031 -7.163 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -14.684 -10.641 -7.361 1.00 0.00 H new ATOM 760 N ILE A 55 -13.493 -10.551 -3.961 1.00 0.00 N ATOM 761 CA ILE A 55 -12.678 -9.652 -3.162 1.00 0.00 C ATOM 762 C ILE A 55 -11.830 -8.768 -4.059 1.00 0.00 C ATOM 763 O ILE A 55 -10.982 -9.254 -4.806 1.00 0.00 O ATOM 764 CB ILE A 55 -11.768 -10.422 -2.187 1.00 0.00 C ATOM 765 CG1 ILE A 55 -12.601 -11.385 -1.338 1.00 0.00 C ATOM 766 CG2 ILE A 55 -10.992 -9.453 -1.303 1.00 0.00 C ATOM 767 CD1 ILE A 55 -11.797 -12.136 -0.300 1.00 0.00 C ATOM 0 H ILE A 55 -13.001 -11.372 -4.315 1.00 0.00 H new ATOM 0 HA ILE A 55 -13.357 -9.033 -2.576 1.00 0.00 H new ATOM 0 HB ILE A 55 -11.049 -11.004 -2.763 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -13.390 -10.824 -0.837 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -13.090 -12.104 -1.995 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -10.354 -10.014 -0.620 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -10.375 -8.806 -1.927 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -11.691 -8.845 -0.729 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -12.456 -12.798 0.262 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -11.025 -12.726 -0.794 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -11.330 -11.426 0.382 1.00 0.00 H new ATOM 779 N TYR A 56 -12.073 -7.468 -3.986 1.00 0.00 N ATOM 780 CA TYR A 56 -11.338 -6.518 -4.801 1.00 0.00 C ATOM 781 C TYR A 56 -10.989 -5.269 -4.011 1.00 0.00 C ATOM 782 O TYR A 56 -11.826 -4.709 -3.307 1.00 0.00 O ATOM 783 CB TYR A 56 -12.150 -6.139 -6.037 1.00 0.00 C ATOM 784 CG TYR A 56 -13.521 -5.585 -5.729 1.00 0.00 C ATOM 785 CD1 TYR A 56 -14.587 -6.433 -5.463 1.00 0.00 C ATOM 786 CD2 TYR A 56 -13.748 -4.217 -5.716 1.00 0.00 C ATOM 787 CE1 TYR A 56 -15.843 -5.931 -5.191 1.00 0.00 C ATOM 788 CE2 TYR A 56 -15.001 -3.706 -5.445 1.00 0.00 C ATOM 789 CZ TYR A 56 -16.046 -4.567 -5.183 1.00 0.00 C ATOM 790 OH TYR A 56 -17.298 -4.062 -4.913 1.00 0.00 O ATOM 0 H TYR A 56 -12.772 -7.050 -3.372 1.00 0.00 H new ATOM 0 HA TYR A 56 -10.410 -6.996 -5.113 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -11.592 -5.400 -6.612 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -12.260 -7.019 -6.670 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -14.431 -7.502 -5.469 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -12.931 -3.541 -5.921 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -16.663 -6.603 -4.985 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -15.162 -2.638 -5.438 1.00 0.00 H new ATOM 0 HH TYR A 56 -17.347 -3.796 -3.971 1.00 0.00 H new ATOM 800 N PHE A 57 -9.747 -4.829 -4.146 1.00 0.00 N ATOM 801 CA PHE A 57 -9.288 -3.632 -3.457 1.00 0.00 C ATOM 802 C PHE A 57 -8.861 -2.580 -4.466 1.00 0.00 C ATOM 803 O PHE A 57 -7.999 -2.827 -5.309 1.00 0.00 O ATOM 804 CB PHE A 57 -8.129 -3.957 -2.516 1.00 0.00 C ATOM 805 CG PHE A 57 -7.070 -4.816 -3.139 1.00 0.00 C ATOM 806 CD1 PHE A 57 -7.275 -6.174 -3.300 1.00 0.00 C ATOM 807 CD2 PHE A 57 -5.870 -4.267 -3.563 1.00 0.00 C ATOM 808 CE1 PHE A 57 -6.305 -6.970 -3.870 1.00 0.00 C ATOM 809 CE2 PHE A 57 -4.895 -5.060 -4.135 1.00 0.00 C ATOM 810 CZ PHE A 57 -5.112 -6.414 -4.289 1.00 0.00 C ATOM 0 H PHE A 57 -9.040 -5.282 -4.725 1.00 0.00 H new ATOM 0 HA PHE A 57 -10.114 -3.241 -2.862 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -7.676 -3.026 -2.177 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -8.520 -4.461 -1.632 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -8.206 -6.616 -2.975 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -5.696 -3.208 -3.445 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -6.478 -8.029 -3.989 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -3.964 -4.621 -4.461 1.00 0.00 H new ATOM 0 HZ PHE A 57 -4.351 -7.037 -4.736 1.00 0.00 H new ATOM 820 N LYS A 58 -9.470 -1.409 -4.378 1.00 0.00 N ATOM 821 CA LYS A 58 -9.153 -0.321 -5.287 1.00 0.00 C ATOM 822 C LYS A 58 -8.156 0.633 -4.647 1.00 0.00 C ATOM 823 O LYS A 58 -8.425 1.216 -3.596 1.00 0.00 O ATOM 824 CB LYS A 58 -10.423 0.426 -5.684 1.00 0.00 C ATOM 825 CG LYS A 58 -11.302 -0.334 -6.671 1.00 0.00 C ATOM 826 CD LYS A 58 -12.753 -0.354 -6.224 1.00 0.00 C ATOM 827 CE LYS A 58 -13.700 -0.467 -7.408 1.00 0.00 C ATOM 828 NZ LYS A 58 -15.110 -0.183 -7.023 1.00 0.00 N ATOM 0 H LYS A 58 -10.186 -1.188 -3.686 1.00 0.00 H new ATOM 0 HA LYS A 58 -8.702 -0.741 -6.186 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -11.003 0.640 -4.786 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -10.147 1.385 -6.122 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -11.230 0.129 -7.655 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -10.937 -1.356 -6.772 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -12.914 -1.192 -5.547 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -12.975 0.555 -5.665 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -13.390 0.228 -8.188 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -13.634 -1.470 -7.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -15.727 -0.304 -7.851 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -15.404 -0.841 -6.273 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -15.185 0.794 -6.675 1.00 0.00 H new ATOM 842 N VAL A 59 -7.005 0.786 -5.285 1.00 0.00 N ATOM 843 CA VAL A 59 -5.965 1.667 -4.781 1.00 0.00 C ATOM 844 C VAL A 59 -6.154 3.080 -5.321 1.00 0.00 C ATOM 845 O VAL A 59 -6.055 3.314 -6.526 1.00 0.00 O ATOM 846 CB VAL A 59 -4.567 1.148 -5.165 1.00 0.00 C ATOM 847 CG1 VAL A 59 -3.481 2.066 -4.622 1.00 0.00 C ATOM 848 CG2 VAL A 59 -4.372 -0.274 -4.659 1.00 0.00 C ATOM 0 H VAL A 59 -6.768 0.309 -6.155 1.00 0.00 H new ATOM 0 HA VAL A 59 -6.043 1.686 -3.694 1.00 0.00 H new ATOM 0 HB VAL A 59 -4.490 1.141 -6.252 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -2.502 1.679 -4.906 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -3.610 3.066 -5.036 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -3.552 2.111 -3.535 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -3.379 -0.627 -4.938 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -4.471 -0.291 -3.574 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -5.126 -0.924 -5.102 1.00 0.00 H new ATOM 858 N CYS A 60 -6.446 4.013 -4.422 1.00 0.00 N ATOM 859 CA CYS A 60 -6.670 5.401 -4.809 1.00 0.00 C ATOM 860 C CYS A 60 -5.471 6.279 -4.468 1.00 0.00 C ATOM 861 O CYS A 60 -4.549 5.851 -3.774 1.00 0.00 O ATOM 862 CB CYS A 60 -7.920 5.945 -4.112 1.00 0.00 C ATOM 863 SG CYS A 60 -9.477 5.375 -4.833 1.00 0.00 S ATOM 0 H CYS A 60 -6.533 3.834 -3.422 1.00 0.00 H new ATOM 0 HA CYS A 60 -6.811 5.425 -5.890 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -7.892 5.656 -3.061 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -7.895 7.034 -4.144 1.00 0.00 H new ATOM 0 HG CYS A 60 -10.435 5.518 -3.966 1.00 0.00 H new ATOM 869 N ARG A 61 -5.498 7.513 -4.963 1.00 0.00 N ATOM 870 CA ARG A 61 -4.423 8.465 -4.713 1.00 0.00 C ATOM 871 C ARG A 61 -4.615 9.148 -3.363 1.00 0.00 C ATOM 872 O ARG A 61 -5.719 9.168 -2.819 1.00 0.00 O ATOM 873 CB ARG A 61 -4.370 9.509 -5.829 1.00 0.00 C ATOM 874 CG ARG A 61 -4.114 8.918 -7.205 1.00 0.00 C ATOM 875 CD ARG A 61 -2.636 8.644 -7.427 1.00 0.00 C ATOM 876 NE ARG A 61 -2.254 8.807 -8.828 1.00 0.00 N ATOM 877 CZ ARG A 61 -1.146 8.293 -9.359 1.00 0.00 C ATOM 878 NH1 ARG A 61 -0.311 7.584 -8.612 1.00 0.00 N ATOM 879 NH2 ARG A 61 -0.875 8.488 -10.642 1.00 0.00 N ATOM 0 H ARG A 61 -6.255 7.877 -5.541 1.00 0.00 H new ATOM 0 HA ARG A 61 -3.479 7.921 -4.695 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -5.312 10.056 -5.848 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -3.586 10.232 -5.602 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -4.677 7.991 -7.315 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -4.477 9.604 -7.970 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -2.045 9.320 -6.809 