USER MOD reduce.3.24.130724 H: found=0, std=0, add=1283, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1280 hydrogens (30 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 NoAdj-H: A 93 HIS HE2 : A 93 HIS NE2 : A 154 HEMFE :(H bumps) USER MOD Set 1.1: A 113 HIS : no HD1:sc= -1.86 K(o=-1.5,f=-2.6) USER MOD Set 1.2: A 117 SER OG : rot 73:sc= 0.399 USER MOD Set 2.1: A 24 HIS : no HE2:sc= -2.89! C(o=-2.4!,f=-15!) USER MOD Set 2.2: A 119 HIS : no HD1:sc= 0.456 K(o=-2.4,f=-13!) USER MOD Single : A 1 VAL N :NH3+ -161:sc= -0.0265 (180deg=-0.567) USER MOD Single : A 3 SER OG : rot 83:sc= 1.26 USER MOD Single : A 8 GLN : amide:sc= 1.04 K(o=1,f=0) USER MOD Single : A 12 HIS : no HE2:sc= 1.1 K(o=1.1,f=-3.3!) USER MOD Single : A 16 LYS NZ :NH3+ -150:sc= 0 (180deg=-0.343) USER MOD Single : A 26 GLN : amide:sc= 1.26 K(o=1.3,f=-0.3) USER MOD Single : A 34 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0815) USER MOD Single : A 35 SER OG : rot 71:sc= 2.32 USER MOD Single : A 36 HIS : no HD1:sc= -0.709 K(o=-0.71,f=-4!) USER MOD Single : A 39 THR OG1 : rot -110:sc= 0.91 USER MOD Single : A 42 LYS NZ :NH3+ 178:sc= 0.381 (180deg=0.374) USER MOD Single : A 47 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.068) USER MOD Single : A 48 HIS : no HE2:sc= -1.4 K(o=-1.4,f=-4!) USER MOD Single : A 50 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.115) USER MOD Single : A 51 THR OG1 : rot -55:sc= 0.909 USER MOD Single : A 55 MET CE :methyl 174:sc= -0.322 (180deg=-0.424) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 SER OG : rot 49:sc= 0.432 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ -168:sc= -0.155 (180deg=-0.257) USER MOD Single : A 64 HIS : no HD1:sc= -0.598 K(o=-0.6,f=-3.8!) USER MOD Single : A 67 THR OG1 : rot 80:sc= 1.18 USER MOD Single : A 70 THR OG1 : rot 82:sc= 1.18 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 LYS NZ :NH3+ 167:sc= 1.07 (180deg=0.935) USER MOD Single : A 81 HIS : no HE2:sc= -0.0846 K(o=-0.085,f=-3.8!) USER MOD Single : A 82 HIS : no HE2:sc= -0.244 K(o=-0.24,f=-1.5) USER MOD Single : A 87 LYS NZ :NH3+ 128:sc= -0.0141 (180deg=-0.247) USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 92 SER OG : rot -149:sc= 0.838 USER MOD Single : A 95 THR OG1 : rot -69:sc= 1.14 USER MOD Single : A 96 LYS NZ :NH3+ -109:sc= 1.04 (180deg=-0.0289) USER MOD Single : A 97 HIS :FLIP no HE2:sc= -2.9 F(o=-3.6,f=-2.9) USER MOD Single : A 98 LYS NZ :NH3+ 163:sc= 1.06 (180deg=0.725) USER MOD Single : A 102 LYS NZ :NH3+ 132:sc= 1.3 (180deg=0.524) USER MOD Single : A 103 TYR OH : rot 180:sc= -0.0268 USER MOD Single : A 108 SER OG : rot 67:sc= 1.26 USER MOD Single : A 116 HIS : no HE2:sc= -0.637 K(o=-0.64,f=-3.8!) USER MOD Single : A 128 GLN : amide:sc= -0.665 K(o=-0.67,f=-4.9!) USER MOD Single : A 131 MET CE :methyl -173:sc= -0.522 (180deg=-0.675) USER MOD Single : A 132 ASN : amide:sc= 0.865 K(o=0.86,f=-0.012) USER MOD Single : A 133 LYS NZ :NH3+ 166:sc= 1.05 (180deg=0.755) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 LYS NZ :NH3+ 169:sc= 0.757 (180deg=0.0672) USER MOD Single : A 146 TYR OH : rot -175:sc= 1.23 USER MOD Single : A 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 TYR OH : rot 180:sc=-0.00746 USER MOD Single : A 152 GLN : amide:sc= 0.17 K(o=0.17,f=-4.9!) USER MOD Single : A 154 HEM CMA :methyl 150:sc= -0.575 (180deg=-0.575) USER MOD Single : A 154 HEM CMB :methyl 150:sc= -0.0158 (180deg=-0.0158) USER MOD Single : A 154 HEM CMC :methyl -30:sc= -4.79! (180deg=-5.97!) USER MOD Single : A 154 HEM CMD :methyl -30:sc= -0.704 (180deg=-1.72) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 18.060 1.510 3.809 1.00 0.00 N ATOM 2 CA VAL A 1 19.051 0.631 3.215 1.00 0.00 C ATOM 3 C VAL A 1 18.652 -0.807 3.550 1.00 0.00 C ATOM 4 O VAL A 1 18.301 -1.098 4.695 1.00 0.00 O ATOM 5 CB VAL A 1 20.449 0.989 3.746 1.00 0.00 C ATOM 6 CG1 VAL A 1 21.518 0.028 3.207 1.00 0.00 C ATOM 7 CG2 VAL A 1 20.826 2.422 3.347 1.00 0.00 C ATOM 0 H1 VAL A 1 18.104 2.442 3.350 1.00 0.00 H new ATOM 0 H2 VAL A 1 17.112 1.103 3.677 1.00 0.00 H new ATOM 0 H3 VAL A 1 18.254 1.615 4.825 1.00 0.00 H new ATOM 0 HA VAL A 1 19.089 0.744 2.132 1.00 0.00 H new ATOM 0 HB VAL A 1 20.412 0.904 4.832 1.00 0.00 H new ATOM 0 HG11 VAL A 1 22.494 0.310 3.602 1.00 0.00 H new ATOM 0 HG12 VAL A 1 21.282 -0.990 3.517 1.00 0.00 H new ATOM 0 HG13 VAL A 1 21.539 0.080 2.118 1.00 0.00 H new ATOM 0 HG21 VAL A 1 21.818 2.658 3.731 1.00 0.00 H new ATOM 0 HG22 VAL A 1 20.828 2.509 2.260 1.00 0.00 H new ATOM 0 HG23 VAL A 1 20.100 3.119 3.765 1.00 0.00 H new ATOM 19 N LEU A 2 18.694 -1.700 2.559 1.00 0.00 N ATOM 20 CA LEU A 2 18.304 -3.084 2.725 1.00 0.00 C ATOM 21 C LEU A 2 19.208 -3.932 1.829 1.00 0.00 C ATOM 22 O LEU A 2 19.411 -3.573 0.668 1.00 0.00 O ATOM 23 CB LEU A 2 16.820 -3.228 2.362 1.00 0.00 C ATOM 24 CG LEU A 2 16.298 -4.660 2.539 1.00 0.00 C ATOM 25 CD1 LEU A 2 16.209 -5.030 4.023 1.00 0.00 C ATOM 26 CD2 LEU A 2 14.914 -4.788 1.892 1.00 0.00 C ATOM 0 H LEU A 2 19.004 -1.472 1.614 1.00 0.00 H new ATOM 0 HA LEU A 2 18.421 -3.422 3.755 1.00 0.00 H new ATOM 0 HB2 LEU A 2 16.232 -2.553 2.984 1.00 0.00 H new ATOM 0 HB3 LEU A 2 16.673 -2.918 1.327 1.00 0.00 H new ATOM 0 HG LEU A 2 16.995 -5.343 2.054 1.00 0.00 H new ATOM 0 HD11 LEU A 2 15.836 -6.050 4.122 1.00 0.00 H new ATOM 0 HD12 LEU A 2 17.198 -4.959 4.476 1.00 0.00 H new ATOM 0 HD13 LEU A 2 15.529 -4.345 4.529 1.00 0.00 H new ATOM 0 HD21 LEU A 2 14.546 -5.806 2.019 1.00 0.00 H new ATOM 0 HD22 LEU A 2 14.224 -4.091 2.367 1.00 0.00 H new ATOM 0 HD23 LEU A 2 14.987 -4.559 0.829 1.00 0.00 H new ATOM 38 N SER A 3 19.788 -5.010 2.363 1.00 0.00 N ATOM 39 CA SER A 3 20.710 -5.852 1.616 1.00 0.00 C ATOM 40 C SER A 3 19.985 -6.694 0.556 1.00 0.00 C ATOM 41 O SER A 3 18.768 -6.901 0.626 1.00 0.00 O ATOM 42 CB SER A 3 21.564 -6.698 2.576 1.00 0.00 C ATOM 43 OG SER A 3 21.469 -6.223 3.908 1.00 0.00 O ATOM 0 H SER A 3 19.629 -5.318 3.322 1.00 0.00 H new ATOM 0 HA SER A 3 21.393 -5.208 1.062 1.00 0.00 H new ATOM 0 HB2 SER A 3 21.239 -7.737 2.535 1.00 0.00 H new ATOM 0 HB3 SER A 3 22.605 -6.677 2.254 1.00 0.00 H new ATOM 0 HG SER A 3 20.665 -6.592 4.330 1.00 0.00 H new ATOM 49 N GLU A 4 20.747 -7.136 -0.452 1.00 0.00 N ATOM 50 CA GLU A 4 20.250 -7.902 -1.589 1.00 0.00 C ATOM 51 C GLU A 4 19.406 -9.103 -1.167 1.00 0.00 C ATOM 52 O GLU A 4 18.322 -9.286 -1.703 1.00 0.00 O ATOM 53 CB GLU A 4 21.407 -8.328 -2.515 1.00 0.00 C ATOM 54 CG GLU A 4 20.987 -8.420 -3.993 1.00 0.00 C ATOM 55 CD GLU A 4 19.867 -9.426 -4.260 1.00 0.00 C ATOM 56 OE1 GLU A 4 20.097 -10.624 -3.984 1.00 0.00 O ATOM 57 OE2 GLU A 4 18.802 -8.979 -4.736 1.00 0.00 O ATOM 0 H GLU A 4 21.751 -6.963 -0.495 1.00 0.00 H new ATOM 0 HA GLU A 4 19.588 -7.241 -2.149 1.00 0.00 H new ATOM 0 HB2 GLU A 4 22.225 -7.614 -2.419 1.00 0.00 H new ATOM 0 HB3 GLU A 4 21.789 -9.296 -2.190 1.00 0.00 H new ATOM 0 HG2 GLU A 4 20.665 -7.435 -4.330 1.00 0.00 H new ATOM 0 HG3 GLU A 4 21.857 -8.693 -4.591 1.00 0.00 H new ATOM 64 N GLY A 5 19.900 -9.945 -0.255 1.00 0.00 N ATOM 65 CA GLY A 5 19.180 -11.144 0.172 1.00 0.00 C ATOM 66 C GLY A 5 17.725 -10.830 0.526 1.00 0.00 C ATOM 67 O GLY A 5 16.788 -11.436 0.003 1.00 0.00 O ATOM 0 H GLY A 5 20.802 -9.815 0.203 1.00 0.00 H new ATOM 0 HA2 GLY A 5 19.209 -11.889 -0.623 1.00 0.00 H new ATOM 0 HA3 GLY A 5 19.680 -11.581 1.037 1.00 0.00 H new ATOM 71 N GLU A 6 17.544 -9.845 1.404 1.00 0.00 N ATOM 72 CA GLU A 6 16.234 -9.407 1.844 1.00 0.00 C ATOM 73 C GLU A 6 15.413 -8.889 0.658 1.00 0.00 C ATOM 74 O GLU A 6 14.226 -9.194 0.556 1.00 0.00 O ATOM 75 CB GLU A 6 16.370 -8.346 2.936 1.00 0.00 C ATOM 76 CG GLU A 6 17.222 -8.777 4.138 1.00 0.00 C ATOM 77 CD GLU A 6 18.682 -8.376 3.965 1.00 0.00 C ATOM 78 OE1 GLU A 6 19.409 -9.151 3.305 1.00 0.00 O ATOM 79 OE2 GLU A 6 19.042 -7.282 4.455 1.00 0.00 O ATOM 0 H GLU A 6 18.314 -9.328 1.830 1.00 0.00 H new ATOM 0 HA GLU A 6 15.701 -10.258 2.267 1.00 0.00 H new ATOM 0 HB2 GLU A 6 16.807 -7.448 2.500 1.00 0.00 H new ATOM 0 HB3 GLU A 6 15.375 -8.077 3.290 1.00 0.00 H new ATOM 0 HG2 GLU A 6 16.825 -8.324 5.047 1.00 0.00 H new ATOM 0 HG3 GLU A 6 17.154 -9.858 4.264 1.00 0.00 H new ATOM 86 N TRP A 7 16.016 -8.101 -0.241 1.00 0.00 N ATOM 87 CA TRP A 7 15.305 -7.670 -1.438 1.00 0.00 C ATOM 88 C TRP A 7 14.852 -8.873 -2.265 1.00 0.00 C ATOM 89 O TRP A 7 13.711 -8.930 -2.714 1.00 0.00 O ATOM 90 CB TRP A 7 16.145 -6.711 -2.292 1.00 0.00 C ATOM 91 CG TRP A 7 16.093 -5.270 -1.893 1.00 0.00 C ATOM 92 CD1 TRP A 7 17.141 -4.525 -1.482 1.00 0.00 C ATOM 93 CD2 TRP A 7 14.952 -4.364 -1.939 1.00 0.00 C ATOM 94 NE1 TRP A 7 16.731 -3.230 -1.265 1.00 0.00 N ATOM 95 CE2 TRP A 7 15.385 -3.073 -1.510 1.00 0.00 C ATOM 96 CE3 TRP A 7 13.592 -4.501 -2.287 1.00 0.00 C ATOM 97 CZ2 TRP A 7 14.516 -1.976 -1.426 1.00 0.00 C ATOM 98 CZ3 TRP A 7 12.707 -3.412 -2.186 1.00 0.00 C ATOM 99 CH2 TRP A 7 13.165 -2.147 -1.774 1.00 0.00 C ATOM 0 H TRP A 7 16.973 -7.758 -0.161 1.00 0.00 H new ATOM 0 HA TRP A 7 14.422 -7.123 -1.108 1.00 0.00 H new ATOM 0 HB2 TRP A 7 17.184 -7.040 -2.260 1.00 0.00 H new ATOM 0 HB3 TRP A 7 15.816 -6.794 -3.328 1.00 0.00 H new ATOM 0 HD1 TRP A 7 18.148 -4.890 -1.344 1.00 0.00 H new ATOM 0 HE1 TRP A 7 17.349 -2.478 -0.960 1.00 0.00 H new ATOM 0 HE3 TRP A 7 13.225 -5.455 -2.636 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 14.880 -1.013 -1.099 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 11.663 -3.549 -2.428 1.00 0.00 H new ATOM 0 HH2 TRP A 7 12.482 -1.312 -1.725 1.00 0.00 H new ATOM 110 N GLN A 8 15.729 -9.856 -2.450 1.00 0.00 N ATOM 111 CA GLN A 8 15.451 -11.039 -3.246 1.00 0.00 C ATOM 112 C GLN A 8 14.254 -11.779 -2.634 1.00 0.00 C ATOM 113 O GLN A 8 13.337 -12.202 -3.339 1.00 0.00 O ATOM 114 CB GLN A 8 16.718 -11.905 -3.299 1.00 0.00 C ATOM 115 CG GLN A 8 16.720 -12.820 -4.525 1.00 0.00 C ATOM 116 CD GLN A 8 17.924 -13.757 -4.548 1.00 0.00 C ATOM 117 OE1 GLN A 8 17.766 -14.962 -4.708 1.00 0.00 O ATOM 118 NE2 GLN A 8 19.137 -13.230 -4.394 1.00 0.00 N ATOM 0 H GLN A 8 16.665 -9.849 -2.044 1.00 0.00 H new ATOM 0 HA GLN A 8 15.185 -10.779 -4.271 1.00 0.00 H new ATOM 0 HB2 GLN A 8 17.598 -11.263 -3.321 1.00 0.00 H new ATOM 0 HB3 GLN A 8 16.786 -12.508 -2.393 1.00 0.00 H new ATOM 0 HG2 GLN A 8 15.803 -13.410 -4.537 1.00 0.00 H new ATOM 0 HG3 GLN A 8 16.719 -12.212 -5.429 1.00 0.00 H new ATOM 0 HE21 GLN A 8 19.243 -12.224 -4.262 1.00 0.00 H new ATOM 0 HE22 GLN A 8 19.960 -13.832 -4.408 1.00 0.00 H new ATOM 127 N LEU A 9 14.274 -11.950 -1.309 1.00 0.00 N ATOM 128 CA LEU A 9 13.203 -12.556 -0.544 1.00 0.00 C ATOM 129 C LEU A 9 11.912 -11.757 -0.776 1.00 0.00 C ATOM 130 O LEU A 9 10.927 -12.314 -1.263 1.00 0.00 O ATOM 131 CB LEU A 9 13.694 -12.649 0.910 1.00 0.00 C ATOM 132 CG LEU A 9 12.619 -12.773 1.987 1.00 0.00 C ATOM 133 CD1 LEU A 9 11.736 -14.013 1.800 1.00 0.00 C ATOM 134 CD2 LEU A 9 13.311 -12.824 3.355 1.00 0.00 C ATOM 0 H LEU A 9 15.063 -11.659 -0.731 1.00 0.00 H new ATOM 0 HA LEU A 9 12.951 -13.571 -0.852 1.00 0.00 H new ATOM 0 HB2 LEU A 9 14.358 -13.509 0.991 1.00 0.00 H new ATOM 0 HB3 LEU A 9 14.292 -11.763 1.125 1.00 0.00 H new ATOM 0 HG LEU A 9 11.960 -11.908 1.914 1.00 0.00 H new ATOM 0 HD11 LEU A 9 10.989 -14.051 2.593 1.00 0.00 H new ATOM 0 HD12 LEU A 9 11.236 -13.961 0.833 1.00 0.00 H new ATOM 0 HD13 LEU A 9 12.355 -14.910 1.841 1.00 0.00 H new ATOM 0 HD21 LEU A 9 12.560 -12.913 4.140 1.00 0.00 H new ATOM 0 HD22 LEU A 9 13.979 -13.685 3.393 1.00 0.00 H new ATOM 0 HD23 LEU A 9 13.887 -11.911 3.506 1.00 0.00 H new ATOM 146 N VAL A 10 11.961 -10.434 -0.588 1.00 0.00 N ATOM 147 CA VAL A 10 10.825 -9.544 -0.813 1.00 0.00 C ATOM 148 C VAL A 10 10.229 -9.792 -2.202 1.00 0.00 C ATOM 149 O VAL A 10 9.041 -10.077 -2.322 1.00 0.00 O ATOM 150 CB VAL A 10 11.244 -8.075 -0.607 1.00 0.00 C ATOM 151 CG1 VAL A 10 10.281 -7.049 -1.220 1.00 0.00 C ATOM 152 CG2 VAL A 10 11.370 -7.784 0.890 1.00 0.00 C ATOM 0 H VAL A 10 12.801 -9.949 -0.272 1.00 0.00 H new ATOM 0 HA VAL A 10 10.045 -9.759 -0.082 1.00 0.00 H new ATOM 0 HB VAL A 10 12.196 -7.965 -1.126 1.00 0.00 H new ATOM 0 HG11 VAL A 10 10.652 -6.042 -1.028 1.00 0.00 H new ATOM 0 HG12 VAL A 10 10.212 -7.212 -2.296 1.00 0.00 H new ATOM 0 HG13 VAL A 10 9.294 -7.163 -0.772 1.00 0.00 H new ATOM 0 HG21 VAL A 10 11.666 -6.745 1.035 1.00 0.00 H new ATOM 0 HG22 VAL A 10 10.411 -7.959 1.377 1.00 0.00 H new ATOM 0 HG23 VAL A 10 12.123 -8.440 1.326 1.00 0.00 H new ATOM 162 N LEU A 11 11.041 -9.714 -3.257 1.00 0.00 N ATOM 163 CA LEU A 11 10.551 -9.946 -4.607 1.00 0.00 C ATOM 164 C LEU A 11 9.977 -11.357 -4.781 1.00 0.00 C ATOM 165 O LEU A 11 8.990 -11.518 -5.497 1.00 0.00 O ATOM 166 CB LEU A 11 11.622 -9.602 -5.646 1.00 0.00 C ATOM 167 CG LEU A 11 12.073 -8.129 -5.585 1.00 0.00 C ATOM 168 CD1 LEU A 11 12.997 -7.842 -6.771 1.00 0.00 C ATOM 169 CD2 LEU A 11 10.906 -7.135 -5.616 1.00 0.00 C ATOM 0 H LEU A 11 12.035 -9.493 -3.199 1.00 0.00 H new ATOM 0 HA LEU A 11 9.715 -9.268 -4.779 1.00 0.00 H new ATOM 0 HB2 LEU A 11 12.487 -10.247 -5.494 1.00 0.00 H new ATOM 0 HB3 LEU A 11 11.235 -9.816 -6.642 1.00 0.00 H new ATOM 0 HG LEU A 11 12.586 -7.993 -4.633 1.00 0.00 H new ATOM 0 HD11 LEU A 11 13.321 -6.802 -6.736 1.00 0.00 H new ATOM 0 HD12 LEU A 11 13.868 -8.495 -6.720 1.00 0.00 H new ATOM 0 HD13 LEU A 11 12.461 -8.024 -7.702 1.00 0.00 H new ATOM 0 HD21 LEU A 11 11.294 -6.117 -5.570 1.00 0.00 H new ATOM 0 HD22 LEU A 11 10.340 -7.267 -6.538 1.00 0.00 H new ATOM 0 HD23 LEU A 11 10.253 -7.313 -4.762 1.00 0.00 H new ATOM 181 N HIS A 12 10.560 -12.376 -4.140 1.00 0.00 N ATOM 182 CA HIS A 12 9.987 -13.717 -4.209 1.00 0.00 C ATOM 183 C HIS A 12 8.572 -13.708 -3.628 1.00 0.00 C ATOM 184 O HIS A 12 7.615 -13.978 -4.352 1.00 0.00 O ATOM 185 CB HIS A 12 10.876 -14.758 -3.520 1.00 0.00 C ATOM 186 CG HIS A 12 11.979 -15.277 -4.406 1.00 0.00 C ATOM 187 ND1 HIS A 12 13.141 -14.607 -4.726 1.00 0.00 N ATOM 188 CD2 HIS A 12 11.973 -16.465 -5.082 1.00 0.00 C ATOM 189 CE1 HIS A 12 13.841 -15.380 -5.575 1.00 0.00 C ATOM 190 NE2 HIS A 12 13.149 -16.513 -5.804 1.00 0.00 N ATOM 0 H HIS A 12 11.409 -12.298 -3.580 1.00 0.00 H new ATOM 0 HA HIS A 12 9.930 -14.010 -5.257 1.00 0.00 H new ATOM 0 HB2 HIS A 12 11.315 -14.316 -2.625 1.00 0.00 H new ATOM 0 HB3 HIS A 12 10.258 -15.594 -3.192 1.00 0.00 H new ATOM 0 HD1 HIS A 12 13.420 -13.689 -4.380 1.00 0.00 H new ATOM 0 HD2 HIS A 12 11.200 -17.219 -5.056 1.00 0.00 H new ATOM 0 HE1 HIS A 12 14.801 -15.133 -6.003 1.00 0.00 H new ATOM 199 N VAL A 13 8.397 -13.299 -2.365 1.00 0.00 N ATOM 200 CA VAL A 13 7.056 -13.296 -1.780 1.00 0.00 C ATOM 201 C VAL A 13 6.132 -12.368 -2.591 1.00 0.00 C ATOM 202 O VAL A 13 5.003 -12.721 -2.928 1.00 0.00 O ATOM 203 CB VAL A 13 7.101 -13.030 -0.265 1.00 0.00 C ATOM 204 CG1 VAL A 13 7.389 -11.575 0.100 1.00 0.00 C ATOM 205 CG2 VAL A 13 5.804 -13.493 0.406 1.00 0.00 C ATOM 0 H VAL A 13 9.142 -12.976 -1.748 1.00 0.00 H new ATOM 0 HA VAL A 13 6.612 -14.289 -1.855 1.00 0.00 H new ATOM 0 HB VAL A 13 7.941 -13.614 0.111 1.00 0.00 H new ATOM 0 HG11 VAL A 13 7.405 -11.468 1.185 1.00 0.00 H new ATOM 0 HG12 VAL A 13 8.357 -11.282 -0.307 1.00 0.00 H new ATOM 0 HG13 VAL A 13 6.611 -10.935 -0.317 1.00 0.00 H new ATOM 0 HG21 VAL A 13 5.858 -13.295 1.477 1.00 0.00 H new ATOM 0 HG22 VAL A 13 4.960 -12.951 -0.021 1.00 0.00 H new ATOM 0 HG23 VAL A 13 5.670 -14.562 0.241 1.00 0.00 H new ATOM 215 N TRP A 14 6.683 -11.272 -3.120 1.00 0.00 N ATOM 216 CA TRP A 14 5.903 -10.347 -3.920 1.00 0.00 C ATOM 217 C TRP A 14 5.419 -10.993 -5.219 1.00 0.00 C ATOM 218 O TRP A 14 4.335 -10.671 -5.709 1.00 0.00 O ATOM 219 CB TRP A 14 6.658 -9.052 -4.205 1.00 0.00 C ATOM 220 CG TRP A 14 5.730 -7.968 -4.637 1.00 0.00 C ATOM 221 CD1 TRP A 14 5.354 -7.709 -5.908 1.00 0.00 C ATOM 222 CD2 TRP A 14 4.915 -7.108 -3.792 1.00 0.00 C ATOM 223 NE1 TRP A 14 4.398 -6.714 -5.913 1.00 0.00 N ATOM 224 CE2 TRP A 14 4.069 -6.325 -4.630 1.00 0.00 C ATOM 225 CE3 TRP A 14 4.781 -6.941 -2.395 1.00 0.00 C ATOM 226 CZ2 TRP A 14 3.139 -5.421 -4.105 1.00 0.00 C ATOM 227 CZ3 TRP A 14 3.884 -5.999 -1.861 1.00 0.00 C ATOM 228 CH2 TRP A 14 3.075 -5.229 -2.714 1.00 0.00 C ATOM 0 H TRP A 14 7.662 -11.011 -3.005 1.00 0.00 H new ATOM 0 HA TRP A 14 5.026 -10.088 -3.327 1.00 0.00 H new ATOM 0 HB2 TRP A 14 7.196 -8.738 -3.311 1.00 0.00 H new ATOM 0 HB3 TRP A 14 7.403 -9.226 -4.981 1.00 0.00 H new ATOM 0 HD1 TRP A 14 5.742 -8.205 -6.786 1.00 0.00 H new ATOM 0 HE1 TRP A 14 3.987 -6.316 -6.757 1.00 0.00 H new ATOM 0 HE3 TRP A 14 5.377 -7.546 -1.728 1.00 0.00 H new ATOM 0 HZ2 TRP A 14 2.477 -4.876 -4.762 1.00 0.00 H new ATOM 0 HZ3 TRP A 14 3.816 -5.867 -0.791 1.00 0.00 H new ATOM 0 HH2 TRP A 14 2.404 -4.490 -2.301 1.00 0.00 H new ATOM 239 N ALA A 15 6.207 -11.895 -5.807 1.00 0.00 N ATOM 240 CA ALA A 15 5.732 -12.626 -6.965 1.00 0.00 C ATOM 241 C ALA A 15 4.479 -13.417 -6.578 1.00 0.00 C ATOM 242 O ALA A 15 3.546 -13.522 -7.368 1.00 0.00 O ATOM 243 CB ALA A 15 6.831 -13.528 -7.534 1.00 0.00 C ATOM 0 H ALA A 15 7.153 -12.128 -5.504 1.00 0.00 H new ATOM 0 HA ALA A 15 5.467 -11.926 -7.757 1.00 0.00 H new ATOM 0 HB1 ALA A 15 6.448 -14.065 -8.402 1.00 0.00 H new ATOM 0 HB2 ALA A 15 7.684 -12.918 -7.832 1.00 0.00 H new ATOM 0 HB3 ALA A 15 7.144 -14.244 -6.774 1.00 0.00 H new ATOM 249 N LYS A 16 4.430 -13.931 -5.346 1.00 0.00 N ATOM 250 CA LYS A 16 3.264 -14.647 -4.848 1.00 0.00 C ATOM 251 C LYS A 16 2.085 -13.671 -4.681 1.00 0.00 C ATOM 252 O LYS A 16 0.970 -14.003 -5.077 1.00 0.00 O ATOM 253 CB LYS A 16 3.610 -15.467 -3.599 1.00 0.00 C ATOM 254 CG LYS A 16 4.895 -16.282 -3.805 1.00 0.00 C ATOM 255 CD LYS A 16 5.173 -17.195 -2.609 1.00 0.00 C ATOM 256 CE LYS A 16 6.520 -17.898 -2.807 1.00 0.00 C ATOM 257 NZ LYS A 16 6.815 -18.819 -1.697 1.00 0.00 N ATOM 0 H LYS A 16 5.194 -13.861 -4.674 1.00 0.00 H new ATOM 0 HA LYS A 16 2.937 -15.389 -5.577 1.00 0.00 H new ATOM 0 HB2 LYS A 16 3.733 -14.800 -2.746 1.00 0.00 H new ATOM 0 HB3 LYS A 16 2.785 -16.139 -3.362 1.00 0.00 H new ATOM 0 HG2 LYS A 16 4.806 -16.882 -4.710 1.00 0.00 H new ATOM 0 HG3 LYS A 16 5.737 -15.606 -3.952 1.00 0.00 H new ATOM 0 HD2 LYS A 16 5.187 -16.612 -1.688 1.00 0.00 H new ATOM 0 HD3 LYS A 16 4.377 -17.933 -2.508 1.00 0.00 H new ATOM 0 HE2 LYS A 16 6.509 -18.450 -3.747 1.00 0.00 H new ATOM 0 HE3 LYS A 16 7.312 -17.154 -2.