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -2.403 7.630 -7.103 1.00 0.00 H new ATOM 0 HE ARG A 61 -2.872 9.346 -9.435 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -0.516 7.430 -7.625 1.00 0.00 H new ATOM 0 HH12 ARG A 61 0.536 7.193 -9.025 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -1.515 9.031 -11.222 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -0.027 8.095 -11.050 1.00 0.00 H new ATOM 893 N ASP A 62 -3.534 9.703 -2.823 1.00 0.00 N ATOM 894 CA ASP A 62 -3.590 10.382 -1.533 1.00 0.00 C ATOM 895 C ASP A 62 -3.830 11.879 -1.708 1.00 0.00 C ATOM 896 O ASP A 62 -3.184 12.700 -1.054 1.00 0.00 O ATOM 897 CB ASP A 62 -2.295 10.145 -0.754 1.00 0.00 C ATOM 898 CG ASP A 62 -1.072 10.648 -1.498 1.00 0.00 C ATOM 899 OD1 ASP A 62 -0.901 11.882 -1.593 1.00 0.00 O ATOM 900 OD2 ASP A 62 -0.287 9.809 -1.985 1.00 0.00 O ATOM 0 H ASP A 62 -2.611 9.696 -3.257 1.00 0.00 H new ATOM 0 HA ASP A 62 -4.426 9.968 -0.970 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -2.359 10.644 0.213 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -2.183 9.079 -0.556 1.00 0.00 H new ATOM 905 N ASN A 63 -4.763 12.230 -2.586 1.00 0.00 N ATOM 906 CA ASN A 63 -5.088 13.632 -2.835 1.00 0.00 C ATOM 907 C ASN A 63 -6.544 13.943 -2.482 1.00 0.00 C ATOM 908 O ASN A 63 -6.962 15.099 -2.511 1.00 0.00 O ATOM 909 CB ASN A 63 -4.809 14.009 -4.296 1.00 0.00 C ATOM 910 CG ASN A 63 -5.088 12.883 -5.279 1.00 0.00 C ATOM 911 OD1 ASN A 63 -6.186 12.162 -5.074 1.00 0.00 O flip ATOM 912 ND2 ASN A 63 -4.320 12.663 -6.215 1.00 0.00 N flip ATOM 0 H ASN A 63 -5.307 11.566 -3.137 1.00 0.00 H new ATOM 0 HA ASN A 63 -4.446 14.231 -2.189 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -5.419 14.872 -4.563 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -3.767 14.313 -4.391 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -3.488 13.239 -6.338 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -4.516 11.904 -6.868 1.00 0.00 H new ATOM 919 N SER A 64 -7.309 12.906 -2.149 1.00 0.00 N ATOM 920 CA SER A 64 -8.712 13.075 -1.790 1.00 0.00 C ATOM 921 C SER A 64 -9.082 12.142 -0.641 1.00 0.00 C ATOM 922 O SER A 64 -10.019 11.348 -0.742 1.00 0.00 O ATOM 923 CB SER A 64 -9.605 12.804 -3.005 1.00 0.00 C ATOM 924 OG SER A 64 -10.581 13.819 -3.158 1.00 0.00 O ATOM 0 H SER A 64 -6.980 11.941 -2.121 1.00 0.00 H new ATOM 0 HA SER A 64 -8.868 14.104 -1.465 1.00 0.00 H new ATOM 0 HB2 SER A 64 -8.992 12.746 -3.905 1.00 0.00 H new ATOM 0 HB3 SER A 64 -10.096 11.838 -2.891 1.00 0.00 H new ATOM 0 HG SER A 64 -10.685 14.032 -4.109 1.00 0.00 H new ATOM 930 N ILE A 65 -8.330 12.239 0.451 1.00 0.00 N ATOM 931 CA ILE A 65 -8.564 11.400 1.619 1.00 0.00 C ATOM 932 C ILE A 65 -8.601 12.229 2.899 1.00 0.00 C ATOM 933 O ILE A 65 -8.265 13.413 2.894 1.00 0.00 O ATOM 934 CB ILE A 65 -7.477 10.319 1.751 1.00 0.00 C ATOM 935 CG1 ILE A 65 -6.089 10.963 1.791 1.00 0.00 C ATOM 936 CG2 ILE A 65 -7.575 9.329 0.599 1.00 0.00 C ATOM 937 CD1 ILE A 65 -5.094 10.210 2.647 1.00 0.00 C ATOM 0 H ILE A 65 -7.552 12.892 0.550 1.00 0.00 H new ATOM 0 HA ILE A 65 -9.533 10.921 1.477 1.00 0.00 H new ATOM 0 HB ILE A 65 -7.632 9.778 2.685 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -5.701 11.033 0.775 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -6.181 11.982 2.168 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -6.800 8.570 0.705 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -8.555 8.852 0.612 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -7.440 9.856 -0.346 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -4.134 10.725 2.627 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -5.459 10.162 3.673 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -4.971 9.199 2.258 1.00 0.00 H new ATOM 949 N LEU A 66 -9.014 11.598 3.995 1.00 0.00 N ATOM 950 CA LEU A 66 -9.100 12.274 5.285 1.00 0.00 C ATOM 951 C LEU A 66 -8.011 11.781 6.238 1.00 0.00 C ATOM 952 O LEU A 66 -8.282 11.002 7.151 1.00 0.00 O ATOM 953 CB LEU A 66 -10.479 12.046 5.908 1.00 0.00 C ATOM 954 CG LEU A 66 -10.686 12.690 7.282 1.00 0.00 C ATOM 955 CD1 LEU A 66 -11.939 13.553 7.285 1.00 0.00 C ATOM 956 CD2 LEU A 66 -10.769 11.625 8.367 1.00 0.00 C ATOM 0 H LEU A 66 -9.295 10.618 4.015 1.00 0.00 H new ATOM 0 HA LEU A 66 -8.952 13.341 5.118 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -11.237 12.431 5.226 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -10.647 10.973 5.998 1.00 0.00 H new ATOM 0 HG LEU A 66 -9.828 13.328 7.493 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -12.069 14.002 8.270 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -11.840 14.340 6.537 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -12.806 12.936 7.050 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -10.916 12.103 9.336 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -11.607 10.959 8.160 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -9.844 11.049 8.383 1.00 0.00 H new ATOM 968 N PRO A 67 -6.757 12.227 6.037 1.00 0.00 N ATOM 969 CA PRO A 67 -5.628 11.825 6.879 1.00 0.00 C ATOM 970 C PRO A 67 -5.592 12.583 8.208 1.00 0.00 C ATOM 971 O PRO A 67 -5.335 13.786 8.237 1.00 0.00 O ATOM 972 CB PRO A 67 -4.420 12.196 6.024 1.00 0.00 C ATOM 973 CG PRO A 67 -4.873 13.379 5.240 1.00 0.00 C ATOM 974 CD PRO A 67 -6.338 13.158 4.967 1.00 0.00 C ATOM 0 HA PRO A 67 -5.674 10.772 7.156 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -3.554 12.436 6.641 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -4.128 11.374 5.371 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -4.715 14.301 5.799 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -4.312 13.469 4.310 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -6.898 14.092 5.007 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -6.501 12.731 3.978 1.00 0.00 H new ATOM 982 N PRO A 68 -5.850 11.887 9.331 1.00 0.00 N ATOM 983 CA PRO A 68 -5.846 12.506 10.663 1.00 0.00 C ATOM 984 C PRO A 68 -4.459 12.999 11.074 1.00 0.00 C ATOM 985 O PRO A 68 -4.326 13.799 12.001 1.00 0.00 O ATOM 986 CB PRO A 68 -6.305 11.376 11.598 1.00 0.00 C ATOM 987 CG PRO A 68 -6.898 10.338 10.704 1.00 0.00 C ATOM 988 CD PRO A 68 -6.168 10.454 9.399 1.00 0.00 C ATOM 0 HA PRO A 68 -6.486 13.387 10.694 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -5.468 10.972 12.167 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -7.037 11.737 12.321 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -6.780 9.342 11.130 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -7.967 10.503 10.570 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -5.268 9.839 9.383 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -6.787 10.137 8.560 1.00 0.00 H new ATOM 996 N LEU A 69 -3.431 12.515 10.385 1.00 0.00 N ATOM 997 CA LEU A 69 -2.056 12.905 10.682 1.00 0.00 C ATOM 998 C LEU A 69 -1.876 14.415 10.562 1.00 0.00 C ATOM 999 O LEU A 69 -2.809 15.135 10.204 1.00 0.00 O ATOM 1000 CB LEU A 69 -1.088 12.189 9.740 1.00 0.00 C ATOM 1001 CG LEU A 69 -1.377 12.384 8.251 1.00 0.00 C ATOM 1002 CD1 LEU A 69 -0.410 13.388 7.644 1.00 0.00 C ATOM 1003 CD2 LEU A 69 -1.302 11.057 7.510 1.00 0.00 C ATOM 0 H LEU A 69 -3.523 11.851 9.616 1.00 0.00 H new ATOM 0 HA LEU A 69 -1.838 12.614 11.710 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.077 12.538 9.948 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -1.109 11.122 9.963 1.00 0.00 H new ATOM 0 HG LEU A 69 -2.389 12.777 8.150 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -0.632 13.512 6.584 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -0.515 14.347 8.152 1.00 0.00 H new ATOM 0 HD13 LEU A 69 0.611 13.025 7.760 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -1.511 11.219 6.452 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -0.304 10.633 7.622 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -2.037 10.367 7.924 1.00 0.00 H new ATOM 1015 N ASP A 70 -0.670 14.887 10.865 1.00 0.00 N ATOM 1016 CA ASP A 70 -0.365 16.312 10.791 1.00 0.00 C ATOM 1017 C ASP A 70 0.802 16.574 9.844 1.00 0.00 C ATOM 1018 O ASP A 70 1.958 16.323 10.184 1.00 0.00 O ATOM 1019 CB ASP A 70 -0.038 16.856 12.184 1.00 0.00 C ATOM 1020 CG ASP A 70 -1.069 16.451 13.219 1.00 0.00 C ATOM 1021 OD1 ASP A 70 -0.947 15.341 13.777 1.00 0.00 O ATOM 1022 OD2 ASP A 70 -2.001 17.244 13.471 1.00 0.00 O ATOM 0 H ASP A 70 0.111 14.304 11.164 1.00 0.00 H new ATOM 0 HA ASP A 70 -1.244 16.826 10.403 1.00 0.00 H new ATOM 0 HB2 ASP A 70 0.943 16.494 12.491 1.00 0.00 H new ATOM 0 HB3 ASP A 70 0.022 17.943 12.141 1.00 0.00 H new ATOM 1027 N LYS A 71 0.490 17.083 8.657 1.00 0.00 N ATOM 1028 CA LYS A 71 1.512 17.383 7.659 1.00 0.00 C ATOM 1029 C LYS A 71 2.392 18.545 8.112 1.00 0.00 C ATOM 1030 O LYS A 71 3.559 18.635 7.736 1.00 0.00 O ATOM 1031 CB LYS A 71 0.860 17.719 6.316 1.00 0.00 C ATOM 1032 CG LYS A 71 -0.277 16.782 5.939 1.00 0.00 C ATOM 1033 CD LYS A 71 -0.557 16.820 4.444 1.00 0.00 C ATOM 1034 CE LYS A 71 -0.868 15.436 3.898 1.00 0.00 C ATOM 1035 NZ LYS A 71 -2.167 15.406 3.167 1.00 0.00 N ATOM 0 H LYS A 71 -0.463 17.297 8.362 1.00 0.00 H new ATOM 0 HA LYS A 71 2.139 16.499 7.542 1.00 0.00 H new ATOM 0 HB2 LYS A 71 0.481 18.740 6.351 1.00 0.00 H new ATOM 0 HB3 LYS A 71 1.620 17.687 5.535 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -0.026 15.764 6.238 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -1.177 17.062 6.486 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -1.397 17.487 4.247 1.00 0.00 H new ATOM 0 HD3 LYS A 71 0.306 17.232 3.922 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -0.067 15.121 3.229 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -0.897 14.720 4.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -2.343 14.445 2.810 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -2.935 15.682 3.812 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -2.131 16.071 2.368 1.00 0.00 H new ATOM 1049 N GLU A 72 1.823 19.432 8.925 1.00 0.00 N ATOM 1050 CA GLU A 72 2.557 20.588 9.431 1.00 0.00 C ATOM 1051 C GLU A 72 3.826 20.150 10.152 1.00 0.00 C ATOM 1052 O GLU A 72 4.854 20.827 10.092 1.00 0.00 O ATOM 1053 CB GLU A 72 1.674 21.407 10.376 1.00 0.00 C ATOM 1054 CG GLU A 72 0.880 20.559 11.355 1.00 0.00 C ATOM 1055 CD GLU A 72 0.705 21.234 12.702 1.00 0.00 C ATOM 1056 OE1 GLU A 72 -0.054 22.221 12.778 1.00 0.00 O ATOM 1057 OE2 GLU A 72 1.330 20.774 13.682 1.00 0.00 O ATOM 0 H GLU A 72 0.857 19.372 9.247 1.00 0.00 H new ATOM 0 HA GLU A 72 2.839 21.210 8.581 1.00 0.00 H new ATOM 0 HB2 GLU A 72 2.301 22.101 10.935 1.00 0.00 H new ATOM 0 HB3 GLU A 72 0.983 22.007 9.785 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -0.101 20.343 10.931 1.00 0.00 H new ATOM 0 HG3 GLU A 72 1.385 19.603 11.495 1.00 0.00 H new ATOM 1064 N LYS A 73 3.750 19.008 10.828 1.00 0.00 N ATOM 1065 CA LYS A 73 4.893 18.470 11.556 1.00 0.00 C ATOM 1066 C LYS A 73 5.802 17.680 10.622 1.00 0.00 C ATOM 1067 O LYS A 73 6.997 17.529 10.879 1.00 0.00 O ATOM 1068 CB LYS A 73 4.420 17.567 12.694 1.00 0.00 C ATOM 1069 CG LYS A 73 3.668 18.305 13.788 1.00 0.00 C ATOM 1070 CD LYS A 73 3.892 17.661 15.146 1.00 0.00 C ATOM 1071 CE LYS A 73 2.715 17.900 16.080 1.00 0.00 C ATOM 1072 NZ LYS A 73 2.301 16.656 16.784 1.00 0.00 N ATOM 0 H LYS A 73 2.907 18.437 10.887 1.00 0.00 H new ATOM 0 HA LYS A 73 5.455 19.307 11.971 1.00 0.00 H new ATOM 0 HB2 LYS A 73 3.776 16.789 12.284 1.00 0.00 H new ATOM 0 HB3 LYS A 73 5.284 17.068 13.133 1.00 0.00 H new ATOM 0 HG2 LYS A 73 3.994 19.345 13.818 1.00 0.00 H new ATOM 0 HG3 LYS A 73 2.603 18.312 13.558 1.00 0.00 H new ATOM 0 HD2 LYS A 73 4.046 16.589 15.020 1.00 0.00 H new ATOM 0 HD3 LYS A 73 4.801 18.063 15.594 1.00 0.00 H new ATOM 0 HE2 LYS A 73 2.983 18.660 16.814 1.00 0.00 H new ATOM 0 HE3 LYS A 73 1.873 18.291 15.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 1.497 16.863 17.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 2.020 15.939 16.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 3.096 16.296 17.349 1.00 0.00 H new ATOM 1086 N GLY A 74 5.224 17.173 9.539 1.00 0.00 N ATOM 1087 CA GLY A 74 5.984 16.396 8.581 1.00 0.00 C ATOM 1088 C GLY A 74 5.331 15.059 8.273 1.00 0.00 C ATOM 1089 O GLY A 74 5.820 14.304 7.433 1.00 0.00 O ATOM 0 H GLY A 74 4.237 17.288 9.308 1.00 0.00 H new ATOM 0 HA2 GLY A 74 6.092 16.966 7.658 1.00 0.00 H new ATOM 0 HA3 GLY A 74 6.988 16.226 8.970 1.00 0.00 H new ATOM 1093 N GLU A 75 4.226 14.767 8.956 1.00 0.00 N ATOM 1094 CA GLU A 75 3.510 13.515 8.751 1.00 0.00 C ATOM 1095 C GLU A 75 2.943 13.438 7.339 1.00 0.00 C ATOM 1096 O GLU A 75 2.801 14.456 6.661 1.00 0.00 O ATOM 1097 CB GLU A 75 2.378 13.378 9.770 1.00 0.00 C ATOM 1098 CG GLU A 75 2.852 13.413 11.213 1.00 0.00 C ATOM 1099 CD GLU A 75 1.831 12.841 12.176 1.00 0.00 C ATOM 1100 OE1 GLU A 75 1.162 11.849 11.813 1.00 0.00 O ATOM 1101 OE2 GLU A 75 1.700 13.382 13.294 1.00 0.00 O ATOM 0 H GLU A 75 3.809 15.382 9.655 1.00 0.00 H new ATOM 0 HA GLU A 75 4.217 12.696 8.887 1.00 0.00 H new ATOM 0 HB2 GLU A 75 1.659 14.182 9.613 1.00 0.00 H new ATOM 0 HB3 GLU A 75 1.851 12.440 9.592 1.00 0.00 H new ATOM 0 HG2 GLU A 75 3.782 12.851 11.300 1.00 0.00 H new ATOM 0 HG3 GLU A 75 3.074 14.443 11.494 1.00 0.00 H new ATOM 1108 N THR A 76 2.618 12.226 6.900 1.00 0.00 N ATOM 1109 CA THR A 76 2.063 12.023 5.565 1.00 0.00 C ATOM 1110 C THR A 76 1.727 10.555 5.318 1.00 0.00 C ATOM 1111 O THR A 76 1.769 9.732 6.233 1.00 0.00 O ATOM 1112 CB THR A 76 3.044 12.519 4.497 1.00 0.00 C ATOM 1113 OG1 THR A 76 2.394 12.659 3.245 1.00 0.00 O ATOM 1114 CG2 THR A 76 4.233 11.604 4.294 1.00 0.00 C ATOM 0 H THR A 76 2.729 11.372 7.447 1.00 0.00 H new ATOM 0 HA THR A 76 1.140 12.599 5.501 1.00 0.00 H new ATOM 0 HB THR A 76 3.406 13.478 4.868 1.00 0.00 H new ATOM 0 HG1 THR A 76 3.036 12.978 2.577 1.00 0.00 H new ATOM 0 HG21 THR A 76 4.884 12.018 3.524 1.00 0.00 H new ATOM 0 HG22 THR A 76 4.787 11.515 5.228 1.00 0.00 H new ATOM 0 HG23 THR A 76 3.885 10.619 3.983 1.00 0.00 H new ATOM 1122 N LEU A 77 1.397 10.237 4.070 1.00 0.00 N ATOM 1123 CA LEU A 77 1.058 8.873 3.685 1.00 0.00 C ATOM 1124 C LEU A 77 2.038 8.352 2.638 1.00 0.00 C ATOM 1125 O LEU A 77 2.186 8.939 1.566 1.00 0.00 O ATOM 1126 CB LEU A 77 -0.369 8.815 3.138 1.00 0.00 C ATOM 1127 CG LEU A 77 -1.176 7.585 3.560 1.00 0.00 C ATOM 1128 CD1 LEU A 77 -2.108 7.929 4.713 1.00 0.00 C ATOM 1129 CD2 LEU A 77 -1.965 7.031 2.384 1.00 0.00 C ATOM 0 H LEU A 77 1.357 10.910 3.305 1.00 0.00 H new ATOM 0 HA LEU A 77 1.124 8.241 4.571 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -0.902 9.709 3.462 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -0.326 8.846 2.049 1.00 0.00 H new ATOM 0 HG LEU A 77 -0.479 6.817 3.896 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -2.674 7.043 5.000 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -1.522 8.276 5.564 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -2.797 8.715 4.402 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -2.532 6.157 2.705 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -2.652 7.793 2.015 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -1.278 6.745 1.587 1.00 0.00 H new ATOM 1141 N LEU A 78 2.707 7.250 2.955 1.00 0.00 N ATOM 1142 CA LEU A 78 3.675 6.656 2.039 1.00 0.00 C ATOM 1143 C LEU A 78 3.143 5.358 1.426 1.00 0.00 C ATOM 1144 O LEU A 78 3.832 4.715 0.632 1.00 0.00 O ATOM 1145 CB LEU A 78 5.007 6.376 2.751 1.00 0.00 C ATOM 1146 CG LEU A 78 5.303 7.226 3.994 1.00 0.00 C ATOM 1147 CD1 LEU A 78 4.949 8.687 3.756 1.00 0.00 C ATOM 1148 CD2 LEU A 78 4.557 6.679 5.202 1.00 0.00 C ATOM 0 H LEU A 78 2.598 6.750 3.837 1.00 0.00 H new ATOM 0 HA LEU A 78 3.842 7.377 1.239 1.00 0.00 H new ATOM 0 HB2 LEU A 78 5.026 5.326 3.042 1.00 0.00 H new ATOM 0 HB3 LEU A 78 5.816 6.523 2.035 1.00 0.00 H new ATOM 0 HG LEU A 78 6.373 7.172 4.195 1.00 0.00 H new ATOM 0 HD11 LEU A 78 5.169 9.266 4.653 1.00 0.00 H new ATOM 0 HD12 LEU A 78 5.536 9.073 2.923 1.00 