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 7.844 -18.883 -1.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 6.374 -18.464 -0.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 6.435 -19.762 -1.918 1.00 0.00 H new ATOM 271 N VAL A 17 2.334 -12.431 -4.229 1.00 0.00 N ATOM 272 CA VAL A 17 1.300 -11.383 -4.175 1.00 0.00 C ATOM 273 C VAL A 17 0.753 -11.220 -5.599 1.00 0.00 C ATOM 274 O VAL A 17 -0.430 -11.445 -5.860 1.00 0.00 O ATOM 275 CB VAL A 17 1.858 -10.057 -3.605 1.00 0.00 C ATOM 276 CG1 VAL A 17 0.962 -8.824 -3.764 1.00 0.00 C ATOM 277 CG2 VAL A 17 2.414 -10.131 -2.183 1.00 0.00 C ATOM 0 H VAL A 17 3.248 -12.128 -3.894 1.00 0.00 H new ATOM 0 HA VAL A 17 0.497 -11.670 -3.496 1.00 0.00 H new ATOM 0 HB VAL A 17 2.706 -9.910 -4.273 1.00 0.00 H new ATOM 0 HG11 VAL A 17 1.457 -7.956 -3.328 1.00 0.00 H new ATOM 0 HG12 VAL A 17 0.777 -8.642 -4.823 1.00 0.00 H new ATOM 0 HG13 VAL A 17 0.014 -8.995 -3.255 1.00 0.00 H new ATOM 0 HG21 VAL A 17 2.778 -9.148 -1.883 1.00 0.00 H new ATOM 0 HG22 VAL A 17 1.626 -10.450 -1.500 1.00 0.00 H new ATOM 0 HG23 VAL A 17 3.235 -10.848 -2.150 1.00 0.00 H new ATOM 287 N GLU A 18 1.632 -10.851 -6.534 1.00 0.00 N ATOM 288 CA GLU A 18 1.271 -10.619 -7.924 1.00 0.00 C ATOM 289 C GLU A 18 0.669 -11.839 -8.621 1.00 0.00 C ATOM 290 O GLU A 18 -0.061 -11.674 -9.598 1.00 0.00 O ATOM 291 CB GLU A 18 2.443 -10.020 -8.708 1.00 0.00 C ATOM 292 CG GLU A 18 2.742 -8.617 -8.162 1.00 0.00 C ATOM 293 CD GLU A 18 3.831 -7.878 -8.932 1.00 0.00 C ATOM 294 OE1 GLU A 18 4.536 -8.533 -9.728 1.00 0.00 O ATOM 295 OE2 GLU A 18 3.950 -6.658 -8.680 1.00 0.00 O ATOM 0 H GLU A 18 2.623 -10.705 -6.340 1.00 0.00 H new ATOM 0 HA GLU A 18 0.467 -9.883 -7.908 1.00 0.00 H new ATOM 0 HB2 GLU A 18 3.323 -10.656 -8.615 1.00 0.00 H new ATOM 0 HB3 GLU A 18 2.199 -9.967 -9.769 1.00 0.00 H new ATOM 0 HG2 GLU A 18 1.827 -8.025 -8.186 1.00 0.00 H new ATOM 0 HG3 GLU A 18 3.041 -8.700 -7.117 1.00 0.00 H new ATOM 302 N ALA A 19 0.986 -13.062 -8.187 1.00 0.00 N ATOM 303 CA ALA A 19 0.323 -14.227 -8.753 1.00 0.00 C ATOM 304 C ALA A 19 -1.196 -14.082 -8.618 1.00 0.00 C ATOM 305 O ALA A 19 -1.937 -14.561 -9.472 1.00 0.00 O ATOM 306 CB ALA A 19 0.843 -15.521 -8.127 1.00 0.00 C ATOM 0 H ALA A 19 1.679 -13.263 -7.466 1.00 0.00 H new ATOM 0 HA ALA A 19 0.558 -14.286 -9.816 1.00 0.00 H new ATOM 0 HB1 ALA A 19 0.328 -16.373 -8.571 1.00 0.00 H new ATOM 0 HB2 ALA A 19 1.914 -15.609 -8.310 1.00 0.00 H new ATOM 0 HB3 ALA A 19 0.659 -15.505 -7.053 1.00 0.00 H new ATOM 312 N ASP A 20 -1.656 -13.358 -7.591 1.00 0.00 N ATOM 313 CA ASP A 20 -3.054 -13.028 -7.406 1.00 0.00 C ATOM 314 C ASP A 20 -3.145 -11.549 -7.018 1.00 0.00 C ATOM 315 O ASP A 20 -3.643 -11.217 -5.936 1.00 0.00 O ATOM 316 CB ASP A 20 -3.685 -13.992 -6.392 1.00 0.00 C ATOM 317 CG ASP A 20 -5.166 -13.707 -6.147 1.00 0.00 C ATOM 318 OD1 ASP A 20 -5.770 -12.966 -6.955 1.00 0.00 O ATOM 319 OD2 ASP A 20 -5.664 -14.227 -5.124 1.00 0.00 O ATOM 0 H ASP A 20 -1.050 -12.985 -6.860 1.00 0.00 H new ATOM 0 HA ASP A 20 -3.631 -13.156 -8.322 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -3.571 -15.015 -6.750 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -3.145 -13.923 -5.448 1.00 0.00 H new ATOM 324 N VAL A 21 -2.720 -10.673 -7.949 1.00 0.00 N ATOM 325 CA VAL A 21 -2.687 -9.222 -7.763 1.00 0.00 C ATOM 326 C VAL A 21 -4.047 -8.779 -7.221 1.00 0.00 C ATOM 327 O VAL A 21 -4.137 -8.198 -6.152 1.00 0.00 O ATOM 328 CB VAL A 21 -2.388 -8.445 -9.072 1.00 0.00 C ATOM 329 CG1 VAL A 21 -1.788 -7.081 -8.705 1.00 0.00 C ATOM 330 CG2 VAL A 21 -1.464 -9.098 -10.105 1.00 0.00 C ATOM 0 H VAL A 21 -2.385 -10.967 -8.867 1.00 0.00 H new ATOM 0 HA VAL A 21 -1.878 -8.996 -7.069 1.00 0.00 H new ATOM 0 HB VAL A 21 -3.358 -8.399 -9.567 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -1.572 -6.522 -9.615 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -2.499 -6.523 -8.096 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -0.866 -7.229 -8.142 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -1.351 -8.435 -10.963 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -0.487 -9.280 -9.656 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -1.895 -10.044 -10.432 1.00 0.00 H new ATOM 340 N ALA A 22 -5.113 -9.090 -7.966 1.00 0.00 N ATOM 341 CA ALA A 22 -6.503 -8.807 -7.641 1.00 0.00 C ATOM 342 C ALA A 22 -6.864 -9.189 -6.209 1.00 0.00 C ATOM 343 O ALA A 22 -7.409 -8.373 -5.470 1.00 0.00 O ATOM 344 CB ALA A 22 -7.402 -9.576 -8.619 1.00 0.00 C ATOM 0 H ALA A 22 -5.017 -9.572 -8.860 1.00 0.00 H new ATOM 0 HA ALA A 22 -6.654 -7.731 -7.730 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -8.448 -9.374 -8.388 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -7.187 -9.256 -9.639 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -7.210 -10.645 -8.526 1.00 0.00 H new ATOM 350 N GLY A 23 -6.599 -10.441 -5.839 1.00 0.00 N ATOM 351 CA GLY A 23 -6.950 -10.960 -4.527 1.00 0.00 C ATOM 352 C GLY A 23 -6.240 -10.154 -3.454 1.00 0.00 C ATOM 353 O GLY A 23 -6.889 -9.549 -2.603 1.00 0.00 O ATOM 0 H GLY A 23 -6.135 -11.120 -6.443 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -8.029 -10.908 -4.381 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -6.669 -12.010 -4.453 1.00 0.00 H new ATOM 357 N HIS A 24 -4.913 -10.027 -3.582 1.00 0.00 N ATOM 358 CA HIS A 24 -4.126 -9.257 -2.628 1.00 0.00 C ATOM 359 C HIS A 24 -4.690 -7.836 -2.565 1.00 0.00 C ATOM 360 O HIS A 24 -4.964 -7.305 -1.500 1.00 0.00 O ATOM 361 CB HIS A 24 -2.631 -9.257 -3.010 1.00 0.00 C ATOM 362 CG HIS A 24 -1.975 -10.593 -2.772 1.00 0.00 C ATOM 363 ND1 HIS A 24 -2.257 -11.759 -3.451 1.00 0.00 N ATOM 364 CD2 HIS A 24 -1.079 -10.893 -1.774 1.00 0.00 C ATOM 365 CE1 HIS A 24 -1.617 -12.763 -2.816 1.00 0.00 C ATOM 366 NE2 HIS A 24 -0.899 -12.288 -1.774 1.00 0.00 N ATOM 0 H HIS A 24 -4.370 -10.448 -4.336 1.00 0.00 H new ATOM 0 HA HIS A 24 -4.195 -9.715 -1.641 1.00 0.00 H new ATOM 0 HB2 HIS A 24 -2.528 -8.987 -4.061 1.00 0.00 H new ATOM 0 HB3 HIS A 24 -2.112 -8.493 -2.432 1.00 0.00 H new ATOM 0 HD1 HIS A 24 -2.842 -11.847 -4.282 1.00 0.00 H new ATOM 0 HD2 HIS A 24 -0.601 -10.187 -1.111 1.00 0.00 H new ATOM 0 HE1 HIS A 24 -1.671 -13.803 -3.101 1.00 0.00 H new ATOM 374 N GLY A 25 -4.888 -7.231 -3.732 1.00 0.00 N ATOM 375 CA GLY A 25 -5.390 -5.880 -3.917 1.00 0.00 C ATOM 376 C GLY A 25 -6.667 -5.688 -3.108 1.00 0.00 C ATOM 377 O GLY A 25 -6.736 -4.798 -2.257 1.00 0.00 O ATOM 0 H GLY A 25 -4.691 -7.697 -4.618 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -4.638 -5.157 -3.603 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -5.587 -5.697 -4.973 1.00 0.00 H new ATOM 381 N GLN A 26 -7.641 -6.587 -3.297 1.00 0.00 N ATOM 382 CA GLN A 26 -8.882 -6.493 -2.556 1.00 0.00 C ATOM 383 C GLN A 26 -8.555 -6.645 -1.076 1.00 0.00 C ATOM 384 O GLN A 26 -8.765 -5.708 -0.316 1.00 0.00 O ATOM 385 CB GLN A 26 -9.917 -7.555 -2.963 1.00 0.00 C ATOM 386 CG GLN A 26 -10.513 -7.318 -4.352 1.00 0.00 C ATOM 387 CD GLN A 26 -11.510 -8.414 -4.714 1.00 0.00 C ATOM 388 OE1 GLN A 26 -11.184 -9.316 -5.479 1.00 0.00 O ATOM 389 NE2 GLN A 26 -12.729 -8.357 -4.184 1.00 0.00 N ATOM 0 H GLN A 26 -7.586 -7.371 -3.947 1.00 0.00 H new ATOM 0 HA GLN A 26 -9.333 -5.525 -2.777 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -9.447 -8.538 -2.940 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -10.721 -7.569 -2.228 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -11.009 -6.348 -4.378 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -9.715 -7.288 -5.094 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -12.975 -7.596 -3.551 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -13.418 -9.074 -4.411 1.00 0.00 H new ATOM 398 N ASP A 27 -8.030 -7.819 -0.694 1.00 0.00 N ATOM 399 CA ASP A 27 -7.683 -8.214 0.669 1.00 0.00 C ATOM 400 C ASP A 27 -7.060 -7.056 1.447 1.00 0.00 C ATOM 401 O ASP A 27 -7.525 -6.699 2.521 1.00 0.00 O ATOM 402 CB ASP A 27 -6.778 -9.461 0.644 1.00 0.00 C ATOM 403 CG ASP A 27 -6.618 -10.128 2.010 1.00 0.00 C ATOM 404 OD1 ASP A 27 -7.135 -9.578 3.006 1.00 0.00 O ATOM 405 OD2 ASP A 27 -5.981 -11.203 2.028 1.00 0.00 O ATOM 0 H ASP A 27 -7.827 -8.556 -1.370 1.00 0.00 H new ATOM 0 HA ASP A 27 -8.597 -8.478 1.200 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -7.191 -10.185 -0.059 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -5.794 -9.178 0.269 1.00 0.00 H new ATOM 410 N ILE A 28 -6.085 -6.371 0.853 1.00 0.00 N ATOM 411 CA ILE A 28 -5.398 -5.263 1.503 1.00 0.00 C ATOM 412 C ILE A 28 -6.395 -4.156 1.874 1.00 0.00 C ATOM 413 O ILE A 28 -6.512 -3.774 3.036 1.00 0.00 O ATOM 414 CB ILE A 28 -4.244 -4.757 0.612 1.00 0.00 C ATOM 415 CG1 ILE A 28 -3.140 -5.830 0.588 1.00 0.00 C ATOM 416 CG2 ILE A 28 -3.666 -3.440 1.148 1.00 0.00 C ATOM 417 CD1 ILE A 28 -2.075 -5.568 -0.468 1.00 0.00 C ATOM 0 H ILE A 28 -5.751 -6.570 -0.090 1.00 0.00 H new ATOM 0 HA ILE A 28 -4.952 -5.607 2.436 1.00 0.00 H new ATOM 0 HB ILE A 28 -4.625 -4.573 -0.392 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -2.667 -5.878 1.569 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -3.593 -6.804 0.405 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -2.855 -3.108 0.500 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -4.448 -2.681 1.168 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -3.284 -3.594 2.157 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -1.326 -6.359 -0.434 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -2.538 -5.549 -1.455 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -1.597 -4.608 -0.273 1.00 0.00 H new ATOM 429 N LEU A 29 -7.174 -3.676 0.903 1.00 0.00 N ATOM 430 CA LEU A 29 -8.133 -2.625 1.070 1.00 0.00 C ATOM 431 C LEU A 29 -9.270 -3.097 1.981 1.00 0.00 C ATOM 432 O LEU A 29 -9.712 -2.353 2.848 1.00 0.00 O ATOM 433 CB LEU A 29 -8.593 -2.249 -0.338 1.00 0.00 C ATOM 434 CG LEU A 29 -7.608 -1.385 -1.153 1.00 0.00 C ATOM 435 CD1 LEU A 29 -8.291 -0.884 -2.433 1.00 0.00 C ATOM 436 CD2 LEU A 29 -7.108 -0.132 -0.414 1.00 0.00 C ATOM 0 H LEU A 29 -7.139 -4.034 -0.051 1.00 0.00 H new ATOM 0 HA LEU A 29 -7.719 -1.744 1.560 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -8.789 -3.166 -0.894 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -9.540 -1.714 -0.261 1.00 0.00 H new ATOM 0 HG LEU A 29 -6.757 -2.037 -1.349 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -7.591 -0.275 -3.004 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -8.605 -1.736 -3.035 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -9.163 -0.285 -2.170 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -6.421 0.419 -1.056 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -7.956 0.504 -0.160 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -6.592 -0.430 0.499 1.00 0.00 H new ATOM 448 N ILE A 30 -9.673 -4.365 1.874 1.00 0.00 N ATOM 449 CA ILE A 30 -10.710 -4.970 2.667 1.00 0.00 C ATOM 450 C ILE A 30 -10.260 -4.923 4.132 1.00 0.00 C ATOM 451 O ILE A 30 -11.005 -4.499 5.015 1.00 0.00 O ATOM 452 CB ILE A 30 -10.940 -6.394 2.085 1.00 0.00 C ATOM 453 CG1 ILE A 30 -12.227 -6.436 1.261 1.00 0.00 C ATOM 454 CG2 ILE A 30 -10.818 -7.506 3.114 1.00 0.00 C ATOM 455 CD1 ILE A 30 -12.415 -7.757 0.502 1.00 0.00 C ATOM 0 H ILE A 30 -9.261 -5.012 1.202 1.00 0.00 H new ATOM 0 HA ILE A 30 -11.670 -4.455 2.634 1.00 0.00 H new ATOM 0 HB ILE A 30 -10.119 -6.603 1.400 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -13.079 -6.280 1.922 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -12.221 -5.612 0.548 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -10.991 -8.468 2.632 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -9.818 -7.492 3.548 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -11.557 -7.356 3.901 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -13.347 -7.723 -0.063 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -11.580 -7.905 -0.183 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -12.452 -8.583 1.212 1.00 0.00 H new ATOM 467 N ARG A 31 -9.008 -5.321 4.373 1.00 0.00 N ATOM 468 CA ARG A 31 -8.423 -5.372 5.699 1.00 0.00 C ATOM 469 C ARG A 31 -8.302 -3.956 6.238 1.00 0.00 C ATOM 470 O ARG A 31 -8.733 -3.688 7.353 1.00 0.00 O ATOM 471 CB ARG A 31 -7.075 -6.108 5.657 1.00 0.00 C ATOM 472 CG ARG A 31 -6.489 -6.426 7.042 1.00 0.00 C ATOM 473 CD ARG A 31 -7.409 -7.340 7.864 1.00 0.00 C ATOM 474 NE ARG A 31 -6.647 -8.146 8.829 1.00 0.00 N ATOM 475 CZ ARG A 31 -6.359 -7.841 10.103 1.00 0.00 C ATOM 476 NH1 ARG A 31 -6.720 -6.675 10.651 1.00 0.00 N ATOM 477 NH2 ARG A 31 -5.696 -8.732 10.846 1.00 0.00 N ATOM 0 H ARG A 31 -8.370 -5.620 3.636 1.00 0.00 H new ATOM 0 HA ARG A 31 -9.063 -5.936 6.378 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -7.199 -7.039 5.105 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -6.359 -5.501 5.102 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -5.517 -6.904 6.922 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -6.322 -5.497 7.586 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -8.145 -6.735 8.394 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -7.961 -7.999 7.194 1.00 0.00 H new ATOM 0 HE ARG A 31 -6.296 -9.042 8.490 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -7.230 -5.987 10.097 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -6.485 -6.474 11.623 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -5.418 -9.626 10.442 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -5.468 -8.518 11.817 1.00 0.00 H new ATOM 491 N LEU A 32 -7.803 -3.028 5.420 1.00 0.00 N ATOM 492 CA LEU A 32 -7.625 -1.640 5.764 1.00 0.00 C ATOM 493 C LEU A 32 -8.978 -1.080 6.233 1.00 0.00 C ATOM 494 O LEU A 32 -9.107 -0.674 7.389 1.00 0.00 O ATOM 495 CB LEU A 32 -7.026 -0.978 4.513 1.00 0.00 C ATOM 496 CG LEU A 32 -6.940 0.539 4.562 1.00 0.00 C ATOM 497 CD1 LEU A 32 -5.960 1.006 5.640 1.00 0.00 C ATOM 498 CD2 LEU A 32 -6.524 1.087 3.192 1.00 0.00 C ATOM 0 H LEU A 32 -7.505 -3.243 4.468 1.00 0.00 H new ATOM 0 HA LEU A 32 -6.944 -1.453 6.594 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -6.024 -1.378 4.354 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -7.624 -1.264 3.648 1.00 0.00 H new ATOM 0 HG LEU A 32 -7.927 0.926 4.817 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -5.921 2.095 5.649 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -6.292 0.646 6.614 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -4.967 0.610 5.426 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -6.465 2.174 3.238 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -5.550 0.682 2.919 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -7.261 0.795 2.444 1.00 0.00 H new ATOM 510 N PHE A 33 -9.993 -1.112 5.362 1.00 0.00 N ATOM 511 CA PHE A 33 -11.351 -0.682 5.673 1.00 0.00 C ATOM 512 C PHE A 33 -11.881 -1.321 6.958 1.00 0.00 C ATOM 513 O PHE A 33 -12.394 -0.625 7.829 1.00 0.00 O ATOM 514 CB PHE A 33 -12.328 -1.033 4.534 1.00 0.00 C ATOM 515 CG PHE A 33 -12.067 -0.537 3.119 1.00 0.00 C ATOM 516 CD1 PHE A 33 -11.245 0.575 2.837 1.00 0.00 C ATOM 517 CD2 PHE A 33 -12.818 -1.119 2.082 1.00 0.00 C ATOM 518 CE1 PHE A 33 -11.136 1.056 1.515 1.00 0.00 C ATOM 519 CE2 PHE A 33 -12.723 -0.624 0.773 1.00 0.00 C ATOM 520 CZ PHE A 33 -11.866 0.444 0.478 1.00 0.00 C ATOM 0 H PHE A 33 -9.886 -1.445 4.404 1.00 0.00 H new ATOM 0 HA PHE A 33 -11.295 0.399 5.802 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -12.393 -2.120 4.488 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -13.312 -0.667 4.828 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -10.699 1.058 3.634 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -13.472 -1.952 2.295 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -10.492 1.895 1.298 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -13.315 -1.069 -0.013 1.00 0.00 H new ATOM 0 HZ PHE A 33 -11.766 0.796 -0.538 1.00 0.00 H new ATOM 530 N LYS A 34 -11.837 -2.654 7.044 1.00 0.00 N ATOM 531 CA LYS A 34 -12.412 -3.374 8.174 1.00 0.00 C ATOM 532 C LYS A 34 -11.690 -3.058 9.487 1.00 0.00 C ATOM 533 O LYS A 34 -12.320 -2.997 10.540 1.00 0.00 O ATOM 534 CB LYS A 34 -12.421 -4.884 7.874 1.00 0.00 C ATOM 535 CG LYS A 34 -13.169 -5.672 8.958 1.00 0.00 C ATOM 536 CD LYS A 34 -13.245 -7.154 8.576 1.00 0.00 C ATOM 537 CE LYS A 34 -14.030 -7.967 9.611 1.00 0.00 C ATOM 538 NZ LYS A 34 -13.383 -7.957 10.936 1.00 0.00 N ATOM 0 H LYS A 34 -11.407 -3.254 6.340 1.00 0.00 H new ATOM 0 HA LYS A 34 -13.440 -3.038 8.308 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -12.891 -5.060 6.906 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -11.396 -5.247 7.802 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -12.660 -5.561 9.915 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -14.174 -5.269 9.083 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -13.719 -7.254 7.599 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -12.237 -7.558 8.484 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -15.039 -7.563 9.698 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -14.127 -8.996 9.