0.00 H new ATOM 0 HD13 LEU A 78 3.888 8.771 3.522 1.00 0.00 H new ATOM 0 HD21 LEU A 78 4.778 7.293 6.075 1.00 0.00 H new ATOM 0 HD22 LEU A 78 3.485 6.698 5.007 1.00 0.00 H new ATOM 0 HD23 LEU A 78 4.873 5.653 5.391 1.00 0.00 H new ATOM 1160 N SER A 79 1.921 4.974 1.794 1.00 0.00 N ATOM 1161 CA SER A 79 1.319 3.749 1.270 1.00 0.00 C ATOM 1162 C SER A 79 0.121 4.062 0.377 1.00 0.00 C ATOM 1163 O SER A 79 -0.601 5.032 0.615 1.00 0.00 O ATOM 1164 CB SER A 79 0.867 2.839 2.408 1.00 0.00 C ATOM 1165 OG SER A 79 1.939 2.043 2.888 1.00 0.00 O ATOM 0 H SER A 79 1.332 5.489 2.448 1.00 0.00 H new ATOM 0 HA SER A 79 2.081 3.241 0.679 1.00 0.00 H new ATOM 0 HB2 SER A 79 0.467 3.443 3.222 1.00 0.00 H new ATOM 0 HB3 SER A 79 0.059 2.194 2.062 1.00 0.00 H new ATOM 0 HG SER A 79 1.614 1.139 3.080 1.00 0.00 H new ATOM 1171 N PRO A 80 -0.122 3.238 -0.659 1.00 0.00 N ATOM 1172 CA PRO A 80 -1.252 3.430 -1.571 1.00 0.00 C ATOM 1173 C PRO A 80 -2.586 3.174 -0.877 1.00 0.00 C ATOM 1174 O PRO A 80 -2.842 2.071 -0.394 1.00 0.00 O ATOM 1175 CB PRO A 80 -1.019 2.388 -2.678 1.00 0.00 C ATOM 1176 CG PRO A 80 0.377 1.896 -2.480 1.00 0.00 C ATOM 1177 CD PRO A 80 0.670 2.053 -1.018 1.00 0.00 C ATOM 0 HA PRO A 80 -1.303 4.452 -1.946 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -1.737 1.571 -2.604 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -1.142 2.832 -3.666 1.00 0.00 H new ATOM 0 HG2 PRO A 80 0.470 0.854 -2.786 1.00 0.00 H new ATOM 0 HG3 PRO A 80 1.081 2.470 -3.082 1.00 0.00 H new ATOM 0 HD2 PRO A 80 0.368 1.175 -0.447 1.00 0.00 H new ATOM 0 HD3 PRO A 80 1.733 2.204 -0.831 1.00 0.00 H new ATOM 1185 N LEU A 81 -3.433 4.197 -0.825 1.00 0.00 N ATOM 1186 CA LEU A 81 -4.738 4.076 -0.184 1.00 0.00 C ATOM 1187 C LEU A 81 -5.564 2.971 -0.833 1.00 0.00 C ATOM 1188 O LEU A 81 -5.779 2.977 -2.043 1.00 0.00 O ATOM 1189 CB LEU A 81 -5.491 5.404 -0.258 1.00 0.00 C ATOM 1190 CG LEU A 81 -5.089 6.432 0.801 1.00 0.00 C ATOM 1191 CD1 LEU A 81 -4.887 7.800 0.169 1.00 0.00 C ATOM 1192 CD2 LEU A 81 -6.134 6.497 1.905 1.00 0.00 C ATOM 0 H LEU A 81 -3.240 5.118 -1.218 1.00 0.00 H new ATOM 0 HA LEU A 81 -4.578 3.816 0.862 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -5.334 5.840 -1.245 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -6.559 5.205 -0.164 1.00 0.00 H new ATOM 0 HG LEU A 81 -4.143 6.119 1.244 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -4.602 8.518 0.938 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -4.100 7.741 -0.582 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -5.815 8.124 -0.303 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -5.831 7.233 2.649 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -7.095 6.785 1.480 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -6.225 5.519 2.378 1.00 0.00 H new ATOM 1204 N VAL A 82 -6.018 2.023 -0.020 1.00 0.00 N ATOM 1205 CA VAL A 82 -6.815 0.905 -0.516 1.00 0.00 C ATOM 1206 C VAL A 82 -8.288 1.062 -0.147 1.00 0.00 C ATOM 1207 O VAL A 82 -8.624 1.601 0.908 1.00 0.00 O ATOM 1208 CB VAL A 82 -6.289 -0.439 0.037 1.00 0.00 C ATOM 1209 CG1 VAL A 82 -7.249 -1.578 -0.280 1.00 0.00 C ATOM 1210 CG2 VAL A 82 -4.906 -0.736 -0.520 1.00 0.00 C ATOM 0 H VAL A 82 -5.848 2.006 0.986 1.00 0.00 H new ATOM 0 HA VAL A 82 -6.724 0.906 -1.602 1.00 0.00 H new ATOM 0 HB VAL A 82 -6.218 -0.353 1.121 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -6.852 -2.511 0.121 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -8.219 -1.372 0.172 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -7.363 -1.668 -1.360 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -4.549 -1.686 -0.121 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -4.957 -0.795 -1.607 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -4.219 0.060 -0.232 1.00 0.00 H new ATOM 1220 N MET A 83 -9.161 0.580 -1.028 1.00 0.00 N ATOM 1221 CA MET A 83 -10.600 0.654 -0.808 1.00 0.00 C ATOM 1222 C MET A 83 -11.219 -0.741 -0.853 1.00 0.00 C ATOM 1223 O MET A 83 -11.262 -1.376 -1.906 1.00 0.00 O ATOM 1224 CB MET A 83 -11.252 1.554 -1.860 1.00 0.00 C ATOM 1225 CG MET A 83 -11.928 2.784 -1.274 1.00 0.00 C ATOM 1226 SD MET A 83 -13.454 3.214 -2.135 1.00 0.00 S ATOM 1227 CE MET A 83 -14.475 3.752 -0.766 1.00 0.00 C ATOM 0 H MET A 83 -8.894 0.132 -1.905 1.00 0.00 H new ATOM 0 HA MET A 83 -10.777 1.082 0.179 1.00 0.00 H new ATOM 0 HB2 MET A 83 -10.493 1.873 -2.574 1.00 0.00 H new ATOM 0 HB3 MET A 83 -11.989 0.974 -2.415 1.00 0.00 H new ATOM 0 HG2 MET A 83 -12.147 2.607 -0.221 1.00 0.00 H new ATOM 0 HG3 MET A 83 -11.240 3.628 -1.319 1.00 0.00 H new ATOM 0 HE1 MET A 83 -15.455 4.051 -1.138 1.00 0.00 H new ATOM 0 HE2 MET A 83 -14.591 2.934 -0.055 1.00 0.00 H new ATOM 0 HE3 MET A 83 -14.001 4.599 -0.270 1.00 0.00 H new ATOM 1237 N CYS A 84 -11.694 -1.214 0.296 1.00 0.00 N ATOM 1238 CA CYS A 84 -12.308 -2.536 0.386 1.00 0.00 C ATOM 1239 C CYS A 84 -13.416 -2.700 -0.650 1.00 0.00 C ATOM 1240 O CYS A 84 -14.330 -1.880 -0.731 1.00 0.00 O ATOM 1241 CB CYS A 84 -12.870 -2.765 1.790 1.00 0.00 C ATOM 1242 SG CYS A 84 -11.692 -2.429 3.120 1.00 0.00 S ATOM 0 H CYS A 84 -11.666 -0.702 1.178 1.00 0.00 H new ATOM 0 HA CYS A 84 -11.536 -3.279 0.183 1.00 0.00 H new ATOM 0 HB2 CYS A 84 -13.746 -2.132 1.927 1.00 0.00 H new ATOM 0 HB3 CYS A 84 -13.208 -3.798 1.871 1.00 0.00 H new ATOM 0 HG CYS A 84 -11.479 -3.519 3.796 1.00 0.00 H new ATOM 1248 N GLY A 85 -13.327 -3.766 -1.441 1.00 0.00 N ATOM 1249 CA GLY A 85 -14.328 -4.018 -2.459 1.00 0.00 C ATOM 1250 C GLY A 85 -15.684 -4.348 -1.867 1.00 0.00 C ATOM 1251 O GLY A 85 -16.571 -3.496 -1.831 1.00 0.00 O ATOM 0 H GLY A 85 -12.579 -4.458 -1.394 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -14.418 -3.142 -3.101 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -14.000 -4.843 -3.091 1.00 0.00 H new ATOM 1255 N PRO A 86 -15.876 -5.589 -1.386 1.00 0.00 N ATOM 1256 CA PRO A 86 -17.145 -6.009 -0.790 1.00 0.00 C ATOM 1257 C PRO A 86 -17.431 -5.286 0.518 1.00 0.00 C ATOM 1258 O PRO A 86 -16.564 -5.187 1.387 1.00 0.00 O ATOM 1259 CB PRO A 86 -16.953 -7.507 -0.541 1.00 0.00 C ATOM 1260 CG PRO A 86 -15.476 -7.698 -0.464 1.00 0.00 C ATOM 1261 CD PRO A 86 -14.874 -6.670 -1.382 1.00 0.00 C ATOM 0 HA PRO A 86 -17.992 -5.781 -1.437 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -17.440 -7.819 0.383 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -17.386 -8.100 -1.346 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -15.119 -7.565 0.557 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -15.197 -8.706 -0.771 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -13.908 -6.321 -1.017 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -14.711 -7.071 -2.382 1.00 0.00 H new ATOM 1269 N HIS A 87 -18.650 -4.781 0.651 1.00 0.00 N ATOM 1270 CA HIS A 87 -19.050 -4.064 1.854 1.00 0.00 C ATOM 1271 C HIS A 87 -19.802 -4.985 2.807 1.00 0.00 C ATOM 1272 O HIS A 87 -20.820 -5.573 2.443 1.00 0.00 O ATOM 1273 CB HIS A 87 -19.922 -2.860 1.493 1.00 0.00 C ATOM 1274 CG HIS A 87 -19.342 -2.005 0.410 1.00 0.00 C ATOM 1275 ND1 HIS A 87 -20.095 -1.481 -0.620 1.00 0.00 N ATOM 1276 CD2 HIS A 87 -18.072 -1.584 0.198 1.00 0.00 C ATOM 1277 CE1 HIS A 87 -19.313 -0.775 -1.418 1.00 0.00 C ATOM 1278 NE2 HIS A 87 -18.083 -0.821 -0.945 1.00 0.00 N ATOM 0 H HIS A 87 -19.379 -4.855 -0.059 1.00 0.00 H new ATOM 0 HA HIS A 87 -18.148 -3.710 2.353 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -20.904 -3.214 1.179 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -20.073 -2.251 2.384 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -17.212 -1.806 0.812 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -19.628 -0.249 -2.307 1.00 0.00 H new ATOM 0 HE2 HIS A 87 -17.271 -0.364 -1.360 1.00 0.00 H new ATOM 1287 N GLY A 88 -19.287 -5.113 4.023 1.00 0.00 N ATOM 1288 CA GLY A 88 -19.915 -5.973 5.004 1.00 0.00 C ATOM 1289 C GLY A 88 -19.535 -7.422 4.802 1.00 0.00 C ATOM 1290 O GLY A 88 -20.397 -8.299 4.764 1.00 0.00 O ATOM 0 H GLY A 88 -18.445 -4.636 4.346 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -19.623 -5.656 6.005 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -20.998 -5.868 4.940 1.00 0.00 H new ATOM 1294 N LEU A 89 -18.237 -7.672 4.667 1.00 0.00 N ATOM 1295 CA LEU A 89 -17.739 -9.023 4.463 1.00 0.00 C ATOM 1296 C LEU A 89 -17.116 -9.550 5.745 1.00 0.00 C ATOM 1297 O LEU A 89 -16.429 -8.821 6.451 1.00 0.00 O ATOM 1298 CB LEU A 89 -16.712 -9.038 3.329 1.00 0.00 C ATOM 1299 CG LEU A 89 -16.133 -10.412 2.988 1.00 0.00 C ATOM 1300 CD1 LEU A 89 -17.246 -11.429 2.790 1.00 0.00 C ATOM 1301 CD2 LEU A 89 -15.261 -10.321 1.745 1.00 0.00 C ATOM 0 H LEU A 89 -17.512 -6.955 4.696 1.00 0.00 H new ATOM 0 HA LEU A 89 -18.573 -9.669 4.189 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -17.178 -8.626 2.434 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -15.891 -8.372 3.596 1.00 0.00 H new ATOM 0 HG LEU A 89 -15.515 -10.745 3.822 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -16.813 -12.400 2.548 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -17.831 -11.511 3.706 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -17.892 -11.107 1.974 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -14.855 -11.305 1.513 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -15.860 -9.968 0.905 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -14.443 -9.624 1.925 1.00 0.00 H new ATOM 1313 N LYS A 90 -17.360 -10.813 6.050 1.00 0.00 N ATOM 1314 CA LYS A 90 -16.814 -11.408 7.260 1.00 0.00 C ATOM 1315 C LYS A 90 -16.267 -12.805 6.992 1.00 0.00 C ATOM 1316 O LYS A 90 -17.022 -13.768 6.849 1.00 0.00 O ATOM 1317 CB LYS A 90 -17.871 -11.453 8.359 1.00 0.00 C ATOM 1318 CG LYS A 90 -18.095 -10.110 9.033 1.00 0.00 C ATOM 1319 CD LYS A 90 -17.882 -10.189 10.537 1.00 0.00 C ATOM 1320 CE LYS A 90 -19.023 -10.923 11.224 1.00 0.00 C ATOM 1321 NZ LYS A 90 -18.726 -11.192 12.658 1.00 0.00 N ATOM 0 H LYS A 90 -17.928 -11.443 5.483 1.00 0.00 H new ATOM 0 HA LYS A 90 -15.987 -10.782 7.595 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -18.813 -11.800 7.934 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -17.573 -12.184 9.111 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -17.414 -9.372 8.608 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -19.108 -9.765 8.827 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -16.942 -10.699 10.746 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -17.796 -9.183 10.947 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -19.935 -10.330 11.147 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -19.211 -11.865 10.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -19.528 -11.694 13.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -17.871 -11.779 12.731 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -18.572 -10.292 13.155 1.00 0.00 H new ATOM 1335 N PHE A 91 -14.946 -12.902 6.928 1.00 0.00 N ATOM 1336 CA PHE A 91 -14.272 -14.170 6.684 1.00 0.00 C ATOM 1337 C PHE A 91 -14.209 -15.009 7.952 1.00 0.00 C ATOM 1338 O PHE A 91 -14.277 -14.484 9.064 1.00 0.00 O ATOM 1339 CB PHE A 91 -12.848 -13.925 6.179 1.00 0.00 C ATOM 1340 CG PHE A 91 -12.751 -12.894 5.091 1.00 0.00 C ATOM 1341 CD1 PHE A 91 -13.179 -13.190 3.810 1.00 0.00 C ATOM 1342 CD2 PHE A 91 -12.224 -11.637 5.347 1.00 0.00 C ATOM 1343 CE1 PHE A 91 -13.089 -12.253 2.802 1.00 0.00 C ATOM 1344 CE2 PHE A 91 -12.130 -10.695 4.341 1.00 0.00 C ATOM 1345 CZ PHE A 91 -12.564 -11.004 3.066 1.00 0.00 C ATOM 0 H PHE A 91 -14.315 -12.109 7.043 1.00 0.00 H new ATOM 0 HA PHE A 91 -14.845 -14.709 5.929 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -12.226 -13.612 7.017 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -12.438 -14.865 5.811 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -13.589 -14.166 3.596 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -11.884 -11.392 6.342 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -13.429 -12.496 1.806 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -11.718 -9.719 4.551 1.00 0.00 H new ATOM 0 HZ PHE A 91 -12.493 -10.270 2.277 1.00 0.00 H new ATOM 1355 N LEU A 92 -14.048 -16.317 7.778 1.00 0.00 N ATOM 1356 CA LEU A 92 -13.941 -17.227 8.910 1.00 0.00 C ATOM 1357 C LEU A 92 -12.546 -17.132 9.525 1.00 0.00 C ATOM 1358 O LEU A 92 -12.332 -17.510 10.677 1.00 0.00 O ATOM 1359 CB LEU A 92 -14.223 -18.666 8.468 1.00 0.00 C ATOM 1360 CG LEU A 92 -15.422 -18.834 7.534 1.00 0.00 C ATOM 1361 CD1 LEU A 92 -15.411 -20.214 6.897 1.00 0.00 C ATOM 1362 CD2 LEU A 92 -16.722 -18.603 8.288 1.00 0.00 C ATOM 0 H LEU A 92 -13.989 -16.769 6.865 1.00 0.00 H new ATOM 0 HA LEU A 92 -14.681 -16.942 9.658 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -13.336 -19.057 7.969 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -14.385 -19.277 9.356 1.00 0.00 H new ATOM 0 HG LEU A 92 -15.349 -18.089 6.741 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -16.271 -20.316 6.235 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -14.494 -20.342 6.322 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -15.460 -20.975 7.676 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -17.564 -18.727 7.607 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -16.804 -19.324 9.101 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -16.731 -17.592 8.697 1.00 0.00 H new ATOM 1374 N LYS A 93 -11.603 -16.613 8.740 1.00 0.00 N ATOM 1375 CA LYS A 93 -10.227 -16.446 9.184 1.00 0.00 C ATOM 1376 C LYS A 93 -9.644 -15.152 8.620 1.00 0.00 C ATOM 1377 O LYS A 93 -10.032 -14.708 7.539 1.00 0.00 O ATOM 1378 CB LYS A 93 -9.375 -17.640 8.745 1.00 0.00 C ATOM 1379 CG LYS A 93 -10.040 -18.984 8.995 1.00 0.00 C ATOM 1380 CD LYS A 93 -9.207 -20.128 8.438 1.00 0.00 C ATOM 1381 CE LYS A 93 -8.073 -20.501 9.379 1.00 0.00 C ATOM 1382 NZ LYS A 93 -6.989 -19.479 9.375 1.00 0.00 N ATOM 0 H LYS A 93 -11.773 -16.299 7.785 1.00 0.00 H new ATOM 0 HA LYS A 93 -10.219 -16.392 10.273 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -9.152 -17.546 7.682 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -8.423 -17.611 9.274 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -10.186 -19.126 10.066 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -11.028 -18.994 8.535 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -9.844 -20.997 8.272 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -8.798 -19.843 7.469 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -8.463 -20.613 10.391 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -7.662 -21.467 9.087 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -6.065 -19.953 9.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -7.044 -18.918 8.501 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -7.100 -18.852 10.197 1.00 0.00 H new ATOM 1396 N PRO A 94 -8.710 -14.524 9.349 1.00 0.00 N ATOM 1397 CA PRO A 94 -8.082 -13.271 8.919 1.00 0.00 C ATOM 1398 C PRO A 94 -7.209 -13.440 7.678 1.00 0.00 C ATOM 1399 O PRO A 94 -6.446 -14.400 7.568 1.00 0.00 O ATOM 1400 CB PRO A 94 -7.227 -12.865 10.122 1.00 0.00 C ATOM 1401 CG PRO A 94 -6.975 -14.136 10.858 1.00 0.00 C ATOM 1402 CD PRO A 94 -8.197 -14.983 10.652 1.00 0.00 C ATOM 0 HA PRO A 94 -8.827 -12.528 8.636 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -6.294 -12.400 9.805 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -7.746 -12.141 10.750 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -6.085 -14.637 10.478 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -6.806 -13.946 11.918 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -7.953 -16.045 10.637 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -8.928 -14.835 11.447 1.00 0.00 H new ATOM 1410 N VAL A 95 -7.325 -12.493 6.751 1.00 0.00 N ATOM 1411 CA VAL A 95 -6.540 -12.524 5.519 1.00 0.00 C ATOM 1412 C VAL A 95 -5.330 -11.602 5.626 1.00 0.00 C ATOM 1413 O VAL A 95 -5.423 -10.502 6.167 1.00 0.00 O ATOM 1414 CB VAL A 95 -7.385 -12.110 