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -13.871 -8.625 11.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -12.387 -8.238 10.838 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -13.434 -7.000 11.340 1.00 0.00 H new ATOM 552 N SER A 35 -10.366 -2.919 9.439 1.00 0.00 N ATOM 553 CA SER A 35 -9.544 -2.703 10.620 1.00 0.00 C ATOM 554 C SER A 35 -9.536 -1.244 11.066 1.00 0.00 C ATOM 555 O SER A 35 -9.426 -0.978 12.263 1.00 0.00 O ATOM 556 CB SER A 35 -8.111 -3.172 10.348 1.00 0.00 C ATOM 557 OG SER A 35 -8.120 -4.493 9.843 1.00 0.00 O ATOM 0 H SER A 35 -9.833 -2.954 8.570 1.00 0.00 H new ATOM 0 HA SER A 35 -9.981 -3.287 11.430 1.00 0.00 H new ATOM 0 HB2 SER A 35 -7.631 -2.504 9.633 1.00 0.00 H new ATOM 0 HB3 SER A 35 -7.526 -3.129 11.266 1.00 0.00 H new ATOM 0 HG SER A 35 -8.473 -4.491 8.929 1.00 0.00 H new ATOM 563 N HIS A 36 -9.601 -0.302 10.121 1.00 0.00 N ATOM 564 CA HIS A 36 -9.490 1.113 10.422 1.00 0.00 C ATOM 565 C HIS A 36 -10.566 1.934 9.707 1.00 0.00 C ATOM 566 O HIS A 36 -10.666 1.840 8.484 1.00 0.00 O ATOM 567 CB HIS A 36 -8.110 1.599 9.972 1.00 0.00 C ATOM 568 CG HIS A 36 -6.965 0.886 10.640 1.00 0.00 C ATOM 569 ND1 HIS A 36 -6.442 1.198 11.879 1.00 0.00 N ATOM 570 CD2 HIS A 36 -6.190 -0.091 10.080 1.00 0.00 C ATOM 571 CE1 HIS A 36 -5.378 0.402 12.082 1.00 0.00 C ATOM 572 NE2 HIS A 36 -5.199 -0.376 10.998 1.00 0.00 N ATOM 0 H HIS A 36 -9.732 -0.506 9.130 1.00 0.00 H new ATOM 0 HA HIS A 36 -9.625 1.248 11.495 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -8.025 1.471 8.893 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -8.028 2.667 10.174 1.00 0.00 H new ATOM 0 HD2 HIS A 36 -6.326 -0.549 9.111 1.00 0.00 H new ATOM 0 HE1 HIS A 36 -4.765 0.389 12.971 1.00 0.00 H new ATOM 0 HE2 HIS A 36 -4.455 -1.062 10.875 1.00 0.00 H new ATOM 581 N PRO A 37 -11.333 2.771 10.429 1.00 0.00 N ATOM 582 CA PRO A 37 -12.309 3.667 9.829 1.00 0.00 C ATOM 583 C PRO A 37 -11.553 4.837 9.184 1.00 0.00 C ATOM 584 O PRO A 37 -10.322 4.831 9.158 1.00 0.00 O ATOM 585 CB PRO A 37 -13.195 4.117 10.995 1.00 0.00 C ATOM 586 CG PRO A 37 -12.219 4.143 12.169 1.00 0.00 C ATOM 587 CD PRO A 37 -11.284 2.970 11.870 1.00 0.00 C ATOM 0 HA PRO A 37 -12.916 3.211 9.047 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -13.636 5.097 10.813 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -14.018 3.424 11.168 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -11.677 5.087 12.221 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -12.732 4.017 13.122 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -10.268 3.188 12.199 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -11.604 2.072 12.398 1.00 0.00 H new ATOM 595 N GLU A 38 -12.265 5.845 8.664 1.00 0.00 N ATOM 596 CA GLU A 38 -11.699 6.998 7.961 1.00 0.00 C ATOM 597 C GLU A 38 -11.286 6.598 6.543 1.00 0.00 C ATOM 598 O GLU A 38 -11.675 7.241 5.574 1.00 0.00 O ATOM 599 CB GLU A 38 -10.540 7.672 8.707 1.00 0.00 C ATOM 600 CG GLU A 38 -10.870 8.048 10.156 1.00 0.00 C ATOM 601 CD GLU A 38 -9.663 8.701 10.823 1.00 0.00 C ATOM 602 OE1 GLU A 38 -8.702 7.953 11.110 1.00 0.00 O ATOM 603 OE2 GLU A 38 -9.721 9.933 11.028 1.00 0.00 O ATOM 0 H GLU A 38 -13.283 5.879 8.724 1.00 0.00 H new ATOM 0 HA GLU A 38 -12.487 7.750 7.912 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -9.680 7.003 8.702 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -10.247 8.572 8.166 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -11.719 8.731 10.177 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -11.163 7.158 10.712 1.00 0.00 H new ATOM 610 N THR A 39 -10.563 5.484 6.422 1.00 0.00 N ATOM 611 CA THR A 39 -10.043 4.921 5.187 1.00 0.00 C ATOM 612 C THR A 39 -11.076 4.977 4.050 1.00 0.00 C ATOM 613 O THR A 39 -10.791 5.434 2.947 1.00 0.00 O ATOM 614 CB THR A 39 -9.654 3.458 5.452 1.00 0.00 C ATOM 615 OG1 THR A 39 -10.796 2.780 5.934 1.00 0.00 O ATOM 616 CG2 THR A 39 -8.515 3.304 6.464 1.00 0.00 C ATOM 0 H THR A 39 -10.313 4.921 7.235 1.00 0.00 H new ATOM 0 HA THR A 39 -9.180 5.508 4.873 1.00 0.00 H new ATOM 0 HB THR A 39 -9.294 3.037 4.513 1.00 0.00 H new ATOM 0 HG1 THR A 39 -10.669 2.557 6.880 1.00 0.00 H new ATOM 0 HG21 THR A 39 -8.292 2.246 6.603 1.00 0.00 H new ATOM 0 HG22 THR A 39 -7.627 3.816 6.093 1.00 0.00 H new ATOM 0 HG23 THR A 39 -8.814 3.740 7.417 1.00 0.00 H new ATOM 624 N LEU A 40 -12.271 4.457 4.318 1.00 0.00 N ATOM 625 CA LEU A 40 -13.376 4.380 3.373 1.00 0.00 C ATOM 626 C LEU A 40 -13.757 5.777 2.876 1.00 0.00 C ATOM 627 O LEU A 40 -14.025 5.975 1.692 1.00 0.00 O ATOM 628 CB LEU A 40 -14.555 3.668 4.058 1.00 0.00 C ATOM 629 CG LEU A 40 -15.545 3.022 3.078 1.00 0.00 C ATOM 630 CD1 LEU A 40 -14.990 1.697 2.540 1.00 0.00 C ATOM 631 CD2 LEU A 40 -16.875 2.750 3.787 1.00 0.00 C ATOM 0 H LEU A 40 -12.502 4.065 5.231 1.00 0.00 H new ATOM 0 HA LEU A 40 -13.083 3.806 2.494 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -14.165 2.899 4.725 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -15.090 4.387 4.679 1.00 0.00 H new ATOM 0 HG LEU A 40 -15.698 3.710 2.246 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -15.707 1.256 1.848 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -14.050 1.881 2.020 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -14.818 1.011 3.369 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -17.573 2.292 3.087 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -16.708 2.076 4.627 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -17.291 3.689 4.152 1.00 0.00 H new ATOM 643 N GLU A 41 -13.760 6.750 3.791 1.00 0.00 N ATOM 644 CA GLU A 41 -14.065 8.141 3.510 1.00 0.00 C ATOM 645 C GLU A 41 -12.987 8.797 2.638 1.00 0.00 C ATOM 646 O GLU A 41 -13.277 9.766 1.943 1.00 0.00 O ATOM 647 CB GLU A 41 -14.301 8.913 4.817 1.00 0.00 C ATOM 648 CG GLU A 41 -15.438 8.307 5.661 1.00 0.00 C ATOM 649 CD GLU A 41 -14.950 7.357 6.757 1.00 0.00 C ATOM 650 OE1 GLU A 41 -14.433 6.273 6.405 1.00 0.00 O ATOM 651 OE2 GLU A 41 -15.091 7.732 7.940 1.00 0.00 O ATOM 0 H GLU A 41 -13.543 6.579 4.773 1.00 0.00 H new ATOM 0 HA GLU A 41 -14.988 8.175 2.931 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -13.382 8.920 5.403 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -14.539 9.951 4.585 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -16.008 9.115 6.120 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -16.120 7.769 5.003 1.00 0.00 H new ATOM 658 N LYS A 42 -11.765 8.249 2.599 1.00 0.00 N ATOM 659 CA LYS A 42 -10.696 8.833 1.789 1.00 0.00 C ATOM 660 C LYS A 42 -11.115 8.812 0.309 1.00 0.00 C ATOM 661 O LYS A 42 -10.982 9.801 -0.411 1.00 0.00 O ATOM 662 CB LYS A 42 -9.372 8.082 2.013 1.00 0.00 C ATOM 663 CG LYS A 42 -8.915 8.044 3.480 1.00 0.00 C ATOM 664 CD LYS A 42 -8.566 9.404 4.089 1.00 0.00 C ATOM 665 CE LYS A 42 -7.469 10.150 3.323 1.00 0.00 C ATOM 666 NZ LYS A 42 -6.269 9.331 3.080 1.00 0.00 N ATOM 0 H LYS A 42 -11.497 7.411 3.114 1.00 0.00 H new ATOM 0 HA LYS A 42 -10.532 9.868 2.091 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -9.480 7.060 1.650 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -8.593 8.552 1.413 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -9.704 7.588 4.078 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -8.042 7.395 3.555 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -9.463 10.022 4.118 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -8.245 9.260 5.121 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -7.869 10.489 2.367 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -7.185 11.041 3.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -5.579 9.881 2.529 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -5.846 9.056 3.990 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -6.533 8.477 2.549 1.00 0.00 H new ATOM 680 N PHE A 43 -11.666 7.683 -0.143 1.00 0.00 N ATOM 681 CA PHE A 43 -12.169 7.494 -1.501 1.00 0.00 C ATOM 682 C PHE A 43 -13.583 8.061 -1.592 1.00 0.00 C ATOM 683 O PHE A 43 -14.495 7.333 -1.986 1.00 0.00 O ATOM 684 CB PHE A 43 -12.202 5.986 -1.819 1.00 0.00 C ATOM 685 CG PHE A 43 -10.926 5.236 -1.506 1.00 0.00 C ATOM 686 CD1 PHE A 43 -10.652 4.815 -0.192 1.00 0.00 C ATOM 687 CD2 PHE A 43 -9.972 5.030 -2.506 1.00 0.00 C ATOM 688 CE1 PHE A 43 -9.388 4.335 0.150 1.00 0.00 C ATOM 689 CE2 PHE A 43 -8.692 4.592 -2.157 1.00 0.00 C ATOM 690 CZ PHE A 43 -8.378 4.259 -0.827 1.00 0.00 C ATOM 0 H PHE A 43 -11.776 6.855 0.442 1.00 0.00 H new ATOM 0 HA PHE A 43 -11.522 8.006 -2.213 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -13.019 5.530 -1.260 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -12.430 5.859 -2.877 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -11.427 4.864 0.558 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -10.222 5.208 -3.541 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -9.185 4.022 1.163 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -7.932 4.508 -2.920 1.00 0.00 H new ATOM 0 HZ PHE A 43 -7.378 3.950 -0.560 1.00 0.00 H new ATOM 700 N ASP A 44 -13.795 9.299 -1.120 1.00 0.00 N ATOM 701 CA ASP A 44 -15.092 9.959 -0.978 1.00 0.00 C ATOM 702 C ASP A 44 -15.913 9.211 0.084 1.00 0.00 C ATOM 703 O ASP A 44 -16.103 9.698 1.196 1.00 0.00 O ATOM 704 CB ASP A 44 -15.788 10.106 -2.339 1.00 0.00 C ATOM 705 CG ASP A 44 -17.238 10.545 -2.171 1.00 0.00 C ATOM 706 OD1 ASP A 44 -17.443 11.752 -1.921 1.00 0.00 O ATOM 707 OD2 ASP A 44 -18.115 9.660 -2.280 1.00 0.00 O ATOM 0 H ASP A 44 -13.025 9.893 -0.813 1.00 0.00 H new ATOM 0 HA ASP A 44 -14.970 10.982 -0.623 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -15.253 10.835 -2.948 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -15.752 9.157 -2.873 1.00 0.00 H new ATOM 712 N ARG A 45 -16.319 7.980 -0.221 1.00 0.00 N ATOM 713 CA ARG A 45 -17.024 7.081 0.676 1.00 0.00 C ATOM 714 C ARG A 45 -16.892 5.617 0.223 1.00 0.00 C ATOM 715 O ARG A 45 -17.584 4.763 0.769 1.00 0.00 O ATOM 716 CB ARG A 45 -18.512 7.490 0.710 1.00 0.00 C ATOM 717 CG ARG A 45 -19.185 7.139 2.049 1.00 0.00 C ATOM 718 CD ARG A 45 -19.312 8.338 2.997 1.00 0.00 C ATOM 719 NE ARG A 45 -18.088 9.144 3.024 1.00 0.00 N ATOM 720 CZ ARG A 45 -17.852 10.205 3.803 1.00 0.00 C ATOM 721 NH1 ARG A 45 -18.657 10.503 4.827 1.00 0.00 N ATOM 722 NH2 ARG A 45 -16.793 10.964 3.514 1.00 0.00 N ATOM 0 H ARG A 45 -16.156 7.569 -1.140 1.00 0.00 H new ATOM 0 HA ARG A 45 -16.585 7.157 1.671 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -18.596 8.562 0.534 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -19.042 6.992 -0.102 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -20.177 6.733 1.853 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -18.611 6.354 2.542 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -20.150 8.961 2.685 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -19.536 7.983 4.003 1.00 0.00 H new ATOM 0 HE ARG A 45 -17.342 8.868 2.385 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -19.468 9.917 5.026 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -18.461 11.317 5.410 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -16.196 10.726 2.722 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -16.581 11.782 4.085 1.00 0.00 H new ATOM 736 N PHE A 46 -16.118 5.332 -0.840 1.00 0.00 N ATOM 737 CA PHE A 46 -16.057 4.026 -1.496 1.00 0.00 C ATOM 738 C PHE A 46 -17.519 3.577 -1.751 1.00 0.00 C ATOM 739 O PHE A 46 -17.975 2.496 -1.372 1.00 0.00 O ATOM 740 CB PHE A 46 -15.096 3.064 -0.746 1.00 0.00 C ATOM 741 CG PHE A 46 -14.148 2.290 -1.659 1.00 0.00 C ATOM 742 CD1 PHE A 46 -14.667 1.468 -2.669 1.00 0.00 C ATOM 743 CD2 PHE A 46 -12.799 2.672 -1.732 1.00 0.00 C ATOM 744 CE1 PHE A 46 -13.893 1.125 -3.794 1.00 0.00 C ATOM 745 CE2 PHE A 46 -11.998 2.302 -2.836 1.00 0.00 C ATOM 746 CZ PHE A 46 -12.561 1.565 -3.894 1.00 0.00 C ATOM 0 H PHE A 46 -15.506 6.024 -1.272 1.00 0.00 H new ATOM 0 HA PHE A 46 -15.588 4.047 -2.480 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -14.506 3.640 -0.033 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -15.688 2.353 -0.169 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -15.676 1.092 -2.583 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -12.367 3.257 -0.933 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -14.323 0.523 -4.581 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -10.956 2.584 -2.867 1.00 0.00 H new ATOM 0 HZ PHE A 46 -11.976 1.340 -4.774 1.00 0.00 H new ATOM 756 N LYS A 47 -18.270 4.557 -2.280 1.00 0.00 N ATOM 757 CA LYS A 47 -19.710 4.612 -2.479 1.00 0.00 C ATOM 758 C LYS A 47 -20.286 3.459 -3.301 1.00 0.00 C ATOM 759 O LYS A 47 -20.465 3.582 -4.508 1.00 0.00 O ATOM 760 CB LYS A 47 -20.059 5.989 -3.071 1.00 0.00 C ATOM 761 CG LYS A 47 -21.565 6.280 -3.023 1.00 0.00 C ATOM 762 CD LYS A 47 -21.830 7.690 -3.565 1.00 0.00 C ATOM 763 CE LYS A 47 -23.319 8.049 -3.510 1.00 0.00 C ATOM 764 NZ LYS A 47 -23.809 8.169 -2.124 1.00 0.00 N ATOM 0 H LYS A 47 -17.828 5.415 -2.610 1.00 0.00 H new ATOM 0 HA LYS A 47 -20.188 4.485 -1.508 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -19.524 6.764 -2.522 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -19.715 6.035 -4.104 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -22.108 5.543 -3.615 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -21.930 6.198 -1.999 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -21.259 8.416 -2.985 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -21.478 7.756 -4.594 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -23.485 8.990 -4.035 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -23.895 7.286 -4.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -24.779 8.543 -2.130 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -23.802 7.233 -1.671 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -23.192 8.816 -1.592 1.00 0.00 H new ATOM 778 N HIS A 48 -20.598 2.358 -2.618 1.00 0.00 N ATOM 779 CA HIS A 48 -21.195 1.111 -3.107 1.00 0.00 C ATOM 780 C HIS A 48 -20.982 0.035 -2.043 1.00 0.00 C ATOM 781 O HIS A 48 -21.813 -0.858 -1.900 1.00 0.00 O ATOM 782 CB HIS A 48 -20.695 0.620 -4.486 1.00 0.00 C ATOM 783 CG HIS A 48 -19.201 0.613 -4.660 1.00 0.00 C ATOM 784 ND1 HIS A 48 -18.418 1.737 -4.806 1.00 0.00 N ATOM 785 CD2 HIS A 48 -18.380 -0.475 -4.573 1.00 0.00 C ATOM 786 CE1 HIS A 48 -17.138 1.348 -4.800 1.00 0.00 C ATOM 787 NE2 HIS A 48 -17.091 0.010 -4.645 1.00 0.00 N ATOM 0 H HIS A 48 -20.424 2.310 -1.614 1.00 0.00 H new ATOM 0 HA HIS A 48 -22.252 1.319 -3.275 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -21.069 -0.390 -4.651 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -21.132 1.252 -5.259 1.00 0.00 H new ATOM 0 HD1 HIS A 48 -18.754 2.695 -4.902 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -18.680 -1.507 -4.469 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -16.283 1.999 -4.903 1.00 0.00 H new ATOM 796 N LEU A 49 -19.884 0.116 -1.280 1.00 0.00 N ATOM 797 CA LEU A 49 -19.586 -0.858 -0.235 1.00 0.00 C ATOM 798 C LEU A 49 -20.473 -0.631 0.993 1.00 0.00 C ATOM 799 O LEU A 49 -19.997 -0.228 2.050 1.00 0.00 O ATOM 800 CB LEU A 49 -18.094 -0.802 0.118 1.00 0.00 C ATOM 801 CG LEU A 49 -17.199 -0.926 -1.121 1.00 0.00 C ATOM 802 CD1 LEU A 49 -15.744 -0.847 -0.665 1.00 0.00 C ATOM 803 CD2 LEU A 49 -17.397 -2.238 -1.875 1.00 0.00 C ATOM 0 H LEU A 49 -19.186 0.854 -1.372 1.00 0.00 H new ATOM 0 HA LEU A 49 -19.808 -1.859 -0.606 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -17.878 0.137 0.627 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -17.858 -1.605 0.816 1.00 0.00 H new ATOM 0 HG LEU A 49 -17.465 -0.118 -1.802 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -15.086 -0.933 -1.530 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -15.569 0.108 -0.170 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -15.536 -1.660 0.031 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -16.735 -2.264 -2.741 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -17.165 -3.075 -1.216 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -18.432 -2.314 -2.208 1.00 0.00 H new ATOM 815 N LYS A 50 -21.774 -0.885 0.849 1.00 0.00 N ATOM 816 CA LYS A 50 -22.738 -0.692 1.921 1.00 0.00 C ATOM 817 C LYS A 50 -22.684 -1.843 2.925 1.00 0.00 C ATOM 818 O LYS A 50 -22.683 -1.609 4.131 1.00 0.00 O ATOM 819 CB LYS A 50 -24.146 -0.519 1.335 1.00 0.00 C ATOM 820 CG LYS A 50 -24.245 0.558 0.243 1.00 0.00 C ATOM 821 CD LYS A 50 -23.685 1.919 0.689 1.00 0.00 C ATOM 822 CE LYS A 50 -23.827 2.987 -0.402 1.00 0.00 C ATOM 823 NZ LYS A 50 -25.237 3.281 -0.714 1.00 0.00 N ATOM 0 H LYS A 50 -22.185 -1.231 -0.018 1.00 0.00 H new ATOM 0 HA LYS A 50 -22.480 0.217 2.464 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -24.475 -1.472 0.921 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -24.835 -0.267 2.141 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -23.705 0.221 -0.642 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -25.289 0.678 -0.047 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -24.206 2.248 1.588 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -22.633 1.809 0.953 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -23.330 3.902 -0.079 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -23.319 2.650 -1.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -25.289 4.120 -1.327 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -25.661 2.467 -1.203 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -25.757 3.464 0.168 1.00 0.00 H new ATOM 837 N THR A 51 -22.619 -3.085 2.434 1.00 0.00 N ATOM 838 CA THR A 51 -22.588 -4.279 3.268 1.00 0.00 C ATOM 839 C THR A 51 -21.197 -4.913 3.280 1.00 0.00 C ATOM 840 O THR A 51 -20.507 -4.940 2.256 1.00 0.00 O ATOM 841 CB THR A 51 -23.643 -5.285 2.783 1.00 0.00 C ATOM 842 OG1 THR A 51 -23.421 -5.648 1.438 1.00 0.00 O ATOM 843 CG2 THR A 51 -25.055 -4.711 2.908 1.00 0.00 C ATOM 0 H THR A 51 -22.586 -3.286 1.435 1.00 0.00 H new ATOM 0 HA THR A 51 -22.823 -3.988 4.292 1.00 0.00 H new ATOM 0 HB THR A 51 -23.553 -6.167 3.417 1.00 0.00 H new ATOM 0 HG1 THR A 51 -23.384 -4.841 0.883 1.00 0.00 H new ATOM 0 HG21 THR A 51 -25.779 -5.446 2.557 1.00 0.00 H new ATOM 0 HG22 THR A 51 -25.259 -4.470 3.951 1.00 0.00 H new ATOM 0 HG23 THR A 51 -25.135 -3.807 2.305 1.00 0.00 H new ATOM 851 N GLU A 52 -20.804 -5.465 4.436 1.00 0.00 N ATOM 852 CA GLU A 52 -19.550 -6.185 4.608 1.00 0.00 C ATOM 853 C GLU A 52 -19.669 -7.541 3.907 1.00 0.00 C ATOM 854 O GLU A 52 -19.798 -8.574 4.555 1.00 0.00 O ATOM 855 CB GLU A 52 -19.243 -6.348 6.106 1.00 0.00 C ATOM 856 CG GLU A 52 -19.045 -5.004 6.823 1.00 0.00 C ATOM 857 CD GLU A 52 -17.802 -4.267 6.331 1.00 0.00 C ATOM 858 OE1 GLU A 52 -16.696 -4.735 6.681 1.00 0.00 O ATOM 859 OE2 GLU A 52 -17.979 -3.263 5.609 1.00 0.00 O ATOM 0 H GLU A 52 -21.363 -5.419 5.288 1.00 0.00 H new ATOM 0 HA GLU A 52 -18.724 -5.630 4.163 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -20.059 -6.892 6.582 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -18.344 -6.953 6.224 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -19.923 -4.377 6.666 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -18.963 -5.175 7.896 1.00 0.00 H new ATOM 866 N ALA A 53 -19.738 -7.510 2.574 1.00 0.00 N ATOM 867 CA ALA A 53 -19.862 -8.678 1.714 1.00 0.00 C ATOM 868 C ALA A 53 -19.660 -8.282 0.248 1.00 0.00 C ATOM 869 O ALA A 53 -18.950 -8.978 -0.478 1.00 0.00 O ATOM 870 CB ALA A 53 -21.232 -9.343 1.900 1.00 0.00 C ATOM 0 H ALA A 53 -19.707 -6.636 2.049 1.00 0.00 H new ATOM 0 HA ALA A 53 -19.090 -9.395 1.994 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -21.305 -10.214 1.249 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -21.347 -9.655 2.938 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -22.019 -8.633 1.646 1.00 0.00 H new ATOM 876 N GLU A 54 -20.227 -7.145 -0.191 1.00 0.00 N ATOM 877 CA GLU A 54 -20.079 -6.655 -1.563 1.00 0.00 C ATOM 878 C GLU A 54 -18.600 -6.595 -1.914 1.00 0.00 C ATOM 879 O GLU A 54 -18.189 -6.936 -3.023 1.00 0.00 O ATOM 880 CB GLU A 54 -20.710 -5.260 -1.697 1.00 0.00 C ATOM 881 CG GLU A 54 -22.239 -5.370 -1.699 1.00 0.00 C ATOM 882 CD GLU A 54 -22.905 -4.015 -1.475 1.00 0.00 C ATOM 883 OE1 GLU A 54 -22.880 -3.564 -0.306 1.00 0.00 O ATOM 884 OE2 GLU A 54 -23.437 -3.465 -2.463 1.00 0.00 O ATOM 0 H GLU A 54 -20.800 -6.543 0.400 1.00 0.00 H new ATOM 0 HA GLU A 54 -20.589 -7.333 -2.248 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -20.385 -4.625 -0.873 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -20.371 -4.786 -2.618 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -22.572 -5.786 -2.650 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -22.555 -6.063 -0.919 1.00 0.00 H new ATOM 891 N MET A 55 -17.802 -6.213 -0.914 1.00 0.00 N ATOM 892 CA MET A 55 -16.365 -6.073 -0.986 1.00 0.00 C ATOM 893 C MET A 55 -15.723 -7.257 -1.732 1.00 0.00 C ATOM 894 O MET A 55 -14.918 -7.073 -2.648 1.00 0.00 O ATOM 895 CB MET A 55 -15.837 -5.925 0.445 1.00 0.00 C ATOM 896 CG MET A 55 -16.250 -4.590 1.090 1.00 0.00 C ATOM 897 SD MET A 55 -16.542 -4.587 2.877 1.00 0.00 S ATOM 898 CE MET A 55 -15.013 -5.280 3.533 1.00 0.00 C ATOM 0 H MET A 55 -18.170 -5.984 0.010 1.00 0.00 H new ATOM 0 HA MET A 55 -16.097 -5.187 -1.561 1.00 0.00 H new ATOM 0 HB2 MET A 55 -16.209 -6.749 1.053 1.00 0.00 H new ATOM 0 HB3 MET A 55 -14.750 -6.000 0.437 1.00 0.00 H new ATOM 0 HG2 MET A 55 -15.473 -3.856 0.874 1.00 0.00 H new ATOM 0 HG3 MET A 55 -17.160 -4.245 0.599 1.00 0.00 H new ATOM 0 HE1 MET A 55 -15.029 -5.230 4.622 1.00 0.00 H new ATOM 0 HE2 MET A 55 -14.920 -6.320 3.219 1.00 0.00 H new ATOM 0 HE3 MET A 55 -14.164 -4.710 3.156 1.00 0.00 H new ATOM 908 N LYS A 56 -16.210 -8.473 -1.450 1.00 0.00 N ATOM 909 CA LYS A 56 -15.712 -9.708 -2.040 1.00 0.00 C ATOM 910 C LYS A 56 -15.701 -9.676 -3.574 1.00 0.00 C ATOM 911 O LYS A 56 -14.788 -10.225 -4.181 1.00 0.00 O ATOM 912 CB LYS A 56 -16.554 -10.882 -1.517 1.00 0.00 C ATOM 913 CG LYS A 56 -15.963 -12.246 -1.895 1.00 0.00 C ATOM 914 CD LYS A 56 -16.799 -13.363 -1.263 1.00 0.00 C ATOM 915 CE LYS A 56 -16.285 -14.737 -1.707 1.00 0.00 C ATOM 916 NZ LYS A 56 -17.042 -15.823 -1.063 1.00 0.00 N ATOM 0 H LYS A 56 -16.975 -8.621 -0.792 1.00 0.00 H new ATOM 0 HA LYS A 56 -14.671 -9.831 -1.740 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -16.633 -10.813 -0.432 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -17.565 -10.805 -1.916 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -15.948 -12.359 -2.979 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -14.930 -12.313 -1.553 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -16.757 -13.286 -0.177 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -17.844 -13.249 -1.550 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -16.367 -14.826 -2.790 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -15.228 -14.830 -1.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -16.672 -16.741 -1.382 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -16.943 -15.750 -0.030 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -18.047 -15.746 -1.321 1.00 0.00 H new ATOM 930 N ALA A 57 -16.697 -9.035 -4.196 1.00 0.00 N ATOM 931 CA ALA A 57 -16.874 -8.931 -5.648 1.00 0.00 C ATOM 932 C ALA A 57 -16.822 -7.475 -6.114 1.00 0.00 C ATOM 933 O ALA A 57 -17.312 -7.159 -7.196 1.00 0.00 O ATOM 934 CB ALA A 57 -18.222 -9.568 -6.005 1.00 0.00 C ATOM 0 H ALA A 57 -17.433 -8.554 -3.679 1.00 0.00 H new ATOM 0 HA ALA A 57 -16.062 -9.452 -6.155 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -18.381 -9.505 -7.082 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -18.222 -10.614 -5.699 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -19.023 -9.039 -5.489 1.00 0.00 H new ATOM 940 N SER A 58 -16.201 -6.580 -5.339 1.00 0.00 N ATOM 941 CA SER A 58 -16.122 -5.182 -5.733 1.00 0.00 C ATOM 942 C SER A 58 -14.983 -4.955 -6.728 1.00 0.00 C ATOM 943 O SER A 58 -13.804 -5.019 -6.384 1.00 0.00 O ATOM 944 CB SER A 58 -16.040 -4.310 -4.492 1.00 0.00 C ATOM 945 OG SER A 58 -17.252 -4.466 -3.790 1.00 0.00 O ATOM 0 H SER A 58 -15.754 -6.800 -4.449 1.00 0.00 H new ATOM 0 HA SER A 58 -17.028 -4.892 -6.265 1.00 0.00 H new ATOM 0 HB2 SER A 58 -15.195 -4.605 -3.870 1.00 0.00 H new ATOM 0 HB3 SER A 58 -15.886 -3.266 -4.765 1.00 0.00 H new ATOM 0 HG SER A 58 -17.456 -5.420 -3.697 1.00 0.00 H new ATOM 951 N GLU A 59 -15.356 -4.694 -7.980 1.00 0.00 N ATOM 952 CA GLU A 59 -14.433 -4.497 -9.081 1.00 0.00 C ATOM 953 C GLU A 59 -13.630 -3.211 -8.934 1.00 0.00 C ATOM 954 O GLU A 59 -12.446 -3.192 -9.242 1.00 0.00 O ATOM 955 CB GLU A 59 -15.181 -4.568 -10.414 1.00 0.00 C ATOM 956 CG GLU A 59 -15.907 -5.912 -10.571 1.00 0.00 C ATOM 957 CD GLU A 59 -16.456 -6.081 -11.982 1.00 0.00 C ATOM 958 OE1 GLU A 59 -17.513 -5.471 -12.253 1.00 0.00 O ATOM 959 OE2 GLU A 59 -15.802 -6.802 -12.766 1.00 0.00 O ATOM 0 H GLU A 59 -16.334 -4.613 -8.257 1.00 0.00 H new ATOM 0 HA GLU A 59 -13.702 -5.306 -9.062 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -15.902 -3.753 -10.474 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -14.478 -4.433 -11.236 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -15.220 -6.728 -10.345 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -16.723 -5.974 -9.851 1.00 0.00 H new ATOM 966 N ASP A 60 -14.245 -2.145 -8.421 1.00 0.00 N ATOM 967 CA ASP A 60 -13.542 -0.885 -8.202 1.00 0.00 C ATOM 968 C ASP A 60 -12.500 -1.081 -7.097 1.00 0.00 C ATOM 969 O ASP A 60 -11.341 -0.696 -7.240 1.00 0.00 O ATOM 970 CB ASP A 60 -14.545 0.229 -7.868 1.00 0.00 C ATOM 971 CG ASP A 60 -13.852 1.568 -7.625 1.00 0.00 C ATOM 972 OD1 ASP A 60 -12.944 1.900 -8.415 1.00 0.00 O ATOM 973 OD2 ASP A 60 -14.256 2.239 -6.653 1.00 0.00 O ATOM 0 H ASP A 60 -15.228 -2.131 -8.150 1.00 0.00 H new ATOM 0 HA ASP A 60 -13.020 -0.579 -9.109 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -15.258 0.333 -8.686 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -15.115 -0.050 -6.982 1.00 0.00 H new ATOM 978 N LEU A 61 -12.915 -1.783 -6.034 1.00 0.00 N ATOM 979 CA LEU A 61 -12.074 -2.124 -4.885 1.00 0.00 C ATOM 980 C LEU A 61 -10.870 -2.905 -5.433 1.00 0.00 C ATOM 981 O LEU A 61 -9.718 -2.503 -5.281 1.00 0.00 O ATOM 982 CB LEU A 61 -12.928 -2.936 -3.892 1.00 0.00 C ATOM 983 CG LEU A 61 -12.491 -2.892 -2.424 1.00 0.00 C ATOM 984 CD1 LEU A 61 -13.544 -3.592 -1.555 1.00 0.00 C ATOM 985 CD2 LEU A 61 -11.185 -3.643 -2.200 1.00 0.00 C ATOM 0 H LEU A 61 -13.868 -2.137 -5.950 1.00 0.00 H new ATOM 0 HA LEU A 61 -11.700 -1.254 -4.346 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -13.956 -2.579 -3.953 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -12.932 -3.977 -4.216 1.00 0.00 H new ATOM 0 HG LEU A 61 -12.368 -1.841 -2.161 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -13.233 -3.561 -0.511 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -14.502 -3.084 -1.664 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -13.646 -4.630 -1.872 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -10.910 -3.588 -1.147 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -11.311 -4.687 -2.488 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -10.398 -3.193 -2.805 1.00 0.00 H new ATOM 997 N LYS A 62 -11.155 -3.958 -6.209 1.00 0.00 N ATOM 998 CA LYS A 62 -10.131 -4.809 -6.803 1.00 0.00 C ATOM 999 C LYS A 62 -9.179 -3.991 -7.686 1.00 0.00 C ATOM 1000 O LYS A 62 -7.968 -3.981 -7.465 1.00 0.00 O ATOM 1001 CB LYS A 62 -10.831 -5.927 -7.596 1.00 0.00 C ATOM 1002 CG LYS A 62 -9.873 -6.930 -8.254 1.00 0.00 C ATOM 1003 CD LYS A 62 -10.593 -7.742 -9.341 1.00 0.00 C ATOM 1004 CE LYS A 62 -11.712 -8.627 -8.778 1.00 0.00 C ATOM 1005 NZ LYS A 62 -12.360 -9.415 -9.842 1.00 0.00 N ATOM 0 H LYS A 62 -12.108 -4.240 -6.440 1.00 0.00 H new ATOM 0 HA LYS A 62 -9.517 -5.256 -6.021 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -11.500 -6.467 -6.926 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -11.451 -5.474 -8.369 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -9.028 -6.399 -8.691 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -9.470 -7.604 -7.498 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -11.013 -7.059 -10.080 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -9.868 -8.368 -9.861 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -11.302 -9.299 -8.024 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -12.455 -8.004 -8.280 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -13.112 -10.003 -9.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -12.771 -8.772 -10.548 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -11.654 -10.027 -10.300 1.00 0.00 H new ATOM 1019 N LYS A 63 -9.731 -3.299 -8.685 1.00 0.00 N ATOM 1020 CA LYS A 63 -8.988 -2.479 -9.630 1.00 0.00 C ATOM 1021 C LYS A 63 -8.054 -1.533 -8.889 1.00 0.00 C ATOM 1022 O LYS A 63 -6.901 -1.345 -9.296 1.00 0.00 O ATOM 1023 CB LYS A 63 -9.983 -1.736 -10.540 1.00 0.00 C ATOM 1024 CG LYS A 63 -9.347 -0.846 -11.623 1.00 0.00 C ATOM 1025 CD LYS A 63 -8.938 0.583 -11.208 1.00 0.00 C ATOM 1026 CE LYS A 63 -10.097 1.449 -10.690 1.00 0.00 C ATOM 1027 NZ LYS A 63 -10.256 1.379 -9.226 1.00 0.00 N ATOM 0 H LYS A 63 -10.736 -3.297 -8.859 1.00 0.00 H new ATOM 0 HA LYS A 63 -8.358 -3.106 -10.262 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -10.623 -2.472 -11.027 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -10.627 -1.116 -9.916 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -8.461 -1.355 -12.001 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -10.049 -0.769 -12.453 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -8.174 0.519 -10.433 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -8.483 1.081 -12.064 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -9.929 2.485 -10.983 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -11.024 1.130 -11.167 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -11.162 1.811 -8.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -10.241 0.384 -8.922 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -9.477 1.893 -8.767 1.00 0.00 H new ATOM 1041 N HIS A 64 -8.560 -0.859 -7.851 1.00 0.00 N ATOM 1042 CA HIS A 64 -7.681 0.018 -7.120 1.00 0.00 C ATOM 1043 C HIS A 64 -6.605 -0.759 -6.401 1.00 0.00 C ATOM 1044 O HIS A 64 -5.438 -0.422 -6.548 1.00 0.00 O ATOM 1045 CB HIS A 64 -8.402 0.939 -6.146 1.00 0.00 C ATOM 1046 CG HIS A 64 -7.758 2.293 -6.102 1.00 0.00 C ATOM 1047 ND1 HIS A 64 -7.043 2.896 -7.116 1.00 0.00 N ATOM 1048 CD2 HIS A 64 -7.542 3.009 -4.964 1.00 0.00 C ATOM 1049 CE1 HIS A 64 -6.428 3.965 -6.598 1.00 0.00 C ATOM 1050 NE2 HIS A 64 -6.712 4.083 -5.290 1.00 0.00 N ATOM 0 H HIS A 64 -9.524 -0.906 -7.521 1.00 0.00 H new ATOM 0 HA HIS A 64 -7.222 0.659 -7.873 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -9.446 1.040 -6.442 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -8.394 0.497 -5.150 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -7.941 2.786 -3.985 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -5.792 4.639 -7.153 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -6.385 4.814 -4.659 1.00 0.00 H new ATOM 1058 N GLY A 65 -6.979 -1.802 -5.660 1.00 0.00 N ATOM 1059 CA GLY A 65 -6.028 -2.637 -4.947 1.00 0.00 C ATOM 1060 C GLY A 65 -4.880 -3.044 -5.881 1.00 0.00 C ATOM 1061 O GLY A 65 -3.715 -2.969 -5.501 1.00 0.00 O ATOM 0 H GLY A 65 -7.951 -2.087 -5.541 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -5.633 -2.098 -4.086 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -6.529 -3.526 -4.564 1.00 0.00 H new ATOM 1065 N VAL A 66 -5.211 -3.386 -7.133 1.00 0.00 N ATOM 1066 CA VAL A 66 -4.259 -3.761 -8.175 1.00 0.00 C ATOM 1067 C VAL A 66 -3.379 -2.545 -8.506 1.00 0.00 C ATOM 1068 O VAL A 66 -2.156 -2.635 -8.454 1.00 0.00 O ATOM 1069 CB VAL A 66 -5.006 -4.308 -9.408 1.00 0.00 C ATOM 1070 CG1 VAL A 66 -4.105 -4.446 -10.644 1.00 0.00 C ATOM 1071 CG2 VAL A 66 -5.620 -5.674 -9.099 1.00 0.00 C ATOM 0 H VAL A 66 -6.179 -3.409 -7.454 1.00 0.00 H new ATOM 0 HA VAL A 66 -3.607 -4.562 -7.827 1.00 0.00 H new ATOM 0 HB VAL A 66 -5.783 -3.579 -9.637 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -4.689 -4.836 -11.478 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -3.700 -3.470 -10.910 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -3.286 -5.131 -10.423 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -6.143 -6.045 -9.980 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -4.831 -6.374 -8.824 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -6.324 -5.578 -8.272 1.00 0.00 H new ATOM 1081 N THR A 67 -3.989 -1.385 -8.779 1.00 0.00 N ATOM 1082 CA THR A 67 -3.279 -0.135 -9.081 1.00 0.00 C ATOM 1083 C THR A 67 -2.249 0.186 -7.987 1.00 0.00 C ATOM 1084 O THR A 67 -1.081 0.471 -8.242 1.00 0.00 O ATOM 1085 CB THR A 67 -4.312 1.002 -9.232 1.00 0.00 C ATOM 1086 OG1 THR A 67 -5.267 0.671 -10.223 1.00 0.00 O ATOM 1087 CG2 THR A 67 -3.703 2.354 -9.614 1.00 0.00 C ATOM 0 H THR A 67 -5.004 -1.287 -8.797 1.00 0.00 H new ATOM 0 HA THR A 67 -2.729 -0.243 -10.016 1.00 0.00 H new ATOM 0 HB THR A 67 -4.766 1.103 -8.246 1.00 0.00 H new ATOM 0 HG1 THR A 67 -5.932 0.059 -9.845 1.00 0.00 H new ATOM 0 HG21 THR A 67 -4.495 3.098 -9.700 1.00 0.00 H new ATOM 0 HG22 THR A 67 -2.995 2.664 -8.845 1.00 0.00 H new ATOM 0 HG23 THR A 67 -3.185 2.263 -10.569 1.00 0.00 H new ATOM 1095 N VAL A 68 -2.718 0.090 -6.753 1.00 0.00 N ATOM 1096 CA VAL A 68 -2.023 0.371 -5.511 1.00 0.00 C ATOM 1097 C VAL A 68 -0.843 -0.587 -5.363 1.00 0.00 C ATOM 1098 O VAL A 68 0.309 -0.152 -5.289 1.00 0.00 O ATOM 1099 CB VAL A 68 -3.134 0.340 -4.443 1.00 0.00 C ATOM 1100 CG1 VAL A 68 -2.815 0.119 -2.972 1.00 0.00 C ATOM 1101 CG2 VAL A 68 -3.873 1.676 -4.541 1.00 0.00 C ATOM 0 H VAL A 68 -3.677 -0.213 -6.583 1.00 0.00 H new ATOM 0 HA VAL A 68 -1.531 1.340 -5.435 1.00 0.00 H new ATOM 0 HB VAL A 68 -3.678 -0.569 -4.698 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -3.739 0.133 -2.393 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -2.323 -0.846 -2.847 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -2.154 0.911 -2.620 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -4.673 1.704 -3.802 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -3.176 2.492 -4.352 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -4.297 1.785 -5.539 1.00 0.00 H new ATOM 1111 N LEU A 69 -1.107 -1.894 -5.400 1.00 0.00 N ATOM 1112 CA LEU A 69 -0.059 -2.902 -5.370 1.00 0.00 C ATOM 1113 C LEU A 69 0.974 -2.658 -6.462 1.00 0.00 C ATOM 1114 O LEU A 69 2.169 -2.717 -6.198 1.00 0.00 O ATOM 1115 CB LEU A 69 -0.656 -4.297 -5.567 1.00 0.00 C ATOM 1116 CG LEU A 69 -1.287 -4.827 -4.280 1.00 0.00 C ATOM 1117 CD1 LEU A 69 -2.039 -6.104 -4.649 1.00 0.00 C ATOM 1118 CD2 LEU A 69 -0.218 -5.192 -3.250 1.00 0.00 C ATOM 0 H LEU A 69 -2.051 -2.277 -5.451 1.00 0.00 H new ATOM 0 HA LEU A 69 0.427 -2.836 -4.396 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -1.409 -4.263 -6.355 1.00 0.00 H new ATOM 0 HB3 LEU A 69 0.123 -4.983 -5.900 1.00 0.00 H new ATOM 0 HG LEU A 69 -1.936 -4.064 -3.850 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -2.508 -6.520 -3.758 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -2.806 -5.874 -5.389 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -1.341 -6.830 -5.064 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -0.697 -5.566 -2.345 1.00 0.00 H new ATOM 0 HD22 LEU A 69 0.434 -5.963 -3.660 1.00 0.00 H new ATOM 0 HD23 LEU A 69 0.372 -4.308 -3.009 1.00 0.00 H new ATOM 1130 N THR A 70 0.527 -2.434 -7.696 1.00 0.00 N ATOM 1131 CA THR A 70 1.442 -2.232 -8.812 1.00 0.00 C ATOM 1132 C THR A 70 2.315 -0.996 -8.564 1.00 0.00 C ATOM 1133 O THR A 70 3.508 -0.998 -8.876 1.00 0.00 O ATOM 1134 CB THR A 70 0.667 -2.161 -10.139 1.00 0.00 C ATOM 1135 OG1 THR A 70 -0.187 -3.283 -10.253 1.00 0.00 O ATOM 1136 CG2 THR A 70 1.618 -2.196 -11.337 1.00 0.00 C ATOM 0 H THR A 70 -0.461 -2.388 -7.946 1.00 0.00 H new ATOM 0 HA THR A 70 2.115 -3.086 -8.890 1.00 0.00 H new ATOM 0 HB THR A 70 0.103 -1.228 -10.138 1.00 0.00 H new ATOM 0 HG1 THR A 70 -1.010 -3.121 -9.746 1.00 0.00 H new ATOM 0 HG21 THR A 70 1.042 -2.144 -12.261 1.00 0.00 H new ATOM 0 HG22 THR A 70 2.299 -1.346 -11.286 1.00 0.00 H new ATOM 0 HG23 THR A 70 2.192 -3.122 -11.319 1.00 0.00 H new ATOM 1144 N ALA A 71 1.721 0.084 -8.049 1.00 0.00 N ATOM 1145 CA ALA A 71 2.481 1.276 -7.739 1.00 0.00 C ATOM 1146 C ALA A 71 3.562 0.991 -6.700 1.00 0.00 C ATOM 1147 O ALA A 71 4.735 1.250 -6.963 1.00 0.00 O ATOM 1148 CB ALA A 71 1.546 2.413 -7.326 1.00 0.00 C ATOM 0 H ALA A 71 0.724 0.148 -7.843 1.00 0.00 H new ATOM 0 HA ALA A 71 3.004 1.602 -8.638 1.00 0.00 H new ATOM 0 HB1 ALA A 71 2.133 3.302 -7.096 1.00 0.00 H new ATOM 0 HB2 ALA A 71 0.858 2.633 -8.143 1.00 0.00 H new ATOM 0 HB3 ALA A 71 0.979 2.115 -6.444 1.00 0.00 H new ATOM 1154 N LEU A 72 3.196 0.480 -5.521 1.00 0.00 N ATOM 1155 CA LEU A 72 4.207 0.149 -4.516 1.00 0.00 C ATOM 1156 C LEU A 72 5.205 -0.871 -5.093 1.00 0.00 C ATOM 1157 O LEU A 72 6.411 -0.798 -4.870 1.00 0.00 O ATOM 1158 CB LEU A 72 3.532 -0.398 -3.245 1.00 0.00 C ATOM 1159 CG LEU A 72 4.517 -0.805 -2.133 1.00 0.00 C ATOM 1160 CD1 LEU A 72 5.335 0.388 -1.627 1.00 0.00 C ATOM 1161 CD2 LEU A 72 3.755 -1.424 -0.956 1.00 0.00 C ATOM 0 H LEU A 72 2.233 0.291 -5.244 1.00 0.00 H new ATOM 0 HA LEU A 72 4.755 1.052 -4.247 1.00 0.00 H new ATOM 0 HB2 LEU A 72 2.852 0.359 -2.854 1.00 0.00 H new ATOM 0 HB3 LEU A 72 2.926 -1.263 -3.513 1.00 0.00 H new ATOM 0 HG LEU A 72 5.205 -1.534 -2.562 1.00 0.00 H new ATOM 0 HD11 LEU A 72 6.017 0.056 -0.844 1.00 0.00 H new ATOM 0 HD12 LEU A 72 5.908 0.812 -2.451 1.00 0.00 H new ATOM 0 HD13 LEU A 72 4.663 1.146 -1.225 1.00 0.00 H new ATOM 0 HD21 LEU A 72 4.460 -1.708 -0.175 1.00 0.00 H new ATOM 0 HD22 LEU A 72 3.047 -0.697 -0.558 1.00 0.00 H new ATOM 0 HD23 LEU A 72 3.215 -2.308 -1.296 1.00 0.00 H new ATOM 1173 N GLY A 73 4.696 -1.839 -5.850 1.00 0.00 N ATOM 1174 CA GLY A 73 5.449 -2.920 -6.457 1.00 0.00 C ATOM 1175 C GLY A 73 6.563 -2.364 -7.329 1.00 0.00 C ATOM 1176 O GLY A 73 7.692 -2.838 -7.270 1.00 0.00 O ATOM 0 H GLY A 73 3.700 -1.889 -6.064 1.00 0.00 H new ATOM 0 HA2 GLY A 73 5.870 -3.559 -5.681 1.00 0.00 H new ATOM 0 HA3 GLY A 73 4.785 -3.542 -7.057 1.00 0.00 H new ATOM 1180 N ALA A 74 6.254 -1.350 -8.137 1.00 0.00 N ATOM 1181 CA ALA A 74 7.232 -0.698 -8.995 1.00 0.00 C ATOM 1182 C ALA A 74 8.385 -0.149 -8.153 1.00 0.00 C ATOM 1183 O ALA A 74 9.550 -0.292 -8.517 1.00 0.00 O ATOM 1184 CB ALA A 74 6.560 0.413 -9.806 1.00 0.00 C ATOM 0 H ALA A 74 5.315 -0.960 -8.212 1.00 0.00 H new ATOM 0 HA ALA A 74 7.641 -1.427 -9.694 1.00 0.00 H new ATOM 0 HB1 ALA A 74 7.300 0.895 -10.445 1.00 0.00 H new ATOM 0 HB2 ALA A 74 5.770 -0.014 -10.424 1.00 0.00 H new ATOM 0 HB3 ALA A 74 6.131 1.150 -9.127 1.00 0.00 H new ATOM 1190 N ILE A 75 8.074 0.380 -6.967 1.00 0.00 N ATOM 1191 CA ILE A 75 9.099 0.934 -6.086 1.00 0.00 C ATOM 1192 C ILE A 75 9.973 -0.224 -5.611 1.00 0.00 C ATOM 1193 O ILE A 75 11.197 -0.199 -5.765 1.00 0.00 O ATOM 1194 CB ILE A 75 8.449 1.714 -4.925 1.00 0.00 C ATOM 1195 CG1 ILE A 75 7.471 2.784 -5.439 1.00 0.00 C ATOM 1196 CG2 ILE A 75 9.482 2.365 -3.997 1.00 0.00 C ATOM 1197 CD1 ILE A 75 8.026 3.666 -6.567 1.00 0.00 C ATOM 0 H ILE A 75 7.125 0.435 -6.598 1.00 0.00 H new ATOM 0 HA ILE A 75 9.726 1.654 -6.611 1.00 0.00 H new ATOM 0 HB ILE A 75 7.897 0.975 -4.345 1.00 0.00 H new ATOM 0 HG12 ILE A 75 6.566 2.291 -5.793 1.00 0.00 H new ATOM 0 HG13 ILE A 75 7.180 3.423 -4.605 1.00 0.00 H new ATOM 0 HG21 ILE A 75 8.968 2.900 -3.199 1.00 0.00 H new ATOM 0 HG22 ILE A 75 10.120 1.594 -3.565 1.00 0.00 H new ATOM 0 HG23 ILE A 75 10.094 3.064 -4.567 1.00 0.00 H new ATOM 0 HD11 ILE A 75 7.270 4.391 -6.867 1.00 0.00 H new ATOM 0 HD12 ILE A 75 8.913 4.192 -6.215 1.00 0.00 H new ATOM 0 HD13 ILE A 75 8.289 3.042 -7.421 1.00 0.00 H new ATOM 1209 N LEU A 76 9.317 -1.250 -5.061 1.00 0.00 N ATOM 1210 CA LEU A 76 9.962 -2.452 -4.559 1.00 0.00 C ATOM 1211 C LEU A 76 10.884 -3.095 -5.599 1.00 0.00 C ATOM 1212 O LEU A 76 12.010 -3.464 -5.279 1.00 0.00 O ATOM 1213 CB LEU A 76 8.904 -3.475 -4.126 1.00 0.00 C ATOM 1214 CG LEU A 76 8.024 -3.056 -2.938 1.00 0.00 C ATOM 1215 CD1 LEU A 76 7.036 -4.181 -2.616 1.00 0.00 C ATOM 1216 CD2 LEU A 76 8.842 -2.760 -1.685 1.00 0.00 C ATOM 0 H LEU A 76 8.303 -1.262 -4.953 1.00 0.00 H new ATOM 0 HA LEU A 76 10.572 -2.154 -3.707 1.00 0.00 H new ATOM 0 HB2 LEU A 76 8.257 -3.685 -4.978 1.00 0.00 H new ATOM 0 HB3 LEU A 76 9.408 -4.407 -3.871 1.00 0.00 H new ATOM 0 HG LEU A 76 7.503 -2.143 -3.228 1.00 0.00 H new ATOM 0 HD11 LEU A 76 6.411 -3.886 -1.773 1.00 0.00 H new ATOM 0 HD12 LEU A 76 6.407 -4.373 -3.485 1.00 0.00 H new ATOM 0 HD13 LEU A 76 7.586 -5.086 -2.360 1.00 0.00 H new ATOM 0 HD21 LEU A 76 8.174 -2.468 -0.875 1.00 0.00 H new ATOM 0 HD22 LEU A 76 9.398 -3.652 -1.394 1.00 0.00 H new ATOM 0 HD23 LEU A 76 9.540 -1.948 -1.890 1.00 0.00 H new ATOM 1228 N LYS A 77 10.407 -3.238 -6.839 1.00 0.00 N ATOM 1229 CA LYS A 77 11.163 -3.867 -7.915 1.00 0.00 C ATOM 1230 C LYS A 77 12.526 -3.206 -8.089 1.00 0.00 C ATOM 1231 O LYS A 77 13.530 -3.896 -8.273 1.00 0.00 O ATOM 1232 CB LYS A 77 10.365 -3.841 -9.228 1.00 0.00 C ATOM 1233 CG LYS A 77 9.230 -4.880 -9.254 1.00 0.00 C ATOM 1234 CD LYS A 77 9.689 -6.333 -9.457 1.00 0.00 C ATOM 1235 CE LYS A 77 10.268 -6.587 -10.854 1.00 0.00 C ATOM 1236 NZ LYS A 77 10.568 -8.016 -11.054 1.00 0.00 N ATOM 0 H LYS A 77 9.481 -2.918 -7.121 1.00 0.00 H new ATOM 0 HA LYS A 77 11.333 -4.909 -7.643 1.00 0.00 H new ATOM 0 HB2 LYS A 77 9.944 -2.846 -9.373 1.00 0.00 H new ATOM 0 HB3 LYS A 77 11.041 -4.026 -10.063 1.00 0.00 H new ATOM 0 HG2 LYS A 77 8.677 -4.816 -8.317 1.00 0.00 H new ATOM 0 HG3 LYS A 77 8.536 -4.618 -10.052 1.00 0.00 H new ATOM 0 HD2 LYS A 77 10.441 -6.579 -8.707 1.00 0.00 H new ATOM 0 HD3 LYS A 77 8.844 -7.002 -9.292 1.00 0.00 H new ATOM 0 HE2 LYS A 77 9.559 -6.252 -11.611 1.00 0.00 H new ATOM 0 HE3 LYS A 77 11.177 -6.000 -10.986 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 10.958 -8.159 -12.007 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 11.263 -8.327 -10.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 9.695 -8.572 -10.951 1.00 0.00 H new ATOM 1250 N LYS A 78 12.583 -1.874 -8.034 1.00 0.00 N ATOM 1251 CA LYS A 78 13.839 -1.163 -8.160 1.00 0.00 C ATOM 1252 C LYS A 78 14.513 -1.161 -6.788 1.00 0.00 C ATOM 1253 O LYS A 78 14.705 -0.093 -6.214 1.00 0.00 O ATOM 1254 CB LYS A 78 13.604 0.254 -8.701 1.00 0.00 C ATOM 1255 CG LYS A 78 13.338 0.311 -10.214 1.00 0.00 C ATOM 1256 CD LYS A 78 11.897 -0.049 -10.589 1.00 0.00 C ATOM 1257 CE LYS A 78 11.693 0.042 -12.104 1.00 0.00 C ATOM 1258 NZ LYS A 78 10.303 -0.282 -12.469 1.00 0.00 N ATOM 0 H LYS A 78 11.769 -1.273 -7.903 1.00 0.00 H new ATOM 0 HA LYS A 78 14.496 -1.655 -8.877 1.00 0.00 H new ATOM 0 HB2 LYS A 78 12.756 0.696 -8.177 1.00 0.00 H new ATOM 0 HB3 LYS A 78 14.475 0.868 -8.473 1.00 0.00 H new ATOM 0 HG2 LYS A 78 13.561 1.314 -10.578 1.00 0.00 H new ATOM 0 HG3 LYS A 78 14.020 -0.371 -10.722 1.00 0.00 H new ATOM 0 HD2 LYS A 78 11.668 -1.058 -10.246 1.00 0.00 H new ATOM 0 HD3 LYS A 78 11.205 0.624 -10.083 1.00 0.00 H new ATOM 0 HE2 LYS A 78 11.939 1.047 -12.448 1.00 0.00 H new ATOM 0 HE3 LYS A 78 12.375 -0.643 -12.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 10.190 -0.213 -13.501 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 10.079 -1.249 -12.160 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 9.657 0.388 -12.005 1.00 0.00 H new ATOM 1272 N LYS A 79 14.861 -2.360 -6.302 1.00 0.00 N ATOM 1273 CA LYS A 79 15.494 -2.708 -5.026 1.00 0.00 C ATOM 1274 C LYS A 79 16.562 -1.706 -4.560 1.00 0.00 C ATOM 1275 O LYS A 79 17.760 -1.953 -4.659 1.00 0.00 O ATOM 1276 CB LYS A 79 16.019 -4.156 -5.117 1.00 0.00 C ATOM 1277 CG LYS A 79 16.926 -4.459 -6.316 1.00 0.00 C ATOM 1278 CD LYS A 79 17.445 -5.903 -6.308 1.00 0.00 C ATOM 1279 CE LYS A 79 16.332 -6.923 -6.570 1.00 0.00 C ATOM 1280 NZ LYS A 79 16.878 -8.281 -6.737 1.00 0.00 N ATOM 0 H LYS A 79 14.686 -3.199 -6.854 1.00 0.00 H new ATOM 0 HA LYS A 79 14.739 -2.646 -4.243 1.00 0.00 H new ATOM 0 HB2 LYS A 79 16.568 -4.382 -4.203 1.00 0.00 H new ATOM 0 HB3 LYS A 79 15.164 -4.832 -5.151 1.00 0.00 H new ATOM 0 HG2 LYS A 79 16.375 -4.279 -7.239 1.00 0.00 H new ATOM 0 HG3 LYS A 79 17.772 -3.772 -6.311 1.00 0.00 H new ATOM 0 HD2 LYS A 79 18.220 -6.012 -7.066 1.00 0.00 H new ATOM 0 HD3 LYS A 79 17.909 -6.115 -5.345 1.00 0.00 H new ATOM 0 HE2 LYS A 79 15.624 -6.913 -5.741 1.00 0.00 H new ATOM 0 HE3 LYS A 79 15.779 -6.639 -7.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 16.104 -8.974 -6.692 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 17.354 -8.353 -7.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 17.562 -8.476 -5.978 1.00 0.00 H new ATOM 1294 N GLY A 80 16.114 -0.539 -4.094 1.00 0.00 N ATOM 1295 CA GLY A 80 16.954 0.526 -3.559 1.00 0.00 C ATOM 1296 C GLY A 80 17.471 1.521 -4.593 1.00 0.00 C ATOM 1297 O GLY A 80 18.193 2.452 -4.223 1.00 0.00 O ATOM 0 H GLY A 80 15.121 -0.304 -4.080 1.00 0.00 H new ATOM 0 HA2 GLY A 80 16.387 1.071 -2.804 1.00 0.00 H new ATOM 0 HA3 GLY A 80 17.807 0.075 -3.052 1.00 0.00 H new ATOM 1301 N HIS A 81 17.132 1.360 -5.875 1.00 0.00 N ATOM 1302 CA HIS A 81 17.661 2.213 -6.904 1.00 0.00 C ATOM 1303 C HIS A 81 16.544 2.657 -7.842 1.00 0.00 C ATOM 1304 O HIS A 81 16.465 2.205 -8.987 1.00 0.00 O ATOM 1305 CB HIS A 81 18.774 1.446 -7.611 1.00 0.00 C ATOM 1306 CG HIS A 81 18.408 0.041 -8.015 1.00 0.00 C ATOM 1307 ND1 HIS A 81 17.474 -0.297 -8.973 1.00 0.00 N ATOM 1308 CD2 HIS A 81 18.894 -1.109 -7.461 1.00 0.00 C ATOM 1309 CE1 HIS A 81 17.444 -1.638 -9.058 1.00 0.00 C ATOM 1310 NE2 HIS A 81 18.312 -2.148 -8.163 1.00 0.00 N ATOM 0 H HIS A 81 16.491 0.641 -6.210 1.00 0.00 H new ATOM 0 HA HIS A 81 18.083 3.129 -6.491 1.00 0.00 H new ATOM 0 HB2 HIS A 81 19.071 2.000 -8.501 1.00 0.00 H new ATOM 0 HB3 HIS A 81 19.644 1.407 -6.955 1.00 0.00 H new ATOM 0 HD1 HIS A 81 16.908 0.354 -9.518 1.00 0.00 H new ATOM 0 HD2 HIS A 81 19.592 -1.190 -6.641 1.00 0.00 H new ATOM 0 HE1 HIS A 81 16.826 -2.212 -9.733 1.00 0.00 H new ATOM 1319 N HIS A 82 15.601 3.445 -7.321 1.00 0.00 N ATOM 1320 CA HIS A 82 14.496 3.907 -8.130 1.00 0.00 C ATOM 1321 C HIS A 82 14.873 5.256 -8.717 1.00 0.00 C ATOM 1322 O HIS A 82 14.914 5.432 -9.931 1.00 0.00 O ATOM 1323 CB HIS A 82 13.167 3.899 -7.355 1.00 0.00 C ATOM 1324 CG HIS A 82 13.252 3.402 -5.932 1.00 0.00 C ATOM 1325 ND1 HIS A 82 13.105 2.097 -5.512 1.00 0.00 N ATOM 1326 CD2 HIS A 82 13.393 4.186 -4.818 1.00 0.00 C ATOM 1327 CE1 HIS A 82 13.152 2.099 -4.172 1.00 0.00 C ATOM 1328 NE2 HIS A 82 13.335 3.345 -3.703 1.00 0.00 N ATOM 0 H HIS A 82 15.589 3.768 -6.353 1.00 0.00 H new ATOM 0 HA HIS A 82 14.314 3.220 -8.956 1.00 0.00 H new ATOM 0 HB2 HIS A 82 12.765 4.912 -7.345 1.00 0.00 H new ATOM 0 HB3 HIS A 82 12.453 3.279 -7.897 1.00 0.00 H new ATOM 0 HD1 HIS A 82 12.983 1.280 -6.111 1.00 0.00 H new ATOM 0 HD2 HIS A 82 13.525 5.258 -4.804 1.00 0.00 H new ATOM 0 HE1 HIS A 82 13.056 1.219 -3.554 1.00 0.00 H new ATOM 1336 N GLU A 83 15.059 6.236 -7.834 1.00 0.00 N ATOM 1337 CA GLU A 83 15.462 7.614 -8.065 1.00 0.00 C ATOM 1338 C GLU A 83 14.353 8.450 -8.704 1.00 0.00 C ATOM 1339 O GLU A 83 14.208 9.628 -8.389 1.00 0.00 O ATOM 1340 CB GLU A 83 16.818 7.704 -8.793 1.00 0.00 C ATOM 1341 CG GLU A 83 17.995 7.352 -7.867 1.00 0.00 C ATOM 1342 CD GLU A 83 17.993 5.888 -7.438 1.00 0.00 C ATOM 1343 OE1 GLU A 83 18.449 5.057 -8.253 1.00 0.00 O ATOM 1344 OE2 GLU A 83 17.519 5.621 -6.312 1.00 0.00 O ATOM 0 H GLU A 83 14.915 6.062 -6.839 1.00 0.00 H new ATOM 0 HA GLU A 83 15.626 8.071 -7.089 1.00 0.00 H new ATOM 0 HB2 GLU A 83 16.815 7.029 -9.648 1.00 0.00 H new ATOM 0 HB3 GLU A 83 16.953 8.713 -9.184 1.00 0.00 H new ATOM 0 HG2 GLU A 83 18.932 7.575 -8.377 1.00 0.00 H new ATOM 0 HG3 GLU A 83 17.956 7.986 -6.981 1.00 0.00 H new ATOM 1351 N ALA A 84 13.549 7.820 -9.561 1.00 0.00 N ATOM 1352 CA ALA A 84 12.395 8.420 -10.222 1.00 0.00 C ATOM 1353 C ALA A 84 11.480 9.046 -9.167 1.00 0.00 C ATOM 1354 O ALA A 84 11.053 10.185 -9.316 1.00 0.00 O ATOM 1355 CB ALA A 84 11.645 7.349 -11.021 1.00 0.00 C ATOM 0 H ALA A 84 13.690 6.844 -9.822 1.00 0.00 H new ATOM 0 HA ALA A 84 12.724 9.198 -10.911 1.00 0.00 H new ATOM 0 HB1 ALA A 84 10.783 7.799 -11.514 1.00 0.00 H new ATOM 0 HB2 ALA A 84 12.310 6.922 -11.772 1.00 0.00 H new ATOM 0 HB3 ALA A 84 11.307 6.562 -10.347 1.00 0.00 H new ATOM 1361 N GLU A 85 11.287 8.311 -8.068 1.00 0.00 N ATOM 1362 CA GLU A 85 10.525 8.682 -6.891 1.00 0.00 C ATOM 1363 C GLU A 85 9.034 8.951 -7.127 1.00 0.00 C ATOM 1364 O GLU A 85 8.548 9.143 -8.239 1.00 0.00 O ATOM 1365 CB GLU A 85 11.251 9.771 -6.089 1.00 0.00 C ATOM 1366 CG GLU A 85 12.078 9.198 -4.926 1.00 0.00 C ATOM 1367 CD GLU A 85 13.278 8.369 -5.374 1.00 0.00 C ATOM 1368 OE1 GLU A 85 13.053 7.348 -6.059 1.00 0.00 O ATOM 1369 OE2 GLU A 85 14.404 8.760 -5.001 1.00 0.00 O ATOM 0 H GLU A 85 11.690 7.378 -7.980 1.00 0.00 H new ATOM 0 HA GLU A 85 10.488 7.791 -6.264 1.00 0.00 H new ATOM 0 HB2 GLU A 85 11.907 10.331 -6.755 1.00 0.00 H new ATOM 0 HB3 GLU A 85 10.519 10.476 -5.696 1.00 0.00 H new ATOM 0 HG2 GLU A 85 12.429 10.020 -4.302 1.00 0.00 H new ATOM 0 HG3 GLU A 85 11.432 8.579 -4.304 1.00 0.00 H new ATOM 1376 N LEU A 86 8.301 8.916 -6.016 1.00 0.00 N ATOM 1377 CA LEU A 86 6.856 9.018 -5.910 1.00 0.00 C ATOM 1378 C LEU A 86 6.358 10.455 -6.143 1.00 0.00 C ATOM 1379 O LEU A 86 5.481 10.909 -5.421 1.00 0.00 O ATOM 1380 CB LEU A 86 6.477 8.505 -4.512 1.00 0.00 C ATOM 1381 CG LEU A 86 6.662 6.990 -4.289 1.00 0.00 C ATOM 1382 CD1 LEU A 86 5.755 6.184 -5.225 1.00 0.00 C ATOM 1383 CD2 LEU A 86 8.104 6.480 -4.389 1.00 0.00 C ATOM 0 H LEU A 86 8.739 8.807 -5.101 1.00 0.00 H new ATOM 0 HA LEU A 86 6.376 8.419 -6.684 1.00 0.00 H new ATOM 0 HB2 LEU A 86 7.075 9.039 -3.773 1.00 0.00 H new ATOM 0 HB3 LEU A 86 5.434 8.758 -4.321 1.00 0.00 H new ATOM 0 HG LEU A 86 6.372 6.834 -3.250 1.00 0.00 H new ATOM 0 HD11 LEU A 86 5.904 5.119 -5.048 1.00 0.00 H new ATOM 0 HD12 LEU A 86 4.713 6.441 -5.033 1.00 0.00 H new ATOM 0 HD13 LEU A 86 6.001 6.418 -6.261 1.00 0.00 H new ATOM 0 HD21 LEU A 86 8.122 5.404 -4.216 1.00 0.00 H new ATOM 0 HD22 LEU A 86 8.498 6.695 -5.382 1.00 0.00 H new ATOM 0 HD23 LEU A 86 8.719 6.978 -3.640 1.00 0.00 H new ATOM 1395 N LYS A 87 6.871 11.188 -7.139 1.00 0.00 N ATOM 1396 CA LYS A 87 6.451 12.576 -7.374 1.00 0.00 C ATOM 1397 C LYS A 87 4.923 12.763 -7.501 1.00 0.00 C ATOM 1398 O LYS A 87 4.315 13.412 -6.646 1.00 0.00 O ATOM 1399 CB LYS A 87 7.190 13.212 -8.567 1.00 0.00 C ATOM 1400 CG LYS A 87 8.577 13.780 -8.240 1.00 0.00 C ATOM 1401 CD LYS A 87 9.639 12.680 -8.193 1.00 0.00 C ATOM 1402 CE LYS A 87 11.057 13.264 -8.179 1.00 0.00 C ATOM 1403 NZ LYS A 87 11.283 14.145 -7.020 1.00 0.00 N ATOM 0 H LYS A 87 7.575 10.845 -7.793 1.00 0.00 H new ATOM 0 HA LYS A 87 6.742 13.110 -6.469 1.00 0.00 H new ATOM 0 HB2 LYS A 87 7.296 12.462 -9.351 1.00 0.00 H new ATOM 0 HB3 LYS A 87 6.572 14.013 -8.973 1.00 0.00 H new ATOM 0 HG2 LYS A 87 8.853 14.521 -8.990 1.00 0.00 H new ATOM 0 HG3 LYS A 87 8.543 14.295 -7.280 1.00 0.00 H new ATOM 0 HD2 LYS A 87 9.489 12.066 -7.305 1.00 0.00 H new ATOM 0 HD3 LYS A 87 9.523 12.025 -9.056 1.00 0.00 H new ATOM 0 HE2 LYS A 87 11.783 12.451 -8.163 1.00 0.00 H new ATOM 0 HE3 LYS A 87 11.227 13.825 -9.