4.300 1.00 0.00 C ATOM 1415 CG1 VAL A 95 -8.495 -13.123 4.058 1.00 0.00 C ATOM 1416 CG2 VAL A 95 -7.955 -10.713 4.489 1.00 0.00 C ATOM 0 H VAL A 95 -7.955 -11.694 6.829 1.00 0.00 H new ATOM 0 HA VAL A 95 -6.204 -13.551 5.379 1.00 0.00 H new ATOM 0 HB VAL A 95 -6.740 -12.092 3.421 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -9.084 -12.818 3.193 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -8.058 -14.104 3.871 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -9.139 -13.174 4.936 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -8.548 -10.441 3.616 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -8.587 -10.695 5.377 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -7.139 -10.000 4.609 1.00 0.00 H new ATOM 1426 N GLU A 96 -4.190 -12.060 5.118 1.00 0.00 N ATOM 1427 CA GLU A 96 -2.961 -11.275 5.173 1.00 0.00 C ATOM 1428 C GLU A 96 -2.850 -10.326 3.985 1.00 0.00 C ATOM 1429 O GLU A 96 -2.647 -10.756 2.853 1.00 0.00 O ATOM 1430 CB GLU A 96 -1.745 -12.201 5.211 1.00 0.00 C ATOM 1431 CG GLU A 96 -0.639 -11.714 6.133 1.00 0.00 C ATOM 1432 CD GLU A 96 0.354 -12.804 6.480 1.00 0.00 C ATOM 1433 OE1 GLU A 96 -0.084 -13.936 6.776 1.00 0.00 O ATOM 1434 OE2 GLU A 96 1.573 -12.526 6.458 1.00 0.00 O ATOM 0 H GLU A 96 -4.091 -12.968 4.665 1.00 0.00 H new ATOM 0 HA GLU A 96 -2.991 -10.676 6.083 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -2.064 -13.193 5.532 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -1.346 -12.305 4.202 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -0.113 -10.887 5.657 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -1.081 -11.325 7.050 1.00 0.00 H new ATOM 1441 N LEU A 97 -2.967 -9.032 4.257 1.00 0.00 N ATOM 1442 CA LEU A 97 -2.863 -8.019 3.214 1.00 0.00 C ATOM 1443 C LEU A 97 -1.507 -7.329 3.285 1.00 0.00 C ATOM 1444 O LEU A 97 -1.083 -6.888 4.353 1.00 0.00 O ATOM 1445 CB LEU A 97 -3.987 -6.989 3.355 1.00 0.00 C ATOM 1446 CG LEU A 97 -3.921 -5.810 2.382 1.00 0.00 C ATOM 1447 CD1 LEU A 97 -5.288 -5.162 2.241 1.00 0.00 C ATOM 1448 CD2 LEU A 97 -2.894 -4.787 2.844 1.00 0.00 C ATOM 0 H LEU A 97 -3.134 -8.659 5.192 1.00 0.00 H new ATOM 0 HA LEU A 97 -2.959 -8.508 2.245 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -4.942 -7.497 3.220 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -3.975 -6.600 4.373 1.00 0.00 H new ATOM 0 HG LEU A 97 -3.613 -6.188 1.407 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -5.224 -4.325 1.546 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -6.001 -5.895 1.862 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -5.621 -4.801 3.214 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -2.864 -3.957 2.138 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -3.170 -4.414 3.830 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -1.911 -5.256 2.896 1.00 0.00 H new ATOM 1460 N ARG A 98 -0.823 -7.247 2.150 1.00 0.00 N ATOM 1461 CA ARG A 98 0.492 -6.617 2.101 1.00 0.00 C ATOM 1462 C ARG A 98 0.496 -5.400 1.185 1.00 0.00 C ATOM 1463 O ARG A 98 0.059 -5.471 0.036 1.00 0.00 O ATOM 1464 CB ARG A 98 1.543 -7.625 1.633 1.00 0.00 C ATOM 1465 CG ARG A 98 1.480 -8.954 2.367 1.00 0.00 C ATOM 1466 CD ARG A 98 2.749 -9.764 2.162 1.00 0.00 C ATOM 1467 NE ARG A 98 3.678 -9.618 3.279 1.00 0.00 N ATOM 1468 CZ ARG A 98 4.685 -10.455 3.520 1.00 0.00 C ATOM 1469 NH1 ARG A 98 4.895 -11.497 2.725 1.00 0.00 N ATOM 1470 NH2 ARG A 98 5.486 -10.247 4.556 1.00 0.00 N ATOM 0 H ARG A 98 -1.154 -7.607 1.255 1.00 0.00 H new ATOM 0 HA ARG A 98 0.736 -6.280 3.109 1.00 0.00 H new ATOM 0 HB2 ARG A 98 1.414 -7.803 0.565 1.00 0.00 H new ATOM 0 HB3 ARG A 98 2.534 -7.192 1.767 1.00 0.00 H new ATOM 0 HG2 ARG A 98 1.329 -8.776 3.432 1.00 0.00 H new ATOM 0 HG3 ARG A 98 0.621 -9.525 2.014 1.00 0.00 H new ATOM 0 HD2 ARG A 98 2.492 -10.816 2.040 1.00 0.00 H new ATOM 0 HD3 ARG A 98 3.237 -9.446 1.241 1.00 0.00 H new ATOM 0 HE ARG A 98 3.548 -8.829 3.912 1.00 0.00 H new ATOM 0 HH11 ARG A 98 4.283 -11.660 1.925 1.00 0.00 H new ATOM 0 HH12 ARG A 98 5.668 -12.135 2.914 1.00 0.00 H new ATOM 0 HH21 ARG A 98 5.331 -9.446 5.168 1.00 0.00 H new ATOM 0 HH22 ARG A 98 6.258 -10.888 4.741 1.00 0.00 H new ATOM 1484 N LEU A 99 1.004 -4.282 1.700 1.00 0.00 N ATOM 1485 CA LEU A 99 1.078 -3.047 0.930 1.00 0.00 C ATOM 1486 C LEU A 99 2.530 -2.623 0.732 1.00 0.00 C ATOM 1487 O LEU A 99 3.373 -2.835 1.605 1.00 0.00 O ATOM 1488 CB LEU A 99 0.297 -1.930 1.627 1.00 0.00 C ATOM 1489 CG LEU A 99 -1.187 -2.226 1.860 1.00 0.00 C ATOM 1490 CD1 LEU A 99 -1.555 -2.006 3.320 1.00 0.00 C ATOM 1491 CD2 LEU A 99 -2.056 -1.364 0.953 1.00 0.00 C ATOM 0 H LEU A 99 1.370 -4.208 2.649 1.00 0.00 H new ATOM 0 HA LEU A 99 0.631 -3.230 -0.047 1.00 0.00 H new ATOM 0 HB2 LEU A 99 0.766 -1.725 2.589 1.00 0.00 H new ATOM 0 HB3 LEU A 99 0.382 -1.021 1.031 1.00 0.00 H new ATOM 0 HG LEU A 99 -1.369 -3.272 1.615 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -2.614 -2.222 3.465 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -0.960 -2.669 3.949 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -1.355 -0.970 3.594 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -3.107 -1.590 1.134 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -1.869 -0.311 1.164 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -1.814 -1.574 -0.089 1.00 0.00 H new ATOM 1503 N PRO A 100 2.839 -2.019 -0.425 1.00 0.00 N ATOM 1504 CA PRO A 100 4.195 -1.567 -0.743 1.00 0.00 C ATOM 1505 C PRO A 100 4.595 -0.326 0.046 1.00 0.00 C ATOM 1506 O PRO A 100 4.233 0.794 -0.314 1.00 0.00 O ATOM 1507 CB PRO A 100 4.117 -1.249 -2.235 1.00 0.00 C ATOM 1508 CG PRO A 100 2.690 -0.899 -2.477 1.00 0.00 C ATOM 1509 CD PRO A 100 1.889 -1.732 -1.516 1.00 0.00 C ATOM 0 HA PRO A 100 4.945 -2.316 -0.489 1.00 0.00 H new ATOM 0 HB2 PRO A 100 4.777 -0.422 -2.498 1.00 0.00 H new ATOM 0 HB3 PRO A 100 4.422 -2.104 -2.838 1.00 0.00 H new ATOM 0 HG2 PRO A 100 2.516 0.164 -2.311 1.00 0.00 H new ATOM 0 HG3 PRO A 100 2.406 -1.111 -3.508 1.00 0.00 H new ATOM 0 HD2 PRO A 100 1.013 -1.194 -1.153 1.00 0.00 H new ATOM 0 HD3 PRO A 100 1.529 -2.648 -1.984 1.00 0.00 H new ATOM 1517 N HIS A 101 5.348 -0.534 1.120 1.00 0.00 N ATOM 1518 CA HIS A 101 5.804 0.568 1.957 1.00 0.00 C ATOM 1519 C HIS A 101 7.326 0.572 2.058 1.00 0.00 C ATOM 1520 O HIS A 101 7.951 -0.479 2.194 1.00 0.00 O ATOM 1521 CB HIS A 101 5.185 0.466 3.354 1.00 0.00 C ATOM 1522 CG HIS A 101 5.609 1.563 4.280 1.00 0.00 C ATOM 1523 ND1 HIS A 101 5.187 2.845 4.389 1.00 0.00 N flip ATOM 1524 CD2 HIS A 101 6.584 1.400 5.243 1.00 0.00 C flip ATOM 1525 CE1 HIS A 101 5.907 3.426 5.404 1.00 0.00 C flip ATOM 1526 NE2 HIS A 101 6.742 2.533 5.903 1.00 0.00 N flip ATOM 0 H HIS A 101 5.655 -1.456 1.431 1.00 0.00 H new ATOM 0 HA HIS A 101 5.484 1.503 1.497 1.00 0.00 H new ATOM 0 HB2 HIS A 101 4.099 0.479 3.263 1.00 0.00 H new ATOM 0 HB3 HIS A 101 5.457 -0.494 3.793 1.00 0.00 H new ATOM 0 HD1 HIS A 101 4.468 3.295 3.823 1.00 0.00 H new ATOM 0 HD2 HIS A 101 7.132 0.488 5.428 1.00 0.00 H new ATOM 0 HE1 HIS A 101 5.807 4.448 5.740 1.00 0.00 H new ATOM 1863 N CYS A 124 7.306 -4.184 4.239 1.00 0.00 N ATOM 1864 CA CYS A 124 5.952 -4.459 3.769 1.00 0.00 C ATOM 1865 C CYS A 124 4.944 -4.325 4.907 1.00 0.00 C ATOM 1866 O CYS A 124 5.151 -4.854 5.998 1.00 0.00 O ATOM 1867 CB CYS A 124 5.870 -5.863 3.166 1.00 0.00 C ATOM 1868 SG CYS A 124 6.445 -7.175 4.270 1.00 0.00 S ATOM 0 HA CYS A 124 5.708 -3.727 3.000 1.00 0.00 H new ATOM 0 HB2 CYS A 124 4.837 -6.066 2.885 1.00 0.00 H new ATOM 0 HB3 CYS A 124 6.461 -5.889 2.250 1.00 0.00 H new ATOM 0 HG CYS A 124 6.190 -6.848 5.502 1.00 0.00 H new ATOM 1874 N VAL A 125 3.850 -3.617 4.642 1.00 0.00 N ATOM 1875 CA VAL A 125 2.808 -3.418 5.642 1.00 0.00 C ATOM 1876 C VAL A 125 1.831 -4.587 5.644 1.00 0.00 C ATOM 1877 O VAL A 125 1.117 -4.809 4.667 1.00 0.00 O ATOM 1878 CB VAL A 125 2.025 -2.110 5.401 1.00 0.00 C ATOM 1879 CG1 VAL A 125 1.365 -1.641 6.687 1.00 0.00 C ATOM 1880 CG2 VAL A 125 