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 12.146 13.848 -6.522 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 11.391 15.127 -7.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 10.471 14.083 -6.373 1.00 0.00 H new ATOM 1417 N PRO A 88 4.272 12.238 -8.556 1.00 0.00 N ATOM 1418 CA PRO A 88 2.845 12.445 -8.758 1.00 0.00 C ATOM 1419 C PRO A 88 2.010 11.739 -7.690 1.00 0.00 C ATOM 1420 O PRO A 88 0.900 12.172 -7.384 1.00 0.00 O ATOM 1421 CB PRO A 88 2.542 11.892 -10.155 1.00 0.00 C ATOM 1422 CG PRO A 88 3.617 10.824 -10.350 1.00 0.00 C ATOM 1423 CD PRO A 88 4.824 11.438 -9.641 1.00 0.00 C ATOM 0 HA PRO A 88 2.587 13.501 -8.677 1.00 0.00 H new ATOM 0 HB2 PRO A 88 1.539 11.469 -10.211 1.00 0.00 H new ATOM 0 HB3 PRO A 88 2.603 12.669 -10.917 1.00 0.00 H new ATOM 0 HG2 PRO A 88 3.328 9.871 -9.907 1.00 0.00 H new ATOM 0 HG3 PRO A 88 3.817 10.638 -11.405 1.00 0.00 H new ATOM 0 HD2 PRO A 88 5.490 10.664 -9.259 1.00 0.00 H new ATOM 0 HD3 PRO A 88 5.409 12.054 -10.324 1.00 0.00 H new ATOM 1431 N LEU A 89 2.503 10.603 -7.198 1.00 0.00 N ATOM 1432 CA LEU A 89 1.809 9.830 -6.190 1.00 0.00 C ATOM 1433 C LEU A 89 1.774 10.615 -4.878 1.00 0.00 C ATOM 1434 O LEU A 89 0.741 10.721 -4.224 1.00 0.00 O ATOM 1435 CB LEU A 89 2.480 8.452 -6.087 1.00 0.00 C ATOM 1436 CG LEU A 89 1.574 7.355 -5.511 1.00 0.00 C ATOM 1437 CD1 LEU A 89 1.855 6.025 -6.219 1.00 0.00 C ATOM 1438 CD2 LEU A 89 1.802 7.198 -4.003 1.00 0.00 C ATOM 0 H LEU A 89 3.393 10.200 -7.491 1.00 0.00 H new ATOM 0 HA LEU A 89 0.767 9.655 -6.457 1.00 0.00 H new ATOM 0 HB2 LEU A 89 2.815 8.148 -7.079 1.00 0.00 H new ATOM 0 HB3 LEU A 89 3.369 8.539 -5.463 1.00 0.00 H new ATOM 0 HG LEU A 89 0.536 7.643 -5.676 1.00 0.00 H new ATOM 0 HD11 LEU A 89 1.209 5.250 -5.806 1.00 0.00 H new ATOM 0 HD12 LEU A 89 1.658 6.132 -7.286 1.00 0.00 H new ATOM 0 HD13 LEU A 89 2.898 5.746 -6.069 1.00 0.00 H new ATOM 0 HD21 LEU A 89 1.150 6.415 -3.616 1.00 0.00 H new ATOM 0 HD22 LEU A 89 2.842 6.928 -3.818 1.00 0.00 H new ATOM 0 HD23 LEU A 89 1.577 8.139 -3.501 1.00 0.00 H new ATOM 1450 N ALA A 90 2.903 11.213 -4.499 1.00 0.00 N ATOM 1451 CA ALA A 90 2.960 12.074 -3.333 1.00 0.00 C ATOM 1452 C ALA A 90 2.025 13.254 -3.579 1.00 0.00 C ATOM 1453 O ALA A 90 1.191 13.559 -2.734 1.00 0.00 O ATOM 1454 CB ALA A 90 4.388 12.551 -3.092 1.00 0.00 C ATOM 0 H ALA A 90 3.791 11.112 -4.990 1.00 0.00 H new ATOM 0 HA ALA A 90 2.646 11.530 -2.442 1.00 0.00 H new ATOM 0 HB1 ALA A 90 4.413 13.196 -2.214 1.00 0.00 H new ATOM 0 HB2 ALA A 90 5.036 11.690 -2.929 1.00 0.00 H new ATOM 0 HB3 ALA A 90 4.737 13.108 -3.961 1.00 0.00 H new ATOM 1460 N GLN A 91 2.155 13.915 -4.735 1.00 0.00 N ATOM 1461 CA GLN A 91 1.309 15.051 -5.079 1.00 0.00 C ATOM 1462 C GLN A 91 -0.179 14.721 -4.905 1.00 0.00 C ATOM 1463 O GLN A 91 -0.896 15.484 -4.256 1.00 0.00 O ATOM 1464 CB GLN A 91 1.624 15.528 -6.502 1.00 0.00 C ATOM 1465 CG GLN A 91 0.887 16.832 -6.840 1.00 0.00 C ATOM 1466 CD GLN A 91 1.287 17.353 -8.215 1.00 0.00 C ATOM 1467 OE1 GLN A 91 1.866 18.427 -8.337 1.00 0.00 O ATOM 1468 NE2 GLN A 91 0.984 16.598 -9.266 1.00 0.00 N ATOM 0 H GLN A 91 2.844 13.677 -5.448 1.00 0.00 H new ATOM 0 HA GLN A 91 1.529 15.866 -4.389 1.00 0.00 H new ATOM 0 HB2 GLN A 91 2.698 15.680 -6.605 1.00 0.00 H new ATOM 0 HB3 GLN A 91 1.341 14.755 -7.216 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -0.189 16.662 -6.812 1.00 0.00 H new ATOM 0 HG3 GLN A 91 1.110 17.585 -6.084 1.00 0.00 H new ATOM 0 HE21 GLN A 91 0.502 15.709 -9.133 1.00 0.00 H new ATOM 0 HE22 GLN A 91 1.234 16.908 -10.205 1.00 0.00 H new ATOM 1477 N SER A 92 -0.649 13.608 -5.479 1.00 0.00 N ATOM 1478 CA SER A 92 -2.046 13.207 -5.374 1.00 0.00 C ATOM 1479 C SER A 92 -2.418 12.994 -3.910 1.00 0.00 C ATOM 1480 O SER A 92 -3.322 13.652 -3.387 1.00 0.00 O ATOM 1481 CB SER A 92 -2.301 11.942 -6.202 1.00 0.00 C ATOM 1482 OG SER A 92 -1.504 10.876 -5.730 1.00 0.00 O ATOM 0 H SER A 92 -0.072 12.968 -6.024 1.00 0.00 H new ATOM 0 HA SER A 92 -2.677 14.000 -5.774 1.00 0.00 H new ATOM 0 HB2 SER A 92 -3.355 11.669 -6.146 1.00 0.00 H new ATOM 0 HB3 SER A 92 -2.077 12.135 -7.251 1.00 0.00 H new ATOM 0 HG SER A 92 -1.275 10.283 -6.476 1.00 0.00 H new ATOM 1488 N HIS A 93 -1.738 12.051 -3.252 1.00 0.00 N ATOM 1489 CA HIS A 93 -2.012 11.753 -1.854 1.00 0.00 C ATOM 1490 C HIS A 93 -1.950 12.990 -0.957 1.00 0.00 C ATOM 1491 O HIS A 93 -2.692 13.099 0.015 1.00 0.00 O ATOM 1492 CB HIS A 93 -1.189 10.571 -1.326 1.00 0.00 C ATOM 1493 CG HIS A 93 -1.490 9.285 -2.057 1.00 0.00 C ATOM 1494 ND1 HIS A 93 -1.244 9.077 -3.392 1.00 0.00 N ATOM 1495 CD2 HIS A 93 -2.262 8.235 -1.623 1.00 0.00 C ATOM 1496 CE1 HIS A 93 -1.849 7.944 -3.742 1.00 0.00 C ATOM 1497 NE2 HIS A 93 -2.472 7.384 -2.698 1.00 0.00 N ATOM 0 H HIS A 93 -0.998 11.486 -3.668 1.00 0.00 H new ATOM 0 HA HIS A 93 -3.050 11.423 -1.814 1.00 0.00 H new ATOM 0 HB2 HIS A 93 -0.128 10.800 -1.422 1.00 0.00 H new ATOM 0 HB3 HIS A 93 -1.392 10.437 -0.263 1.00 0.00 H new ATOM 0 HD1 HIS A 93 -0.697 9.681 -4.005 1.00 0.00 H new ATOM 0 HD2 HIS A 93 -2.639 8.096 -0.621 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -1.839 7.530 -4.739 1.00 0.00 H new ATOM 1505 N ALA A 94 -1.098 13.944 -1.322 1.00 0.00 N ATOM 1506 CA ALA A 94 -0.907 15.188 -0.603 1.00 0.00 C ATOM 1507 C ALA A 94 -2.111 16.107 -0.785 1.00 0.00 C ATOM 1508 O ALA A 94 -2.849 16.373 0.165 1.00 0.00 O ATOM 1509 CB ALA A 94 0.379 15.900 -1.048 1.00 0.00 C ATOM 0 H ALA A 94 -0.508 13.865 -2.150 1.00 0.00 H new ATOM 0 HA ALA A 94 -0.809 14.945 0.455 1.00 0.00 H new ATOM 0 HB1 ALA A 94 0.492 16.829 -0.490 1.00 0.00 H new ATOM 0 HB2 ALA A 94 1.237 15.255 -0.857 1.00 0.00 H new ATOM 0 HB3 ALA A 94 0.322 16.122 -2.114 1.00 0.00 H new ATOM 1515 N THR A 95 -2.256 16.637 -2.003 1.00 0.00 N ATOM 1516 CA THR A 95 -3.256 17.636 -2.345 1.00 0.00 C ATOM 1517 C THR A 95 -4.681 17.093 -2.369 1.00 0.00 C ATOM 1518 O THR A 95 -5.607 17.778 -1.939 1.00 0.00 O ATOM 1519 CB THR A 95 -2.921 18.261 -3.709 1.00 0.00 C ATOM 1520 OG1 THR A 95 -2.919 17.290 -4.737 1.00 0.00 O ATOM 1521 CG2 THR A 95 -1.562 18.965 -3.699 1.00 0.00 C ATOM 0 H THR A 95 -1.665 16.373 -2.792 1.00 0.00 H new ATOM 0 HA THR A 95 -3.222 18.388 -1.556 1.00 0.00 H new ATOM 0 HB THR A 95 -3.701 18.997 -3.903 1.00 0.00 H new ATOM 0 HG1 THR A 95 -2.153 16.690 -4.619 1.00 0.00 H new ATOM 0 HG21 THR A 95 -1.366 19.392 -4.683 1.00 0.00 H new ATOM 0 HG22 THR A 95 -1.570 19.760 -2.953 1.00 0.00 H new ATOM 0 HG23 THR A 95 -0.781 18.245 -3.454 1.00 0.00 H new ATOM 1529 N LYS A 96 -4.867 15.894 -2.922 1.00 0.00 N ATOM 1530 CA LYS A 96 -6.183 15.329 -3.151 1.00 0.00 C ATOM 1531 C LYS A 96 -6.579 14.383 -2.029 1.00 0.00 C ATOM 1532 O LYS A 96 -7.683 14.490 -1.500 1.00 0.00 O ATOM 1533 CB LYS A 96 -6.207 14.643 -4.528 1.00 0.00 C ATOM 1534 CG LYS A 96 -7.642 14.434 -5.030 1.00 0.00 C ATOM 1535 CD LYS A 96 -7.630 13.765 -6.412 1.00 0.00 C ATOM 1536 CE LYS A 96 -8.964 13.052 -6.669 1.00 0.00 C ATOM 1537 NZ LYS A 96 -8.943 12.309 -7.941 1.00 0.00 N ATOM 0 H LYS A 96 -4.101 15.291 -3.222 1.00 0.00 H new ATOM 0 HA LYS A 96 -6.925 16.127 -3.152 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -5.654 15.248 -5.246 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -5.699 13.681 -4.465 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -8.195 13.815 -4.324 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -8.158 15.392 -5.087 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -7.455 14.514 -7.185 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -6.810 13.049 -6.470 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -9.175 12.366 -5.849 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -9.771 13.784 -6.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -9.554 12.788 -8.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -7.970 12.272 -8.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -9.291 11.342 -7.784 1.00 0.00 H new ATOM 1551 N HIS A 97 -5.711 13.423 -1.693 1.00 0.00 N ATOM 1552 CA HIS A 97 -6.081 12.371 -0.744 1.00 0.00 C ATOM 1553 C HIS A 97 -5.779 12.691 0.721 1.00 0.00 C ATOM 1554 O HIS A 97 -5.703 11.779 1.539 1.00 0.00 O ATOM 1555 CB HIS A 97 -5.593 11.000 -1.220 1.00 0.00 C ATOM 1556 CG HIS A 97 -5.773 10.823 -2.721 1.00 0.00 C ATOM 1557 ND1 HIS A 97 -5.054 10.047 -3.583 1.00 0.00 N flip ATOM 1558 CD2 HIS A 97 -6.781 11.393 -3.459 1.00 0.00 C flip ATOM 1559 CE1 HIS A 97 -5.616 10.107 -4.834 1.00 0.00 C flip ATOM 1560 NE2 HIS A 97 -6.642 10.957 -4.724 1.00 0.00 N flip ATOM 0 H HIS A 97 -4.761 13.353 -2.058 1.00 0.00 H new ATOM 0 HA HIS A 97 -7.170 12.325 -0.742 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -4.540 10.880 -0.964 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -6.140 10.217 -0.694 1.00 0.00 H new ATOM 0 HD1 HIS A 97 -4.226 9.505 -3.336 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -7.543 12.065 -3.093 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -5.297 9.579 -5.720 1.00 0.00 H new ATOM 1569 N LYS A 98 -5.717 13.984 1.054 1.00 0.00 N ATOM 1570 CA LYS A 98 -5.592 14.503 2.409 1.00 0.00 C ATOM 1571 C LYS A 98 -4.322 14.018 3.112 1.00 0.00 C ATOM 1572 O LYS A 98 -4.355 13.161 3.993 1.00 0.00 O ATOM 1573 CB LYS A 98 -6.854 14.238 3.246 1.00 0.00 C ATOM 1574 CG LYS A 98 -8.135 14.835 2.637 1.00 0.00 C ATOM 1575 CD LYS A 98 -8.939 13.796 1.842 1.00 0.00 C ATOM 1576 CE LYS A 98 -10.186 14.402 1.188 1.00 0.00 C ATOM 1577 NZ LYS A 98 -9.829 15.399 0.163 1.00 0.00 N ATOM 0 H LYS A 98 -5.755 14.724 0.353 1.00 0.00 H new ATOM 0 HA LYS A 98 -5.494 15.584 2.315 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -6.984 13.162 3.361 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -6.710 14.650 4.245 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -8.758 15.242 3.433 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -7.871 15.666 1.983 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -8.303 13.360 1.072 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -9.237 12.985 2.506 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -10.781 13.610 0.734 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -10.807 14.870 1.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -10.650 15.576 -0.450 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -9.545 16.286 0.626 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -9.040 15.040 -0.411 1.00 0.00 H new ATOM 1591 N ILE A 99 -3.219 14.647 2.724 1.00 0.00 N ATOM 1592 CA ILE A 99 -1.867 14.525 3.244 1.00 0.00 C ATOM 1593 C ILE A 99 -1.454 13.383 4.196 1.00 0.00 C ATOM 1594 O ILE A 99 -0.715 12.514 3.736 1.00 0.00 O ATOM 1595 CB ILE A 99 -1.290 15.899 3.671 1.00 0.00 C ATOM 1596 CG1 ILE A 99 -2.372 16.959 3.979 1.00 0.00 C ATOM 1597 CG2 ILE A 99 -0.319 16.463 2.632 1.00 0.00 C ATOM 1598 CD1 ILE A 99 -1.816 18.161 4.752 1.00 0.00 C ATOM 0 H ILE A 99 -3.256 15.322 1.961 1.00 0.00 H new ATOM 0 HA ILE A 99 -1.381 14.139 2.348 1.00 0.00 H new ATOM 0 HB ILE A 99 -0.754 15.693 4.597 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -2.813 17.305 3.044 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -3.173 16.498 4.558 1.00 0.00 H new ATOM 0 HG21 ILE A 99 0.060 17.426 2.973 1.00 0.00 H new ATOM 0 HG22 ILE A 99 0.513 15.772 2.499 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -0.838 16.593 1.682 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -2.618 18.874 4.942 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -1.400 17.822 5.701 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -1.034 18.642 4.164 1.00 0.00 H new ATOM 1610 N PRO A 100 -1.726 13.441 5.513 1.00 0.00 N ATOM 1611 CA PRO A 100 -1.197 12.520 6.512 1.00 0.00 C ATOM 1612 C PRO A 100 -0.707 11.113 6.124 1.00 0.00 C ATOM 1613 O PRO A 100 -1.470 10.150 6.062 1.00 0.00 O ATOM 1614 CB PRO A 100 -2.238 12.499 7.626 1.00 0.00 C ATOM 1615 CG PRO A 100 -2.661 13.966 7.668 1.00 0.00 C ATOM 1616 CD PRO A 100 -2.528 14.442 6.215 1.00 0.00 C ATOM 0 HA PRO A 100 -0.221 12.917 6.789 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -3.073 11.837 7.396 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -1.818 12.165 8.575 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -3.683 14.075 8.030 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -2.023 14.545 8.336 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -3.509 14.546 5.751 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -2.050 15.420 6.171 1.00 0.00 H new ATOM 1624 N ILE A 101 0.624 10.977 6.027 1.00 0.00 N ATOM 1625 CA ILE A 101 1.383 9.746 5.766 1.00 0.00 C ATOM 1626 C ILE A 101 0.997 8.628 6.730 1.00 0.00 C ATOM 1627 O ILE A 101 1.160 7.451 6.429 1.00 0.00 O ATOM 1628 CB ILE A 101 2.881 10.077 5.918 1.00 0.00 C ATOM 1629 CG1 ILE A 101 3.199 10.982 4.730 1.00 0.00 C ATOM 1630 CG2 ILE A 101 3.801 8.853 5.936 1.00 0.00 C ATOM 1631 CD1 ILE A 101 4.668 11.379 4.581 1.00 0.00 C ATOM 0 H ILE A 101 1.241 11.782 6.137 1.00 0.00 H new ATOM 0 HA ILE A 101 1.159 9.392 4.760 1.00 0.00 H new ATOM 0 HB ILE A 101 3.063 10.548 6.884 1.00 0.00 H new ATOM 0 HG12 ILE A 101 2.882 10.478 3.817 1.00 0.00 H new ATOM 0 HG13 ILE A 101 2.602 11.890 4.817 1.00 0.00 H new ATOM 0 HG21 ILE A 101 4.836 9.177 6.046 1.00 0.00 H new ATOM 0 HG22 ILE A 101 3.532 8.208 6.772 1.00 0.00 H new ATOM 0 HG23 ILE A 101 3.691 8.301 5.002 1.00 0.00 H new ATOM 0 HD11 ILE A 101 4.785 12.021 3.708 1.00 0.00 H new ATOM 0 HD12 ILE A 101 4.992 11.916 5.472 1.00 0.00 H new ATOM 0 HD13 ILE A 101 5.276 10.483 4.456 1.00 0.00 H new ATOM 1643 N LYS A 102 0.468 9.012 7.885 1.00 0.00 N ATOM 1644 CA LYS A 102 -0.035 8.144 8.934 1.00 0.00 C ATOM 1645 C LYS A 102 -0.986 7.108 8.332 1.00 0.00 C ATOM 1646 O LYS A 102 -1.032 5.964 8.782 1.00 0.00 O ATOM 1647 CB LYS A 102 -0.731 9.007 9.996 1.00 0.00 C ATOM 1648 CG LYS A 102 -1.132 8.201 11.244 1.00 0.00 C ATOM 1649 CD LYS A 102 -2.606 8.398 11.629 1.00 0.00 C ATOM 1650 CE LYS A 102 -3.596 7.810 10.610 1.00 0.00 C ATOM 1651 NZ LYS A 102 -3.391 6.366 10.409 1.00 0.00 N ATOM 0 H LYS A 102 0.375 9.999 8.126 1.00 0.00 H new ATOM 0 HA LYS A 102 0.782 7.602 9.410 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -0.067 9.820 10.291 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -1.620 9.464 9.562 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -0.947 7.142 11.063 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -0.500 8.497 12.081 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -2.783 7.938 12.601 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -2.804 9.464 11.740 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -4.616 7.987 10.952 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -3.485 8.328 9.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -4.305 5.874 10.467 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -2.969 6.202 9.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -2.754 6.000 11.145 1.00 0.00 H new ATOM 1665 N TYR A 103 -1.787 7.500 7.338 1.00 0.00 N ATOM 1666 CA TYR A 103 -2.640 6.538 6.674 1.00 0.00 C ATOM 1667 C TYR A 103 -1.846 5.409 6.027 1.00 0.00 C ATOM 1668 O TYR A 103 -2.300 4.262 6.032 1.00 0.00 O ATOM 1669 CB TYR A 103 -3.552 7.267 5.690 1.00 0.00 C ATOM 1670 CG TYR A 103 -4.717 7.953 6.366 1.00 0.00 C ATOM 1671 CD1 TYR A 103 -5.652 7.181 7.078 1.00 0.00 C ATOM 1672 CD2 TYR A 103 -4.877 9.348 6.283 1.00 0.00 C ATOM 1673 CE1 TYR A 103 -6.755 7.791 7.691 1.00 0.00 C ATOM 1674 CE2 TYR A 103 -6.007 9.956 6.858 1.00 0.00 C ATOM 1675 CZ TYR A 103 -6.935 9.179 7.578 1.00 0.00 C ATOM 1676 OH TYR A 103 -8.028 9.765 8.140 1.00 0.00 O ATOM 0 H TYR A 103 -1.856 8.456 6.989 1.00 0.00 H new ATOM 0 HA TYR A 103 -3.267 6.048 7.419 1.00 0.00 H new ATOM 0 HB2 TYR A 103 -2.969 8.007 5.142 1.00 0.00 H new ATOM 0 HB3 TYR A 103 -3.932 6.554 4.958 1.00 0.00 H new ATOM 0 HD1 TYR A 103 -5.519 6.112 7.153 1.00 0.00 H new ATOM 0 HD2 TYR A 103 -4.135 9.950 5.780 1.00 0.00 H new ATOM 0 HE1 TYR A 103 -7.464 7.196 8.248 1.00 0.00 H new ATOM 0 HE2 TYR A 103 -6.163 11.019 6.747 1.00 0.00 H new ATOM 0 HH TYR A 103 -8.004 10.730 7.973 1.00 0.00 H new ATOM 1686 N LEU A 104 -0.652 5.698 5.506 1.00 0.00 N ATOM 1687 CA LEU A 104 0.160 4.631 4.930 1.00 0.00 C ATOM 1688 C LEU A 104 0.555 3.605 6.007 1.00 0.00 C ATOM 1689 O LEU A 104 0.768 2.433 5.697 1.00 0.00 O ATOM 1690 CB LEU A 104 1.360 5.177 4.142 1.00 0.00 C ATOM 1691 CG LEU A 104 0.985 6.295 3.151 1.00 0.00 C ATOM 1692 CD1 LEU A 104 2.230 6.912 2.507 1.00 0.00 C ATOM 1693 CD2 LEU A 104 0.028 5.858 2.044 1.00 0.00 C ATOM 0 H LEU A 104 -0.238 6.630 5.471 1.00 0.00 H new ATOM 0 HA LEU A 104 -0.448 4.101 4.196 1.00 0.00 H new ATOM 0 HB2 LEU A 104 2.103 5.558 4.843 1.00 0.00 H new ATOM 0 HB3 LEU A 104 1.828 4.359 3.595 1.00 0.00 H new ATOM 0 HG LEU A 104 0.464 7.034 3.760 1.00 0.00 H new ATOM 0 HD11 LEU A 104 1.930 7.697 1.813 1.00 0.00 H new ATOM 0 HD12 LEU A 104 2.868 7.337 3.282 1.00 0.00 H new ATOM 0 HD13 LEU A 104 2.780 6.141 1.967 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -0.184 6.705 1.391 1.00 0.00 H new ATOM 0 HD22 LEU A 104 0.485 5.057 1.463 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -0.901 5.500 2.487 1.00 0.00 H new ATOM 1705 N GLU A 105 0.571 3.987 7.290 1.00 0.00 N ATOM 1706 CA GLU A 105 0.849 3.039 8.364 1.00 0.00 C ATOM 1707 C GLU A 105 -0.301 2.036 8.494 1.00 0.00 C ATOM 1708 O GLU A 105 -0.099 0.898 8.924 1.00 0.00 O ATOM 1709 CB GLU A 105 1.082 3.758 9.699 1.00 0.00 C ATOM 1710 CG GLU A 105 2.227 4.773 9.613 1.00 0.00 C ATOM 1711 CD GLU A 105 2.497 5.405 10.975 1.00 0.00 C ATOM 1712 OE1 GLU A 105 1.625 6.178 11.428 1.00 0.00 O ATOM 1713 OE2 GLU A 105 3.576 5.114 11.538 1.00 0.00 O ATOM 0 H GLU A 105 0.395 4.942 7.604 1.00 0.00 H new ATOM 0 HA GLU A 105 1.763 2.502 8.110 1.00 0.00 H new ATOM 0 HB2 GLU A 105 0.167 4.268 10.000 1.00 0.00 H new ATOM 0 HB3 GLU A 105 1.306 3.023 10.472 1.00 0.00 H new ATOM 0 HG2 GLU A 105 3.129 4.280 9.251 1.00 0.00 H new ATOM 0 HG3 GLU A 105 1.977 5.550 8.890 1.00 0.00 H new ATOM 1720 N PHE A 106 -1.528 2.456 8.176 1.00 0.00 N ATOM 1721 CA PHE A 106 -2.637 1.534 8.227 1.00 0.00 C ATOM 1722 C PHE A 106 -2.559 0.540 7.070 1.00 0.00 C ATOM 1723 O PHE A 106 -2.791 -0.652 7.282 1.00 0.00 O ATOM 1724 CB PHE A 106 -3.982 2.272 8.306 1.00 0.00 C ATOM 1725 CG PHE A 106 -4.272 3.121 9.542 1.00 0.00 C ATOM 1726 CD1 PHE A 106 -3.622 2.878 10.770 1.00 0.00 C ATOM 1727 CD2 PHE A 106 -5.424 3.929 9.533 1.00 0.00 C ATOM 1728 CE1 PHE A 106 -4.156 3.383 11.970 1.00 0.00 C ATOM 1729 CE2 PHE A 106 -5.944 4.460 10.726 1.00 0.00 C ATOM 1730 CZ PHE A 106 -5.326 4.162 11.952 1.00 0.00 C ATOM 0 H PHE A 106 -1.764 3.406 7.889 1.00 0.00 H new ATOM 0 HA PHE A 106 -2.568 0.953 9.147 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -4.057 2.920 7.433 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -4.774 1.528 8.220 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -2.709 2.301 10.789 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -5.916 4.144 8.596 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -3.665 3.171 12.908 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -6.817 5.096 10.700 1.00 0.00 H new ATOM 0 HZ PHE A 106 -5.748 4.530 12.876 1.00 0.00 H new ATOM 1740 N ILE A 107 -2.231 0.986 5.850 1.00 0.00 N ATOM 1741 CA ILE A 107 -2.067 0.001 4.783 1.00 0.00 C ATOM 1742 C ILE A 107 -0.829 -0.857 5.046 1.00 0.00 C ATOM 1743 O ILE A 107 -0.761 -1.982 4.562 1.00 0.00 O ATOM 1744 CB ILE A 107 -2.103 0.584 3.358 1.00 0.00 C ATOM 1745 CG1 ILE A 107 -2.554 -0.498 2.366 1.00 0.00 C ATOM 1746 CG2 ILE A 107 -0.733 1.126 2.932 1.00 0.00 C ATOM 1747 CD1 ILE A 107 -2.836 0.082 0.977 1.00 0.00 C ATOM 0 H ILE A 107 -2.082 1.961 5.590 1.00 0.00 H new ATOM 0 HA ILE A 107 -2.947 -0.641 4.813 1.00 0.00 H new ATOM 0 HB ILE A 107 -2.811 1.413 3.356 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -1.783 -1.264 2.290 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -3.452 -0.986 2.745 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -0.799 1.529 1.921 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -0.425 1.915 3.618 1.00 0.00 H new ATOM 0 HG23 ILE A 107 0.000 0.320 2.954 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -3.152 -0.717 0.306 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -3.626 0.830 1.048 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -1.931 0.547 0.586 1.00 0.00 H new ATOM 1759 N SER A 108 0.183 -0.330 5.746 1.00 0.00 N ATOM 1760 CA SER A 108 1.337 -1.144 6.098 1.00 0.00 C ATOM 1761 C SER A 108 0.861 -2.365 6.885 1.00 0.00 C ATOM 1762 O SER A 108 1.199 -3.498 6.540 1.00 0.00 O ATOM 1763 CB SER A 108 2.363 -0.340 6.902 1.00 0.00 C ATOM 1764 OG SER A 108 2.881 0.717 6.122 1.00 0.00 O ATOM 0 H SER A 108 0.221 0.636 6.071 1.00 0.00 H new ATOM 0 HA SER A 108 1.834 -1.471 5.185 1.00 0.00 H new ATOM 0 HB2 SER A 108 1.897 0.059 7.803 1.00 0.00 H new ATOM 0 HB3 SER A 108 3.174 -0.993 7.225 1.00 0.00 H new ATOM 0 HG SER A 108 2.174 1.373 5.948 1.00 0.00 H new ATOM 1770 N GLU A 109 0.074 -2.123 7.939 1.00 0.00 N ATOM 1771 CA GLU A 109 -0.518 -3.196 8.723 1.00 0.00 C ATOM 1772 C GLU A 109 -1.263 -4.167 7.806 1.00 0.00 C ATOM 1773 O GLU A 109 -1.113 -5.381 7.938 1.00 0.00 O ATOM 1774 CB GLU A 109 -1.478 -2.621 9.768 1.00 0.00 C ATOM 1775 CG GLU A 109 -0.768 -1.801 10.853 1.00 0.00 C ATOM 1776 CD GLU A 109 -1.781 -1.011 11.675 1.00 0.00 C ATOM 1777 OE1 GLU A 109 -2.868 -1.578 11.924 1.00 0.00 O ATOM 1778 OE2 GLU A 109 -1.469 0.148 12.020 1.00 0.00 O ATOM 0 H GLU A 109 -0.165 -1.186 8.265 1.00 0.00 H new ATOM 0 HA GLU A 109 0.278 -3.735 9.237 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -2.214 -1.991 9.268 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -2.025 -3.438 10.238 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -0.200 -2.465 11.505 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -0.054 -1.119 10.392 1.00 0.00 H new ATOM 1785 N ALA A 110 -2.068 -3.635 6.882 1.00 0.00 N ATOM 1786 CA ALA A 110 -2.806 -4.463 5.943 1.00 0.00 C ATOM 1787 C ALA A 110 -1.857 -5.346 5.128 1.00 0.00 C ATOM 1788 O ALA A 110 -1.928 -6.567 5.247 1.00 0.00 O ATOM 1789 CB ALA A 110 -3.717 -3.610 5.058 1.00 0.00 C ATOM 0 H ALA A 110 -2.221 -2.633 6.770 1.00 0.00 H new ATOM 0 HA ALA A 110 -3.454 -5.133 6.508 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -4.258 -4.254 4.365 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -4.429 -3.070 5.682 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -3.114 -2.897 4.496 1.00 0.00 H new ATOM 1795 N ILE A 111 -0.890 -4.778 4.393 1.00 0.00 N ATOM 1796 CA ILE A 111 -0.036 -5.616 3.551 1.00 0.00 C ATOM 1797 C ILE A 111 0.715 -6.646 4.395 1.00 0.00 C ATOM 1798 O ILE A 111 0.732 -7.831 4.066 1.00 0.00 O ATOM 1799 CB ILE A 111 0.887 -4.837 2.590 1.00 0.00 C ATOM 1800 CG1 ILE A 111 2.200 -4.331 3.212 1.00 0.00 C ATOM 1801 CG2 ILE A 111 0.147 -3.692 1.889 1.00 0.00 C ATOM 1802 CD1 ILE A 111 3.113 -3.711 2.150 1.00 0.00 C ATOM 0 H ILE A 111 -0.687 -3.779 4.365 1.00 0.00 H new ATOM 0 HA ILE A 111 -0.707 -6.152 2.880 1.00 0.00 H new ATOM 0 HB ILE A 111 1.183 -5.580 1.849 1.00 0.00 H new ATOM 0 HG12 ILE A 111 1.979 -3.592 3.982 1.00 0.00 H new ATOM 0 HG13 ILE A 111 2.716 -5.157 3.701 1.00 0.00 H new ATOM 0 HG21 ILE A 111 0.833 -3.170 1.222 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -0.684 -4.096 1.311 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -0.235 -2.995 2.635 1.00 0.00 H new ATOM 0 HD11 ILE A 111 4.033 -3.363 2.620 1.00 0.00 H new ATOM 0 HD12 ILE A 111 3.352 -4.459 1.394 1.00 0.00 H new ATOM 0 HD13 ILE A 111 2.605 -2.870 1.679 1.00 0.00 H new ATOM 1814 N ILE A 112 1.219 -6.228 5.563 1.00 0.00 N ATOM 1815 CA ILE A 112 1.941 -7.133 6.445 1.00 0.00 C ATOM 1816 C ILE A 112 0.994 -8.273 6.838 1.00 0.00 C ATOM 1817 O ILE A 112 1.360 -9.447 6.776 1.00 0.00 O ATOM 1818 CB ILE A 112 2.514 -6.354 7.650 1.00 0.00 C ATOM 1819 CG1 ILE A 112 3.638 -5.420 7.157 1.00 0.00 C ATOM 1820 CG2 ILE A 112 3.075 -7.297 8.725 1.00 0.00 C ATOM 1821 CD1 ILE A 112 4.057 -4.382 8.203 1.00 0.00 C ATOM 0 H ILE A 112 1.137 -5.273 5.912 1.00 0.00 H new ATOM 0 HA ILE A 112 2.803 -7.577 5.946 1.00 0.00 H new ATOM 0 HB ILE A 112 1.703 -5.779 8.098 1.00 0.00 H new ATOM 0 HG12 ILE A 112 4.505 -6.019 6.880 1.00 0.00 H new ATOM 0 HG13 ILE A 112 3.306 -4.905 6.255 1.00 0.00 H new ATOM 0 HG21 ILE A 112 3.468 -6.710 9.555 1.00 0.00 H new ATOM 0 HG22 ILE A 112 2.281 -7.950 9.087 1.00 0.00 H new ATOM 0 HG23 ILE A 112 3.875 -7.901 8.297 1.00 0.00 H new ATOM 0 HD11 ILE A 112 4.851 -3.755 7.796 1.00 0.00 H new ATOM 0 HD12 ILE A 112 3.200 -3.760 8.462 1.00 0.00 H new ATOM 0 HD13 ILE A 112 4.419 -4.891 9.096 1.00 0.00 H new ATOM 1833 N HIS A 113 -0.248 -7.942 7.205 1.00 0.00 N ATOM 1834 CA HIS A 113 -1.220 -8.953 7.576 1.00 0.00 C ATOM 1835 C HIS A 113 -1.538 -9.891 6.404 1.00 0.00 C ATOM 1836 O HIS A 113 -1.597 -11.107 6.595 1.00 0.00 O ATOM 1837 CB HIS A 113 -2.484 -8.351 8.199 1.00 0.00 C ATOM 1838 CG HIS A 113 -3.286 -9.453 8.832 1.00 0.00 C ATOM 1839 ND1 HIS A 113 -2.844 -10.209 9.903 1.00 0.00 N ATOM 1840 CD2 HIS A 113 -4.230 -10.182 8.168 1.00 0.00 C ATOM 1841 CE1 HIS A 113 -3.515 -11.373 9.894 1.00 0.00 C ATOM 1842 NE2 HIS A 113 -4.380 -11.365 8.863 1.00 0.00 N ATOM 0 H HIS A 113 -0.595 -6.984 7.250 1.00 0.00 H new ATOM 0 HA HIS A 113 -0.760 -9.561 8.355 1.00 0.00 H new ATOM 0 HB2 HIS A 113 -2.217 -7.603 8.945 1.00 0.00 H new ATOM 0 HB3 HIS A 113 -3.076 -7.844 7.437 1.00 0.00 H new ATOM 0 HD2 HIS A 113 -4.757 -9.890 7.272 1.00 0.00 H new ATOM 0 HE1 HIS A 113 -3.382 -12.181 10.598 1.00 0.00 H new ATOM 0 HE2 HIS A 113 -5.038 -12.110 8.633 1.00 0.00 H new ATOM 1851 N VAL A 114 -1.726 -9.362 5.188 1.00 0.00 N ATOM 1852 CA VAL A 114 -1.999 -10.211 4.028 1.00 0.00 C ATOM 1853 C VAL A 114 -0.827 -11.171 3.828 1.00 0.00 C ATOM 1854 O VAL A 114 -1.044 -12.372 3.711 1.00 0.00 O ATOM 1855 CB VAL A 114 -2.343 -9.415 2.751 1.00 0.00 C ATOM 1856 CG1 VAL A 114 -2.637 -10.374 1.590 1.00 0.00 C ATOM 1857 CG2 VAL A 114 -3.601 -8.579 3.015 1.00 0.00 C ATOM 0 H VAL A 114 -1.694 -8.363 4.986 1.00 0.00 H new ATOM 0 HA VAL A 114 -2.901 -10.788 4.232 1.00 0.00 H new ATOM 0 HB VAL A 114 -1.498 -8.777 2.491 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -2.878 -9.799 0.696 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -1.760 -10.993 1.398 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -3.482 -11.012 1.850 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -3.855 -8.011 2.120 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -4.429 -9.239 3.273 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -3.414 -7.891 3.840 1.00 0.00 H new ATOM 1867 N LEU A 115 0.412 -10.668 3.844 1.00 0.00 N ATOM 1868 CA LEU A 115 1.599 -11.507 3.707 1.00 0.00 C ATOM 1869 C LEU A 115 1.614 -12.590 4.792 1.00 0.00 C ATOM 1870 O LEU A 115 1.847 -13.763 4.503 1.00 0.00 O ATOM 1871 CB LEU A 115 2.866 -10.648 3.757 1.00 0.00 C ATOM 1872 CG LEU A 115 2.965 -9.655 2.586 1.00 0.00 C ATOM 1873 CD1 LEU A 115 4.116 -8.692 2.871 1.00 0.00 C ATOM 1874 CD2 LEU A 115 3.227 -10.357 1.249 1.00 0.00 C ATOM 0 H LEU A 115 0.616 -9.674 3.952 1.00 0.00 H new ATOM 0 HA LEU A 115 1.571 -12.005 2.738 1.00 0.00 H new ATOM 0 HB2 LEU A 115 2.888 -10.096 4.697 1.00 0.00 H new ATOM 0 HB3 LEU A 115 3.740 -11.299 3.749 1.00 0.00 H new ATOM 0 HG LEU A 115 2.013 -9.131 2.503 1.00 0.00 H new ATOM 0 HD11 LEU A 115 4.204 -7.978 2.052 1.00 0.00 H new ATOM 0 HD12 LEU A 115 3.921 -8.156 3.800 1.00 0.00 H new ATOM 0 HD13 LEU A 115 5.046 -9.254 2.965 1.00 0.00 H new ATOM 0 HD21 LEU A 115 3.289 -9.614 0.454 1.00 0.00 H new ATOM 0 HD22 LEU A 115 4.166 -10.907 1.305 1.00 0.00 H new ATOM 0 HD23 LEU A 115 2.413 -11.050 1.036 1.00 0.00 H new ATOM 1886 N HIS A 116 1.351 -12.200 6.043 1.00 0.00 N ATOM 1887 CA HIS A 116 1.243 -13.125 7.166 1.00 0.00 C ATOM 1888 C HIS A 116 0.194 -14.205 6.869 1.00 0.00 C ATOM 1889 O HIS A 116 0.435 -15.378 7.145 1.00 0.00 O ATOM 1890 CB HIS A 116 0.930 -12.319 8.443 1.00 0.00 C ATOM 1891 CG HIS A 116 0.418 -13.065 9.656 1.00 0.00 C ATOM 1892 ND1 HIS A 116 0.159 -14.422 9.763 1.00 0.00 N ATOM 1893 CD2 HIS A 116 -0.002 -12.468 10.816 1.00 0.00 C ATOM 1894 CE1 HIS A 116 -0.402 -14.642 10.965 1.00 0.00 C ATOM 1895 NE2 HIS A 116 -0.499 -13.471 11.626 1.00 0.00 N ATOM 0 H HIS A 116 1.207 -11.224 6.303 1.00 0.00 H new ATOM 0 HA HIS A 116 2.185 -13.650 7.323 1.00 0.00 H new ATOM 0 HB2 HIS A 116 1.839 -11.794 8.735 1.00 0.00 H new ATOM 0 HB3 HIS A 116 0.192 -11.560 8.184 1.00 0.00 H new ATOM 0 HD1 HIS A 116 0.359 -15.129 9.055 1.00 0.00 H new ATOM 0 HD2 HIS A 116 0.046 -11.415 11.052 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -0.723 -15.602 11.341 1.00 0.00 H new ATOM 1904 N SER A 117 -0.966 -13.821 6.337 1.00 0.00 N ATOM 1905 CA SER A 117 -2.075 -14.737 6.094 1.00 0.00 C ATOM 1906 C SER A 117 -1.829 -15.679 4.912 1.00 0.00 C ATOM 1907 O SER A 117 -1.978 -16.893 5.033 1.00 0.00 O ATOM 1908 CB SER A 117 -3.352 -13.932 5.836 1.00 0.00 C ATOM 1909 OG SER A 117 -3.588 -13.053 6.913 1.00 0.00 O ATOM 0 H SER A 117 -1.162 -12.859 6.061 1.00 0.00 H new ATOM 0 HA SER A 117 -2.175 -15.357 6.985 1.00 0.00 H new ATOM 0 HB2 SER A 117 -3.256 -13.368 4.908 1.00 0.00 H new ATOM 0 HB3 SER A 117 -4.199 -14.606 5.713 1.00 0.00 H new ATOM 0 HG SER A 117 -2.942 -12.317 6.882 1.00 0.00 H new ATOM 1915 N ARG A 118 -1.512 -15.104 3.753 1.00 0.00 N ATOM 1916 CA ARG A 118 -1.380 -15.806 2.486 1.00 0.00 C ATOM 1917 C ARG A 118 -0.006 -16.438 2.277 1.00 0.00 C ATOM 1918 O ARG A 118 0.088 -17.449 1.574 1.00 0.00 O ATOM 1919 CB ARG A 118 -1.712 -14.850 1.332 1.00 0.00 C ATOM 1920 CG ARG A 118 -3.145 -14.305 1.431 1.00 0.00 C ATOM 1921 CD ARG A 118 -3.610 -13.663 0.117 1.00 0.00 C ATOM 1922 NE ARG A 118 -3.749 -14.678 -0.938 1.00 0.00 N ATOM 1923 CZ ARG A 118 -4.358 -14.495 -2.117 1.00 0.00 C ATOM 1924 NH1 ARG A 118 -4.863 -13.305 -2.454 1.00 0.00 N ATOM 1925 NH2 ARG A 118 -4.461 -15.514 -2.974 1.00 0.00 N ATOM 0 H ARG A 118 -1.335 -14.103 3.672 1.00 0.00 H new ATOM 0 HA ARG A 118 -2.089 -16.633 2.507 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -1.007 -14.019 1.335 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -1.587 -15.370 0.382 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -3.823 -15.116 1.698 1.00 0.00 H new ATOM 0 HG3 ARG A 118 -3.198 -13.568 2.233 1.00 0.00 H new ATOM 0 HD2 ARG A 118 -4.564 -13.158 0.271 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -2.894 -12.903 -0.195 1.00 0.00 H new ATOM 0 HE ARG A 118 -3.348 -15.598 -0.757 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -4.788 -12.518 -1.809 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -5.324 -13.183 -3.356 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -4.077 -16.427 -2.730 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -4.924 -15.380 -3.873 1.00 0.00 H new ATOM 1939 N HIS A 119 1.066 -15.871 2.852 1.00 0.00 N ATOM 1940 CA HIS A 119 2.395 -16.395 2.612 1.00 0.00 C ATOM 1941 C HIS A 119 3.194 -16.626 3.897 1.00 0.00 C ATOM 1942 O HIS A 119 4.349 -16.204 3.961 1.00 0.00 O ATOM 1943 CB HIS A 119 3.129 -15.464 1.634 1.00 0.00 C ATOM 1944 CG HIS A 119 2.329 -15.192 0.385 1.00 0.00 C ATOM 1945 ND1 HIS A 119 2.045 -16.119 -0.600 1.00 0.00 N ATOM 1946 CD2 HIS A 119 1.524 -14.107 0.184 1.00 0.00 C ATOM 1947 CE1 HIS A 119 1.078 -15.604 -1.380 1.00 0.00 C ATOM 1948 NE2 HIS A 119 0.750 -14.387 -0.921 1.00 0.00 N ATOM 0 H HIS A 119 1.028 -15.064 3.474 1.00 0.00 H new ATOM 0 HA HIS A 119 2.295 -17.384 2.165 1.00 0.00 H new ATOM 0 HB2 HIS A 119 3.350 -14.520 2.133 1.00 0.00 H new ATOM 0 HB3 HIS A 119 4.084 -15.911 1.359 1.00 0.00 H new ATOM 0 HD2 HIS A 119 1.499 -13.204 0.776 1.00 0.00 H new ATOM 0 HE1 HIS A 119 0.637 -16.091 -2.237 1.00 0.00 H new ATOM 0 HE2 HIS A 119 0.044 -13.771 -1.324 1.00 0.00 H new ATOM 1957 N PRO A 120 2.638 -17.289 4.927 1.00 0.00 N ATOM 1958 CA PRO A 120 3.356 -17.529 6.170 1.00 0.00 C ATOM 1959 C PRO A 120 4.638 -18.307 5.880 1.00 0.00 C ATOM 1960 O PRO A 120 5.711 -17.942 6.353 1.00 0.00 O ATOM 1961 CB PRO A 120 2.386 -18.287 7.083 1.00 0.00 C ATOM 1962 CG PRO A 120 1.365 -18.897 6.123 1.00 0.00 C ATOM 1963 CD PRO A 120 1.315 -17.886 4.978 1.00 0.00 C ATOM 0 HA PRO A 120 3.671 -16.609 6.662 1.00 0.00 H new ATOM 0 HB2 PRO A 120 2.900 -19.056 7.659 1.00 0.00 H new ATOM 0 HB3 PRO A 120 1.909 -17.618 7.799 1.00 0.00 H new ATOM 0 HG2 PRO A 120 1.677 -19.882 5.777 1.00 0.00 H new ATOM 0 HG3 PRO A 120 0.390 -19.019 6.596 1.00 0.00 H new ATOM 0 HD2 PRO A 120 1.068 -18.374 4.035 1.00 0.00 H new ATOM 0 HD3 PRO A 120 0.550 -17.130 5.156 1.00 0.00 H new ATOM 1971 N GLY A 121 4.527 -19.351 5.052 1.00 0.00 N ATOM 1972 CA GLY A 121 5.643 -20.185 4.628 1.00 0.00 C ATOM 1973 C GLY A 121 6.792 -19.410 3.974 1.00 0.00 C ATOM 1974 O GLY A 121 7.876 -19.969 3.815 1.00 0.00 O ATOM 0 H GLY A 121 3.635 -19.642 4.652 1.00 0.00 H new ATOM 0 HA2 GLY A 121 6.029 -20.724 5.493 1.00 0.00 H new ATOM 0 HA3 GLY A 121 5.277 -20.933 3.924 1.00 0.00 H new ATOM 1978 N ASP A 122 6.598 -18.132 3.625 1.00 0.00 N ATOM 1979 CA ASP A 122 7.637 -17.313 3.022 1.00 0.00 C ATOM 1980 C ASP A 122 7.676 -15.931 3.680 1.00 0.00 C ATOM 1981 O ASP A 122 8.204 -14.977 3.105 1.00 0.00 O ATOM 1982 CB ASP A 122 7.395 -17.273 1.507 1.00 0.00 C ATOM 1983 