2.936 -1.029 4.836 1.00 0.00 C ATOM 0 H VAL A 125 3.663 -3.172 3.743 1.00 0.00 H new ATOM 0 HA VAL A 125 3.307 -3.353 6.609 1.00 0.00 H new ATOM 0 HB VAL A 125 1.244 -2.309 4.667 1.00 0.00 H new ATOM 0 HG11 VAL A 125 0.817 -0.718 6.499 1.00 0.00 H new ATOM 0 HG12 VAL A 125 0.675 -2.406 7.042 1.00 0.00 H new ATOM 0 HG13 VAL A 125 2.129 -1.462 7.444 1.00 0.00 H new ATOM 0 HG21 VAL A 125 2.362 -0.117 4.675 1.00 0.00 H new ATOM 0 HG22 VAL A 125 3.744 -0.829 5.540 1.00 0.00 H new ATOM 0 HG23 VAL A 125 3.356 -1.366 3.888 1.00 0.00 H new ATOM 1890 N SER A 126 1.808 -5.339 6.740 1.00 0.00 N ATOM 1891 CA SER A 126 0.922 -6.493 6.852 1.00 0.00 C ATOM 1892 C SER A 126 -0.248 -6.215 7.794 1.00 0.00 C ATOM 1893 O SER A 126 -0.060 -5.742 8.915 1.00 0.00 O ATOM 1894 CB SER A 126 1.701 -7.717 7.338 1.00 0.00 C ATOM 1895 OG SER A 126 3.099 -7.527 7.190 1.00 0.00 O ATOM 0 H SER A 126 2.390 -5.171 7.560 1.00 0.00 H new ATOM 0 HA SER A 126 0.517 -6.693 5.860 1.00 0.00 H new ATOM 0 HB2 SER A 126 1.466 -7.909 8.385 1.00 0.00 H new ATOM 0 HB3 SER A 126 1.389 -8.597 6.775 1.00 0.00 H new ATOM 0 HG SER A 126 3.573 -8.323 7.510 1.00 0.00 H new ATOM 1901 N VAL A 127 -1.452 -6.529 7.327 1.00 0.00 N ATOM 1902 CA VAL A 127 -2.664 -6.335 8.116 1.00 0.00 C ATOM 1903 C VAL A 127 -3.594 -7.533 7.949 1.00 0.00 C ATOM 1904 O VAL A 127 -3.822 -8.000 6.833 1.00 0.00 O ATOM 1905 CB VAL A 127 -3.405 -5.044 7.712 1.00 0.00 C ATOM 1906 CG1 VAL A 127 -3.685 -5.036 6.219 1.00 0.00 C ATOM 1907 CG2 VAL A 127 -4.695 -4.887 8.503 1.00 0.00 C ATOM 0 H VAL A 127 -1.615 -6.922 6.400 1.00 0.00 H new ATOM 0 HA VAL A 127 -2.367 -6.242 9.161 1.00 0.00 H new ATOM 0 HB VAL A 127 -2.762 -4.195 7.946 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -4.208 -4.118 5.952 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -2.744 -5.089 5.672 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -4.304 -5.895 5.960 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -5.198 -3.969 8.199 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -5.346 -5.739 8.310 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -4.466 -4.840 9.568 1.00 0.00 H new ATOM 1917 N LEU A 128 -4.110 -8.041 9.062 1.00 0.00 N ATOM 1918 CA LEU A 128 -4.994 -9.201 9.028 1.00 0.00 C ATOM 1919 C LEU A 128 -6.462 -8.799 9.075 1.00 0.00 C ATOM 1920 O LEU A 128 -6.909 -8.140 10.013 1.00 0.00 O ATOM 1921 CB LEU A 128 -4.676 -10.138 10.194 1.00 0.00 C ATOM 1922 CG LEU A 128 -3.465 -11.050 9.982 1.00 0.00 C ATOM 1923 CD1 LEU A 128 -3.247 -11.938 11.197 1.00 0.00 C ATOM 1924 CD2 LEU A 128 -3.644 -11.892 8.729 1.00 0.00 C ATOM 0 H LEU A 128 -3.933 -7.670 9.996 1.00 0.00 H new ATOM 0 HA LEU A 128 -4.820 -9.717 8.084 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -4.507 -9.537 11.087 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -5.550 -10.760 10.389 1.00 0.00 H new ATOM 0 HG LEU A 128 -2.582 -10.425 9.851 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -2.382 -12.579 11.028 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -3.072 -11.317 12.075 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -4.130 -12.555 11.360 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -2.773 -12.534 8.595 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -4.537 -12.508 8.829 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -3.750 -11.238 7.863 1.00 0.00 H new ATOM 1936 N ILE A 129 -7.209 -9.210 8.054 1.00 0.00 N ATOM 1937 CA ILE A 129 -8.628 -8.903 7.975 1.00 0.00 C ATOM 1938 C ILE A 129 -9.482 -10.149 8.044 1.00 0.00 C ATOM 1939 O ILE A 129 -9.516 -10.954 7.112 1.00 0.00 O ATOM 1940 CB ILE A 129 -8.973 -8.159 6.679 1.00 0.00 C ATOM 1941 CG1 ILE A 129 -8.018 -6.992 6.484 1.00 0.00 C ATOM 1942 CG2 ILE A 129 -10.417 -7.675 6.712 1.00 0.00 C ATOM 1943 CD1 ILE A 129 -7.268 -7.025 5.172 1.00 0.00 C ATOM 0 H ILE A 129 -6.852 -9.757 7.271 1.00 0.00 H new ATOM 0 HA ILE A 129 -8.843 -8.268 8.835 1.00 0.00 H new ATOM 0 HB ILE A 129 -8.865 -8.843 5.837 1.00 0.00 H new ATOM 0 HG12 ILE A 129 -8.581 -6.061 6.546 1.00 0.00 H new ATOM 0 HG13 ILE A 129 -7.298 -6.984 7.302 1.00 0.00 H new ATOM 0 HG21 ILE A 129 -10.646 -7.149 5.785 1.00 0.00 H new ATOM 0 HG22 ILE A 129 -11.085 -8.530 6.819 1.00 0.00 H new ATOM 0 HG23 ILE A 129 -10.555 -6.999 7.556 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -6.608 -6.160 5.108 1.00 0.00 H new ATOM 0 HD12 ILE A 129 -6.676 -7.938 5.114 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -7.979 -7.001 4.346 1.00 0.00 H new ATOM 1955 N ASP A 130 -10.211 -10.273 9.133 1.00 0.00 N ATOM 1956 CA ASP A 130 -11.117 -11.388 9.311 1.00 0.00 C ATOM 1957 C ASP A 130 -12.467 -10.996 8.739 1.00 0.00 C ATOM 1958 O ASP A 130 -13.162 -11.802 8.129 1.00 0.00 O ATOM 1959 CB ASP A 130 -11.248 -11.751 10.792 1.00 0.00 C ATOM 1960 CG ASP A 130 -12.196 -12.911 11.023 1.00 0.00 C ATOM 1961 OD1 ASP A 130 -13.421 -12.717 10.870 1.00 0.00 O ATOM 1962 OD2 ASP A 130 -11.715 -14.015 11.357 1.00 0.00 O ATOM 0 H ASP A 130 -10.194 -9.613 9.911 1.00 0.00 H new ATOM 0 HA ASP A 130 -10.730 -12.265 8.792 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -10.265 -12.005 11.189 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -11.601 -10.881 11.346 1.00 0.00 H new ATOM 1967 N HIS A 131 -12.805 -9.725 8.929 1.00 0.00 N ATOM 1968 CA HIS A 131 -14.048 -9.164 8.422 1.00 0.00 C ATOM 1969 C HIS A 131 -13.803 -7.767 7.852 1.00 0.00 C ATOM 1970 O HIS A 131 -13.176 -6.927 8.498 1.00 0.00 O ATOM 1971 CB HIS A 131 -15.123 -9.154 9.521 1.00 0.00 C ATOM 1972 CG HIS A 131 -15.819 -7.839 9.715 1.00 0.00 C ATOM 1973 ND1 HIS A 131 -16.531 -7.076 8.851 1.00 0.00 N flip ATOM 1974 CD2 HIS A 131 -15.828 -7.163 10.916 1.00 0.00 C flip ATOM 1975 CE1 HIS A 131 -16.953 -5.966 9.541 1.00 0.00 C flip ATOM 1976 NE2 HIS A 131 -16.516 -6.042 10.785 1.00 0.00 N flip ATOM 0 H HIS A 131 -12.225 -9.058 9.438 1.00 0.00 H new ATOM 0 HA HIS A 131 -14.418 -9.792 7.612 1.00 0.00 H new ATOM 0 HB2 HIS A 131 -15.870 -9.912 9.285 1.00 0.00 H new ATOM 0 HB3 HIS A 131 -14.660 -9.446 10.464 1.00 0.00 H new ATOM 0 HD1 HIS A 131 -16.719 -7.287 7.871 1.00 0.00 H new ATOM 0 HD2 HIS A 131 -15.347 -7.497 11.824 1.00 0.00 H new ATOM 0 HE1 HIS A 131 -17.546 -5.161 9.132 1.00 0.00 H new ATOM 1985 N PHE A 132 -14.299 -7.522 6.646 1.00 0.00 N ATOM 1986 CA PHE A 132 -14.128 -6.225 6.003 1.00 0.00 C ATOM 1987 C PHE A 132 -15.358 -5.346 6.216 1.00 0.00 C ATOM 1988 O PHE A 132 -16.492 -5.800 6.080 1.00 0.00 O ATOM 1989 CB PHE A 132 -13.864 -6.403 4.509 1.00 0.00 C ATOM 1990 CG PHE A 132 -12.402 -6.512 4.160 1.00 0.00 C ATOM 1991 CD1 PHE A 132 -11.470 -5.637 4.702 1.00 0.00 C ATOM 1992 CD2 PHE A 132 -11.960 -7.488 3.279 1.00 0.00 C ATOM 1993 CE1 PHE A 132 -10.132 -5.735 4.368 1.00 0.00 C ATOM 1994 CE2 PHE A 132 -10.626 -7.587 2.942 1.00 0.00 C ATOM 1995 CZ PHE A 132 -9.710 -6.710 3.486 1.00 0.00 C ATOM 0 H PHE A 132 -14.822 -8.202 6.094 1.00 0.00 H new ATOM 0 HA PHE A 132 -13.269 -5.732 6.458 1.00 0.00 H new ATOM 0 HB2 PHE A 132 -14.379 -7.299 4.163 1.00 0.00 H new ATOM 0 HB3 PHE A 132 -14.295 -5.559 3.970 1.00 0.00 H new ATOM 0 HD1 PHE A 132 -11.794 -4.872 5.392 1.00 0.00 H new ATOM 0 HD2 PHE A 132 -12.670 -8.180 2.851 1.00 0.00 H new ATOM 0 HE1 PHE A 132 -9.417 -5.049 4.797 1.00 0.00 H new ATOM 0 HE2 PHE A 132 -10.299 -8.351 2.252 1.00 0.00 H new ATOM 0 HZ PHE A 132 -8.665 -6.786 3.223 1.00 0.00 H new ATOM 2048 N VAL A 138 -14.408 3.487 4.128 1.00 0.00 N ATOM 2049 CA VAL A 138 -13.392 2.649 4.751 1.00 0.00 C ATOM 2050 C VAL A 138 -12.220 2.397 3.801 1.00 0.00 C ATOM 2051 O VAL A 138 -12.392 1.829 2.723 1.00 0.00 O ATOM 2052 CB VAL A 138 -13.981 1.297 5.203 1.00 0.00 C ATOM 2053 CG1 VAL A 138 -15.182 1.512 6.113 1.00 0.00 C ATOM 2054 CG2 VAL A 138 -14.361 0.439 4.003 1.00 0.00 C ATOM 0 HA VAL A 138 -13.030 3.189 5.626 1.00 0.00 H new ATOM 0 HB VAL A 138 -13.214 0.766 5.767 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -15.583 0.546 6.421 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -14.875 2.075 6.994 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -15.950 2.069 5.576 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -14.774 -0.509 4.349 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -15.106 0.962 3.403 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -13.475 0.249 3.397 1.00 0.00 H new ATOM 2064 N VAL A 139 -11.031 2.829 4.207 1.00 0.00 N ATOM 2065 CA VAL A 139 -9.837 2.651 3.391 1.00 0.00 C ATOM 2066 C VAL A 139 -8.594 2.476 4.255 1.00 0.00 C ATOM 2067 O VAL A 139 -8.546 2.944 5.394 1.00 0.00 O ATOM 2068 CB VAL A 139 -9.620 3.848 2.446 1.00 0.00 C ATOM 2069 CG1 VAL A 139 -10.611 3.809 1.296 1.00 0.00 C ATOM 2070 CG2 VAL A 139 -9.726 5.158 3.210 1.00 0.00 C ATOM 0 H VAL A 139 -10.869 3.304 5.095 1.00 0.00 H new ATOM 0 HA VAL A 139 -9.995 1.749 2.800 1.00 0.00 H new ATOM 0 HB VAL A 139 -8.615 3.779 2.029 1.00 0.00 H new ATOM 0 HG11 VAL A 139 -10.441 4.663 0.640 1.00 0.00 H new ATOM 0 HG12 VAL A 139 -10.478 2.886 0.732 1.00 0.00 H new ATOM 0 HG13 VAL A 139 -11.627 3.850 1.689 1.00 0.00 H new ATOM 0 HG21 VAL A 139 -9.570 5.992 2.526 1.00 0.00 H new ATOM 0 HG22 VAL A 139 -10.716 5.238 3.660 1.00 0.00 H new ATOM 0 HG23 VAL A 139 -8.968 5.185 3.993 1.00 0.00 H new ATOM 2080 N TYR A 140 -7.589 1.807 3.703 1.00 0.00 N ATOM 2081 CA TYR A 140 -6.340 1.577 4.418 1.00 0.00 C ATOM 2082 C TYR A 140 -5.287 2.590 3.994 1.00 0.00 C ATOM 2083 O TYR A 140 -5.147 2.893 2.808 1.00 0.00 O ATOM 2084 CB TYR A 140 -5.830 0.158 4.160 1.00 0.00 C ATOM 2085 CG TYR A 140 -6.658 -0.918 4.823 1.00 0.00 C ATOM 2086 CD1 TYR A 140 -6.519 -1.191 6.178 1.00 0.00 C ATOM 2087 CD2 TYR A 140 -7.576 -1.662 4.094 1.00 0.00 C ATOM 2088 CE1 TYR A 140 -7.273 -2.175 6.787 1.00 0.00 C ATOM 2089 CE2 TYR A 140 -8.335 -2.647 4.697 1.00 0.00 C ATOM 2090 CZ TYR A 140 -8.179 -2.901 6.043 1.00 0.00 C ATOM 2091 OH TYR A 140 -8.932 -3.881 6.647 1.00 0.00 O ATOM 0 H TYR A 140 -7.615 1.414 2.762 1.00 0.00 H new ATOM 0 HA TYR A 140 -6.532 1.695 5.484 1.00 0.00 H new ATOM 0 HB2 TYR A 140 -5.812 -0.022 3.085 1.00 0.00 H new ATOM 0 HB3 TYR A 140 -4.802 0.082 4.514 1.00 0.00 H new ATOM 0 HD1 TYR A 140 -5.810 -0.625 6.764 1.00 0.00 H new ATOM 0 HD2 TYR A 140 -7.699 -1.468 3.039 1.00 0.00 H new ATOM 0 HE1 TYR A 140 -7.153 -2.375 7.842 1.00 0.00 H new ATOM 0 HE2 TYR A 140 -9.047 -3.215 4.117 1.00 0.00 H new ATOM 0 HH TYR A 140 -9.847 -3.854 6.296 1.00 0.00 H new ATOM 2101 N GLY A 141 -4.548 3.117 4.964 1.00 0.00 N ATOM 2102 CA GLY A 141 -3.523 4.093 4.656 1.00 0.00 C ATOM 2103 C GLY A 141 -2.452 4.183 5.727 1.00 0.00 C ATOM 2104 O GLY A 141 -2.748 4.440 6.893 1.00 0.00 O ATOM 0 H GLY A 141 -4.641 2.886 5.953 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -3.057 3.836 3.705 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -3.986 5.071 4.530 1.00 0.00 H new ATOM 2108 N VAL A 142 -1.205 3.980 5.319 1.00 0.00 N ATOM 2109 CA VAL A 142 -0.077 4.049 6.238 1.00 0.00 C ATOM 2110 C VAL A 142 0.076 5.468 6.783 1.00 0.00 C ATOM 2111 O VAL A 142 0.127 6.430 6.018 1.00 0.00 O ATOM 2112 CB VAL A 142 1.229 3.609 5.536 1.00 0.00 C ATOM 2113 CG1 VAL A 142 1.838 4.755 4.744 1.00 0.00 C ATOM 2114 CG2 VAL A 142 2.232 3.060 6.533 1.00 0.00 C ATOM 0 H VAL A 142 -0.950 3.766 4.355 1.00 0.00 H new ATOM 0 HA VAL A 142 -0.271 3.369 7.067 1.00 0.00 H new ATOM 0 HB VAL A 142 0.973 2.811 4.839 1.00 0.00 H new ATOM 0 HG11 VAL A 142 2.755 4.417 4.261 1.00 0.00 H new ATOM 0 HG12 VAL A 142 1.130 5.089 3.985 1.00 0.00 H new ATOM 0 HG13 VAL A 142 2.066 5.582 5.417 1.00 0.00 H new ATOM 0 HG21 VAL A 142 3.139 2.759 6.009 1.00 0.00 H new ATOM 0 HG22 VAL A 142 2.475 3.829 7.266 1.00 0.00 H new ATOM 0 HG23 VAL A 142 1.804 2.196 7.042 1.00 0.00 H new ATOM 2124 N VAL A 143 0.141 5.597 8.101 1.00 0.00 N ATOM 2125 CA VAL A 143 0.277 6.906 8.725 1.00 0.00 C ATOM 2126 C VAL A 143 1.725 7.196 9.100 1.00 0.00 C ATOM 2127 O VAL A 143 2.306 6.519 9.948 1.00 0.00 O ATOM 2128 CB VAL A 143 -0.610 7.032 9.981 1.00 0.00 C ATOM 2129 CG1 VAL A 143 -0.161 6.063 11.066 1.00 0.00 C ATOM 2130 CG2 VAL A 143 -0.601 8.464 10.496 1.00 0.00 C ATOM 0 H VAL A 143 0.102 4.816 8.756 1.00 0.00 H new ATOM 0 HA VAL A 143 -0.052 7.638 7.987 1.00 0.00 H new ATOM 0 HB VAL A 143 -1.632 6.772 9.705 1.00 0.00 H new ATOM 0 HG11 VAL A 143 -0.803 6.173 11.940 1.00 0.00 H new ATOM 0 HG12 VAL A 143 -0.228 5.041 10.692 1.00 0.00 H new ATOM 0 HG13 VAL A 143 0.870 6.280 11.344 1.00 0.00 H new ATOM 0 HG21 VAL A 143 -1.231 8.536 11.382 1.00 0.00 H new ATOM 0 HG22 VAL A 143 0.419 8.752 10.752 1.00 0.00 H new ATOM 0 HG23 VAL A 143 -0.984 9.131 9.723 1.00 0.00 H new ATOM 2140 N ARG A 144 2.301 8.215 8.467 1.00 0.00 N ATOM 2141 CA ARG A 144 3.678 8.606 8.740 1.00 0.00 C ATOM 2142 C ARG A 144 3.716 9.677 9.819 1.00 0.00 C ATOM 2143 O ARG A 144 3.381 10.835 9.566 1.00 0.00 O ATOM 2144 CB ARG A 144 4.351 9.124 7.468 1.00 0.00 C ATOM 2145 CG ARG A 144 5.826 8.766 7.371 1.00 0.00 C ATOM 2146 CD ARG A 144 6.675 9.663 8.257 1.00 0.00 C ATOM 2147 NE ARG A 144 7.775 8.931 8.884 1.00 0.00 N ATOM 2148 CZ ARG A 144 8.837 9.516 9.431 1.00 0.00 C ATOM 2149 NH1 ARG A 144 8.948 10.839 9.432 1.00 0.00 N ATOM 2150 NH2 ARG A 144 9.792 8.776 9.979 1.00 0.00 N ATOM 0 H ARG A 144 1.834 8.784 7.761 1.00 0.00 H new ATOM 0 HA ARG A 144 4.222 7.729 9.091 1.00 0.00 H new ATOM 0 HB2 ARG A 144 3.830 8.719 6.600 1.00 0.00 H new ATOM 0 HB3 ARG A 144 4.245 10.208 7.427 1.00 0.00 H new ATOM 0 HG2 ARG A 144 5.969 7.725 7.661 1.00 0.00 H new ATOM 0 HG3 ARG A 144 6.156 8.857 6.336 1.00 0.00 H new ATOM 0 HD2 ARG A 144 7.078 10.483 7.663 1.00 0.00 H new ATOM 0 HD3 ARG A 144 6.048 10.107 9.030 1.00 0.00 H new ATOM 0 HE ARG A 144 7.725 7.912 8.903 1.00 0.00 H new ATOM 0 HH11 ARG A 144 8.217 11.412 9.012 1.00 0.00 H new ATOM 0 HH12 ARG A 144 9.765 11.282 9.853 1.00 0.00 H new ATOM 0 HH21 ARG A 144 9.712 7.759 9.981 1.00 0.00 H new ATOM 0 HH22 ARG A 144 10.607 9.224 10.399 1.00 0.00 H new ATOM 2164 N ARG A 145 4.111 9.280 11.025 1.00 0.00 N ATOM 2165 CA ARG A 145 4.184 10.200 12.154 1.00 0.00 C ATOM 2166 C ARG A 145 5.401 11.114 12.049 1.00 0.00 C ATOM 2167 O ARG A 145 6.333 10.839 11.293 1.00 0.00 O ATOM 2168 CB ARG A 145 4.231 9.418 13.469 1.00 0.00 C ATOM 2169 CG ARG A 145 3.192 8.312 13.556 1.00 0.00 C ATOM 2170 CD ARG A 145 1.910 8.800 14.215 1.00 0.00 C ATOM 2171 NE ARG A 145 1.383 7.833 15.173 1.00 0.00 N ATOM 2172 CZ ARG A 145 0.123 7.824 15.602 1.00 0.00 C ATOM 2173 NH1 ARG A 145 -0.743 8.729 15.160 1.00 0.00 N ATOM 2174 NH2 ARG A 145 -0.273 6.909 16.476 1.00 0.00 N ATOM 0 H ARG A 145 4.386 8.323 11.245 1.00 0.00 H new ATOM 0 HA ARG A 145 3.290 10.823 12.136 1.00 0.00 H new ATOM 0 HB2 ARG A 145 5.223 8.983 13.588 1.00 0.00 H new ATOM 0 HB3 ARG A 145 4.084 10.109 14.299 1.00 0.00 H new ATOM 0 HG2 ARG A 145 2.969 7.941 12.555 1.00 0.00 H new ATOM 0 HG3 ARG A 145 3.598 7.474 14.123 1.00 0.00 H new ATOM 0 HD2 ARG A 145 2.101 9.745 14.723 1.00 0.00 H new ATOM 0 HD3 ARG A 145 1.160 8.996 13.448 1.00 0.00 H new ATOM 0 HE ARG A 145 2.018 7.122 15.535 1.00 0.00 H new ATOM 0 HH11 ARG A 145 -0.444 9.436 14.488 1.00 0.00 H new ATOM 0 HH12 ARG A 145 -1.707 8.717 15.492 1.00 0.00 H new ATOM 0 HH21 ARG A 145 0.388 6.212 16.820 1.00 0.00 H new ATOM 0 HH22 ARG A 145 -1.239 6.902 16.805 1.00 0.00 H new ATOM 2188 N SER A 146 5.382 12.202 12.812 1.00 0.00 N ATOM 2189 CA SER A 146 6.480 13.161 12.809 1.00 0.00 C ATOM 2190 C SER A 146 6.743 13.694 14.213 1.00 0.00 C ATOM 2191 O SER A 146 5.762 13.899 14.960 1.00 0.00 O ATOM 2192 CB SER A 146 6.169 14.320 11.860 1.00 0.00 C ATOM 2193 OG SER A 146 7.359 14.888 11.340 1.00 0.00 O ATOM 2194 OXT SER A 146 7.926 13.903 14.555 1.00 0.00 O ATOM 0 H SER A 146 4.616 12.442 13.442 1.00 0.00 H new ATOM 0 HA SER A 146 7.377 12.647 12.463 1.00 0.00 H new ATOM 0 HB2 SER A 146 5.544 13.965 11.041 1.00 0.00 H new ATOM 0 HB3 SER A 146 5.599 15.084 12.389 1.00 0.00 H new ATOM 0 HG SER A 146 7.252 15.859 11.264 1.00 0.00 H new