CG ASP A 122 8.546 -16.663 0.706 1.00 0.00 C ATOM 1984 OD1 ASP A 122 9.702 -16.752 1.172 1.00 0.00 O ATOM 1985 OD2 ASP A 122 8.244 -16.158 -0.399 1.00 0.00 O ATOM 0 H ASP A 122 5.712 -17.643 3.756 1.00 0.00 H new ATOM 0 HA ASP A 122 8.626 -17.740 3.189 1.00 0.00 H new ATOM 0 HB2 ASP A 122 7.217 -18.288 1.152 1.00 0.00 H new ATOM 0 HB3 ASP A 122 6.487 -16.703 1.310 1.00 0.00 H new ATOM 1990 N PHE A 123 7.179 -15.827 4.921 1.00 0.00 N ATOM 1991 CA PHE A 123 7.179 -14.584 5.663 1.00 0.00 C ATOM 1992 C PHE A 123 7.657 -14.860 7.089 1.00 0.00 C ATOM 1993 O PHE A 123 7.995 -15.996 7.425 1.00 0.00 O ATOM 1994 CB PHE A 123 5.798 -13.909 5.599 1.00 0.00 C ATOM 1995 CG PHE A 123 5.786 -12.419 5.920 1.00 0.00 C ATOM 1996 CD1 PHE A 123 6.540 -11.535 5.128 1.00 0.00 C ATOM 1997 CD2 PHE A 123 4.900 -11.897 6.882 1.00 0.00 C ATOM 1998 CE1 PHE A 123 6.454 -10.147 5.328 1.00 0.00 C ATOM 1999 CE2 PHE A 123 4.786 -10.503 7.058 1.00 0.00 C ATOM 2000 CZ PHE A 123 5.559 -9.624 6.276 1.00 0.00 C ATOM 0 H PHE A 123 6.768 -16.611 5.428 1.00 0.00 H new ATOM 0 HA PHE A 123 7.872 -13.872 5.215 1.00 0.00 H new ATOM 0 HB2 PHE A 123 5.388 -14.052 4.599 1.00 0.00 H new ATOM 0 HB3 PHE A 123 5.130 -14.419 6.293 1.00 0.00 H new ATOM 0 HD1 PHE A 123 7.190 -11.926 4.360 1.00 0.00 H new ATOM 0 HD2 PHE A 123 4.306 -12.566 7.487 1.00 0.00 H new ATOM 0 HE1 PHE A 123 7.078 -9.480 4.751 1.00 0.00 H new ATOM 0 HE2 PHE A 123 4.103 -10.108 7.796 1.00 0.00 H new ATOM 0 HZ PHE A 123 5.465 -8.556 6.404 1.00 0.00 H new ATOM 2010 N GLY A 124 7.639 -13.845 7.954 1.00 0.00 N ATOM 2011 CA GLY A 124 8.112 -14.003 9.311 1.00 0.00 C ATOM 2012 C GLY A 124 9.525 -13.481 9.416 1.00 0.00 C ATOM 2013 O GLY A 124 9.844 -12.484 8.767 1.00 0.00 O ATOM 0 H GLY A 124 7.300 -12.909 7.730 1.00 0.00 H new ATOM 0 HA2 GLY A 124 7.462 -13.463 9.999 1.00 0.00 H new ATOM 0 HA3 GLY A 124 8.079 -15.054 9.599 1.00 0.00 H new ATOM 2017 N ALA A 125 10.336 -14.133 10.257 1.00 0.00 N ATOM 2018 CA ALA A 125 11.702 -13.731 10.532 1.00 0.00 C ATOM 2019 C ALA A 125 12.401 -13.181 9.294 1.00 0.00 C ATOM 2020 O ALA A 125 12.421 -13.794 8.229 1.00 0.00 O ATOM 2021 CB ALA A 125 12.522 -14.865 11.135 1.00 0.00 C ATOM 0 H ALA A 125 10.048 -14.967 10.769 1.00 0.00 H new ATOM 0 HA ALA A 125 11.636 -12.929 11.267 1.00 0.00 H new ATOM 0 HB1 ALA A 125 13.538 -14.519 11.324 1.00 0.00 H new ATOM 0 HB2 ALA A 125 12.067 -15.185 12.072 1.00 0.00 H new ATOM 0 HB3 ALA A 125 12.549 -15.704 10.440 1.00 0.00 H new ATOM 2027 N ASP A 126 12.881 -11.954 9.449 1.00 0.00 N ATOM 2028 CA ASP A 126 13.580 -11.133 8.472 1.00 0.00 C ATOM 2029 C ASP A 126 12.661 -10.629 7.359 1.00 0.00 C ATOM 2030 O ASP A 126 12.746 -9.459 6.996 1.00 0.00 O ATOM 2031 CB ASP A 126 14.839 -11.837 7.961 1.00 0.00 C ATOM 2032 CG ASP A 126 15.573 -10.968 6.945 1.00 0.00 C ATOM 2033 OD1 ASP A 126 16.330 -10.081 7.396 1.00 0.00 O ATOM 2034 OD2 ASP A 126 15.356 -11.199 5.737 1.00 0.00 O ATOM 0 H ASP A 126 12.782 -11.467 10.340 1.00 0.00 H new ATOM 0 HA ASP A 126 13.917 -10.229 8.980 1.00 0.00 H new ATOM 0 HB2 ASP A 126 15.500 -12.062 8.798 1.00 0.00 H new ATOM 0 HB3 ASP A 126 14.568 -12.789 7.504 1.00 0.00 H new ATOM 2039 N ALA A 127 11.758 -11.461 6.829 1.00 0.00 N ATOM 2040 CA ALA A 127 10.824 -11.034 5.797 1.00 0.00 C ATOM 2041 C ALA A 127 10.010 -9.843 6.321 1.00 0.00 C ATOM 2042 O ALA A 127 9.976 -8.790 5.682 1.00 0.00 O ATOM 2043 CB ALA A 127 9.932 -12.198 5.378 1.00 0.00 C ATOM 0 H ALA A 127 11.659 -12.438 7.104 1.00 0.00 H new ATOM 0 HA ALA A 127 11.367 -10.713 4.908 1.00 0.00 H new ATOM 0 HB1 ALA A 127 9.238 -11.865 4.606 1.00 0.00 H new ATOM 0 HB2 ALA A 127 10.549 -13.007 4.987 1.00 0.00 H new ATOM 0 HB3 ALA A 127 9.370 -12.555 6.241 1.00 0.00 H new ATOM 2049 N GLN A 128 9.515 -9.922 7.568 1.00 0.00 N ATOM 2050 CA GLN A 128 8.759 -8.800 8.114 1.00 0.00 C ATOM 2051 C GLN A 128 9.616 -7.523 8.151 1.00 0.00 C ATOM 2052 O GLN A 128 9.172 -6.448 7.750 1.00 0.00 O ATOM 2053 CB GLN A 128 8.074 -9.085 9.464 1.00 0.00 C ATOM 2054 CG GLN A 128 8.804 -9.888 10.551 1.00 0.00 C ATOM 2055 CD GLN A 128 10.189 -9.363 10.900 1.00 0.00 C ATOM 2056 OE1 GLN A 128 11.193 -9.848 10.385 1.00 0.00 O ATOM 2057 NE2 GLN A 128 10.264 -8.350 11.756 1.00 0.00 N ATOM 0 H GLN A 128 9.622 -10.722 8.191 1.00 0.00 H new ATOM 0 HA GLN A 128 7.931 -8.637 7.423 1.00 0.00 H new ATOM 0 HB2 GLN A 128 7.807 -8.122 9.899 1.00 0.00 H new ATOM 0 HB3 GLN A 128 7.142 -9.607 9.249 1.00 0.00 H new ATOM 0 HG2 GLN A 128 8.193 -9.893 11.454 1.00 0.00 H new ATOM 0 HG3 GLN A 128 8.894 -10.923 10.222 1.00 0.00 H new ATOM 0 HE21 GLN A 128 9.413 -7.967 12.169 1.00 0.00 H new ATOM 0 HE22 GLN A 128 11.172 -7.955 12.001 1.00 0.00 H new ATOM 2066 N GLY A 129 10.871 -7.654 8.592 1.00 0.00 N ATOM 2067 CA GLY A 129 11.818 -6.553 8.661 1.00 0.00 C ATOM 2068 C GLY A 129 12.120 -5.996 7.272 1.00 0.00 C ATOM 2069 O GLY A 129 12.353 -4.799 7.109 1.00 0.00 O ATOM 0 H GLY A 129 11.256 -8.542 8.914 1.00 0.00 H new ATOM 0 HA2 GLY A 129 11.414 -5.762 9.293 1.00 0.00 H new ATOM 0 HA3 GLY A 129 12.742 -6.894 9.128 1.00 0.00 H new ATOM 2073 N ALA A 130 12.136 -6.873 6.270 1.00 0.00 N ATOM 2074 CA ALA A 130 12.396 -6.500 4.893 1.00 0.00 C ATOM 2075 C ALA A 130 11.252 -5.630 4.374 1.00 0.00 C ATOM 2076 O ALA A 130 11.493 -4.566 3.796 1.00 0.00 O ATOM 2077 CB ALA A 130 12.615 -7.760 4.058 1.00 0.00 C ATOM 0 H ALA A 130 11.966 -7.870 6.399 1.00 0.00 H new ATOM 0 HA ALA A 130 13.306 -5.905 4.820 1.00 0.00 H new ATOM 0 HB1 ALA A 130 12.811 -7.481 3.023 1.00 0.00 H new ATOM 0 HB2 ALA A 130 13.467 -8.314 4.452 1.00 0.00 H new ATOM 0 HB3 ALA A 130 11.724 -8.386 4.103 1.00 0.00 H new ATOM 2083 N MET A 131 10.008 -6.083 4.556 1.00 0.00 N ATOM 2084 CA MET A 131 8.873 -5.249 4.205 1.00 0.00 C ATOM 2085 C MET A 131 8.916 -3.942 4.981 1.00 0.00 C ATOM 2086 O MET A 131 8.729 -2.888 4.383 1.00 0.00 O ATOM 2087 CB MET A 131 7.540 -5.962 4.430 1.00 0.00 C ATOM 2088 CG MET A 131 7.416 -7.166 3.506 1.00 0.00 C ATOM 2089 SD MET A 131 7.469 -6.829 1.733 1.00 0.00 S ATOM 2090 CE MET A 131 7.586 -8.535 1.175 1.00 0.00 C ATOM 0 H MET A 131 9.772 -7.000 4.935 1.00 0.00 H new ATOM 0 HA MET A 131 8.946 -5.034 3.139 1.00 0.00 H new ATOM 0 HB2 MET A 131 7.464 -6.284 5.469 1.00 0.00 H new ATOM 0 HB3 MET A 131 6.716 -5.271 4.249 1.00 0.00 H new ATOM 0 HG2 MET A 131 8.219 -7.864 3.745 1.00 0.00 H new ATOM 0 HG3 MET A 131 6.477 -7.672 3.729 1.00 0.00 H new ATOM 0 HE1 MET A 131 7.756 -8.555 0.099 1.00 0.00 H new ATOM 0 HE2 MET A 131 8.415 -9.028 1.683 1.00 0.00 H new ATOM 0 HE3 MET A 131 6.658 -9.058 1.405 1.00 0.00 H new ATOM 2100 N ASN A 132 9.154 -3.994 6.293 1.00 0.00 N ATOM 2101 CA ASN A 132 9.241 -2.786 7.107 1.00 0.00 C ATOM 2102 C ASN A 132 10.250 -1.802 6.506 1.00 0.00 C ATOM 2103 O ASN A 132 9.938 -0.632 6.300 1.00 0.00 O ATOM 2104 CB ASN A 132 9.599 -3.136 8.552 1.00 0.00 C ATOM 2105 CG ASN A 132 9.811 -1.863 9.362 1.00 0.00 C ATOM 2106 OD1 ASN A 132 8.859 -1.272 9.857 1.00 0.00 O ATOM 2107 ND2 ASN A 132 11.058 -1.425 9.493 1.00 0.00 N ATOM 0 H ASN A 132 9.290 -4.861 6.812 1.00 0.00 H new ATOM 0 HA ASN A 132 8.265 -2.300 7.113 1.00 0.00 H new ATOM 0 HB2 ASN A 132 8.803 -3.732 8.998 1.00 0.00 H new ATOM 0 HB3 ASN A 132 10.503 -3.745 8.574 1.00 0.00 H new ATOM 0 HD21 ASN A 132 11.246 -0.572 10.019 1.00 0.00 H new ATOM 0 HD22 ASN A 132 11.827 -1.942 9.068 1.00 0.00 H new ATOM 2114 N LYS A 133 11.464 -2.266 6.208 1.00 0.00 N ATOM 2115 CA LYS A 133 12.483 -1.431 5.588 1.00 0.00 C ATOM 2116 C LYS A 133 11.961 -0.854 4.268 1.00 0.00 C ATOM 2117 O LYS A 133 11.990 0.358 4.060 1.00 0.00 O ATOM 2118 CB LYS A 133 13.760 -2.254 5.383 1.00 0.00 C ATOM 2119 CG LYS A 133 14.646 -2.303 6.636 1.00 0.00 C ATOM 2120 CD LYS A 133 15.378 -0.968 6.853 1.00 0.00 C ATOM 2121 CE LYS A 133 16.516 -1.085 7.873 1.00 0.00 C ATOM 2122 NZ LYS A 133 17.629 -1.907 7.363 1.00 0.00 N ATOM 0 H LYS A 133 11.763 -3.224 6.389 1.00 0.00 H new ATOM 0 HA LYS A 133 12.721 -0.591 6.240 1.00 0.00 H new ATOM 0 HB2 LYS A 133 13.489 -3.270 5.095 1.00 0.00 H new ATOM 0 HB3 LYS A 133 14.331 -1.830 4.557 1.00 0.00 H new ATOM 0 HG2 LYS A 133 14.034 -2.531 7.509 1.00 0.00 H new ATOM 0 HG3 LYS A 133 15.374 -3.108 6.538 1.00 0.00 H new ATOM 0 HD2 LYS A 133 15.780 -0.619 5.902 1.00 0.00 H new ATOM 0 HD3 LYS A 133 14.665 -0.217 7.193 1.00 0.00 H new ATOM 0 HE2 LYS A 133 16.884 -0.090 8.122 1.00 0.00 H new ATOM 0 HE3 LYS A 133 16.134 -1.523 8.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 18.465 -1.772 7.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 17.353 -2.910 7.373 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 17.855 -1.620 6.389 1.00 0.00 H new ATOM 2136 N ALA A 134 11.419 -1.702 3.393 1.00 0.00 N ATOM 2137 CA ALA A 134 10.877 -1.246 2.121 1.00 0.00 C ATOM 2138 C ALA A 134 9.798 -0.168 2.314 1.00 0.00 C ATOM 2139 O ALA A 134 9.759 0.839 1.605 1.00 0.00 O ATOM 2140 CB ALA A 134 10.337 -2.445 1.350 1.00 0.00 C ATOM 0 H ALA A 134 11.346 -2.708 3.546 1.00 0.00 H new ATOM 0 HA ALA A 134 11.676 -0.780 1.544 1.00 0.00 H new ATOM 0 HB1 ALA A 134 9.929 -2.111 0.396 1.00 0.00 H new ATOM 0 HB2 ALA A 134 11.144 -3.156 1.171 1.00 0.00 H new ATOM 0 HB3 ALA A 134 9.551 -2.927 1.931 1.00 0.00 H new ATOM 2146 N LEU A 135 8.915 -0.373 3.292 1.00 0.00 N ATOM 2147 CA LEU A 135 7.869 0.570 3.641 1.00 0.00 C ATOM 2148 C LEU A 135 8.496 1.860 4.156 1.00 0.00 C ATOM 2149 O LEU A 135 8.057 2.937 3.770 1.00 0.00 O ATOM 2150 CB LEU A 135 6.907 -0.038 4.673 1.00 0.00 C ATOM 2151 CG LEU A 135 5.964 -1.078 4.046 1.00 0.00 C ATOM 2152 CD1 LEU A 135 5.393 -1.965 5.156 1.00 0.00 C ATOM 2153 CD2 LEU A 135 4.824 -0.387 3.283 1.00 0.00 C ATOM 0 H LEU A 135 8.912 -1.214 3.869 1.00 0.00 H new ATOM 0 HA LEU A 135 7.283 0.801 2.751 1.00 0.00 H new ATOM 0 HB2 LEU A 135 7.482 -0.506 5.472 1.00 0.00 H new ATOM 0 HB3 LEU A 135 6.317 0.757 5.129 1.00 0.00 H new ATOM 0 HG LEU A 135 6.524 -1.688 3.337 1.00 0.00 H new ATOM 0 HD11 LEU A 135 4.723 -2.706 4.721 1.00 0.00 H new ATOM 0 HD12 LEU A 135 6.208 -2.472 5.672 1.00 0.00 H new ATOM 0 HD13 LEU A 135 4.841 -1.349 5.866 1.00 0.00 H new ATOM 0 HD21 LEU A 135 4.168 -1.141 2.847 1.00 0.00 H new ATOM 0 HD22 LEU A 135 4.253 0.237 3.970 1.00 0.00 H new ATOM 0 HD23 LEU A 135 5.241 0.234 2.490 1.00 0.00 H new ATOM 2165 N GLU A 136 9.564 1.773 4.953 1.00 0.00 N ATOM 2166 CA GLU A 136 10.250 2.941 5.491 1.00 0.00 C ATOM 2167 C GLU A 136 10.818 3.737 4.321 1.00 0.00 C ATOM 2168 O GLU A 136 10.630 4.947 4.262 1.00 0.00 O ATOM 2169 CB GLU A 136 11.352 2.549 6.484 1.00 0.00 C ATOM 2170 CG GLU A 136 10.780 2.132 7.848 1.00 0.00 C ATOM 2171 CD GLU A 136 11.851 1.600 8.801 1.00 0.00 C ATOM 2172 OE1 GLU A 136 13.024 1.515 8.374 1.00 0.00 O ATOM 2173 OE2 GLU A 136 11.476 1.272 9.947 1.00 0.00 O ATOM 0 H GLU A 136 9.975 0.885 5.242 1.00 0.00 H new ATOM 0 HA GLU A 136 9.541 3.552 6.050 1.00 0.00 H new ATOM 0 HB2 GLU A 136 11.937 1.727 6.070 1.00 0.00 H new ATOM 0 HB3 GLU A 136 12.033 3.389 6.619 1.00 0.00 H new ATOM 0 HG2 GLU A 136 10.285 2.988 8.306 1.00 0.00 H new ATOM 0 HG3 GLU A 136 10.019 1.366 7.699 1.00 0.00 H new ATOM 2180 N LEU A 137 11.484 3.070 3.371 1.00 0.00 N ATOM 2181 CA LEU A 137 12.003 3.740 2.184 1.00 0.00 C ATOM 2182 C LEU A 137 10.851 4.417 1.437 1.00 0.00 C ATOM 2183 O LEU A 137 10.894 5.620 1.181 1.00 0.00 O ATOM 2184 CB LEU A 137 12.720 2.757 1.242 1.00 0.00 C ATOM 2185 CG LEU A 137 14.057 2.202 1.763 1.00 0.00 C ATOM 2186 CD1 LEU A 137 14.538 1.107 0.802 1.00 0.00 C ATOM 2187 CD2 LEU A 137 15.134 3.291 1.844 1.00 0.00 C ATOM 0 H LEU A 137 11.673 2.068 3.406 1.00 0.00 H new ATOM 0 HA LEU A 137 12.731 4.483 2.508 1.00 0.00 H new ATOM 0 HB2 LEU A 137 12.052 1.920 1.041 1.00 0.00 H new ATOM 0 HB3 LEU A 137 12.900 3.257 0.290 1.00 0.00 H new ATOM 0 HG LEU A 137 13.896 1.809 2.767 1.00 0.00 H new ATOM 0 HD11 LEU A 137 15.486 0.702 1.157 1.00 0.00 H new ATOM 0 HD12 LEU A 137 13.796 0.309 0.759 1.00 0.00 H new ATOM 0 HD13 LEU A 137 14.674 1.530 -0.193 1.00 0.00 H new ATOM 0 HD21 LEU A 137 16.062 2.858 2.216 1.00 0.00 H new ATOM 0 HD22 LEU A 137 15.302 3.711 0.852 1.00 0.00 H new ATOM 0 HD23 LEU A 137 14.804 4.079 2.521 1.00 0.00 H new ATOM 2199 N PHE A 138 9.768 3.678 1.161 1.00 0.00 N ATOM 2200 CA PHE A 138 8.666 4.228 0.381 1.00 0.00 C ATOM 2201 C PHE A 138 8.108 5.468 1.095 1.00 0.00 C ATOM 2202 O PHE A 138 8.047 6.559 0.533 1.00 0.00 O ATOM 2203 CB PHE A 138 7.632 3.118 0.141 1.00 0.00 C ATOM 2204 CG PHE A 138 6.272 3.588 -0.332 1.00 0.00 C ATOM 2205 CD1 PHE A 138 6.086 4.078 -1.637 1.00 0.00 C ATOM 2206 CD2 PHE A 138 5.241 3.707 0.609 1.00 0.00 C ATOM 2207 CE1 PHE A 138 4.840 4.612 -2.026 1.00 0.00 C ATOM 2208 CE2 PHE A 138 4.003 4.252 0.231 1.00 0.00 C ATOM 2209 CZ PHE A 138 3.786 4.684 -1.091 1.00 0.00 C ATOM 0 H PHE A 138 9.638 2.713 1.464 1.00 0.00 H new ATOM 0 HA PHE A 138 8.993 4.569 -0.601 1.00 0.00 H new ATOM 0 HB2 PHE A 138 8.034 2.423 -0.596 1.00 0.00 H new ATOM 0 HB3 PHE A 138 7.502 2.559 1.068 1.00 0.00 H new ATOM 0 HD1 PHE A 138 6.901 4.045 -2.345 1.00 0.00 H new ATOM 0 HD2 PHE A 138 5.398 3.379 1.626 1.00 0.00 H new ATOM 0 HE1 PHE A 138 4.693 4.965 -3.036 1.00 0.00 H new ATOM 0 HE2 PHE A 138 3.211 4.340 0.960 1.00 0.00 H new ATOM 0 HZ PHE A 138 2.821 5.067 -1.387 1.00 0.00 H new ATOM 2219 N ARG A 139 7.788 5.314 2.380 1.00 0.00 N ATOM 2220 CA ARG A 139 7.280 6.360 3.253 1.00 0.00 C ATOM 2221 C ARG A 139 8.222 7.569 3.253 1.00 0.00 C ATOM 2222 O ARG A 139 7.790 8.708 3.109 1.00 0.00 O ATOM 2223 CB ARG A 139 7.143 5.758 4.659 1.00 0.00 C ATOM 2224 CG ARG A 139 6.532 6.731 5.665 1.00 0.00 C ATOM 2225 CD ARG A 139 6.438 6.067 7.040 1.00 0.00 C ATOM 2226 NE ARG A 139 5.848 6.982 8.022 1.00 0.00 N ATOM 2227 CZ ARG A 139 5.425 6.617 9.238 1.00 0.00 C ATOM 2228 NH1 ARG A 139 5.604 5.364 9.668 1.00 0.00 N ATOM 2229 NH2 ARG A 139 4.813 7.508 10.023 1.00 0.00 N ATOM 0 H ARG A 139 7.882 4.417 2.856 1.00 0.00 H new ATOM 0 HA ARG A 139 6.311 6.717 2.904 1.00 0.00 H new ATOM 0 HB2 ARG A 139 6.525 4.862 4.606 1.00 0.00 H new ATOM 0 HB3 ARG A 139 8.126 5.447 5.013 1.00 0.00 H new ATOM 0 HG2 ARG A 139 7.141 7.633 5.728 1.00 0.00 H new ATOM 0 HG3 ARG A 139 5.541 7.038 5.331 1.00 0.00 H new ATOM 0 HD2 ARG A 139 5.834 5.162 6.971 1.00 0.00 H new ATOM 0 HD3 ARG A 139 7.431 5.763 7.371 1.00 0.00 H new ATOM 0 HE ARG A 139 5.754 7.963 7.761 1.00 0.00 H new ATOM 0 HH11 ARG A 139 6.065 4.680 9.068 1.00 0.00 H new ATOM 0 HH12 ARG A 139 5.279 5.092 10.596 1.00 0.00 H new ATOM 0 HH21 ARG A 139 4.669 8.463 9.695 1.00 0.00 H new ATOM 0 HH22 ARG A 139 4.489 7.233 10.950 1.00 0.00 H new ATOM 2243 N LYS A 140 9.525 7.329 3.407 1.00 0.00 N ATOM 2244 CA LYS A 140 10.525 8.382 3.403 1.00 0.00 C ATOM 2245 C LYS A 140 10.501 9.114 2.061 1.00 0.00 C ATOM 2246 O LYS A 140 10.665 10.333 2.033 1.00 0.00 O ATOM 2247 CB LYS A 140 11.907 7.793 3.728 1.00 0.00 C ATOM 2248 CG LYS A 140 13.054 8.817 3.723 1.00 0.00 C ATOM 2249 CD LYS A 140 12.840 10.034 4.636 1.00 0.00 C ATOM 2250 CE LYS A 140 12.635 9.637 6.102 1.00 0.00 C ATOM 2251 NZ LYS A 140 12.545 10.826 6.967 1.00 0.00 N ATOM 0 H LYS A 140 9.911 6.394 3.538 1.00 0.00 H new ATOM 0 HA LYS A 140 10.298 9.116 4.176 1.00 0.00 H new ATOM 0 HB2 LYS A 140 11.864 7.319 4.709 1.00 0.00 H new ATOM 0 HB3 LYS A 140 12.133 7.010 3.005 1.00 0.00 H new ATOM 0 HG2 LYS A 140 13.973 8.313 4.023 1.00 0.00 H new ATOM 0 HG3 LYS A 140 13.203 9.169 2.702 1.00 0.00 H new ATOM 0 HD2 LYS A 140 13.701 10.698 4.559 1.00 0.00 H new ATOM 0 HD3 LYS A 140 11.972 10.596 4.290 1.00 0.00 H new ATOM 0 HE2 LYS A 140 11.725 9.045 6.197 1.00 0.00 H new ATOM 0 HE3 LYS A 140 13.462 9.007 6.430 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 12.406 10.528 7.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 13.424 11.377 6.892 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 11.741 11.414 6.667 1.00 0.00 H new ATOM 2265 N ASP A 141 10.269 8.399 0.953 1.00 0.00 N ATOM 2266 CA ASP A 141 10.203 9.045 -0.347 1.00 0.00 C ATOM 2267 C ASP A 141 9.018 10.005 -0.324 1.00 0.00 C ATOM 2268 O ASP A 141 9.175 11.177 -0.655 1.00 0.00 O ATOM 2269 CB ASP A 141 10.117 8.037 -1.511 1.00 0.00 C ATOM 2270 CG ASP A 141 11.280 7.050 -1.556 1.00 0.00 C ATOM 2271 OD1 ASP A 141 12.420 7.496 -1.305 1.00 0.00 O ATOM 2272 OD2 ASP A 141 11.009 5.875 -1.889 1.00 0.00 O ATOM 0 H ASP A 141 10.127 7.389 0.938 1.00 0.00 H new ATOM 0 HA ASP A 141 11.126 9.595 -0.529 1.00 0.00 H new ATOM 0 HB2 ASP A 141 9.183 7.481 -1.430 1.00 0.00 H new ATOM 0 HB3 ASP A 141 10.081 8.585 -2.452 1.00 0.00 H new ATOM 2277 N ILE A 142 7.840 9.516 0.078 1.00 0.00 N ATOM 2278 CA ILE A 142 6.633 10.338 0.178 1.00 0.00 C ATOM 2279 C ILE A 142 6.915 11.572 1.040 1.00 0.00 C ATOM 2280 O ILE A 142 6.635 12.693 0.633 1.00 0.00 O ATOM 2281 CB ILE A 142 5.435 9.544 0.741 1.00 0.00 C ATOM 2282 CG1 ILE A 142 5.179 8.225 0.007 1.00 0.00 C ATOM 2283 CG2 ILE A 142 4.168 10.399 0.741 1.00 0.00 C ATOM 2284 CD1 ILE A 142 4.575 8.391 -1.387 1.00 0.00 C ATOM 0 H ILE A 142 7.698 8.541 0.342 1.00 0.00 H new ATOM 0 HA ILE A 142 6.360 10.655 -0.829 1.00 0.00 H new ATOM 0 HB ILE A 142 5.702 9.286 1.766 1.00 0.00 H new ATOM 0 HG12 ILE A 142 6.120 7.682 -0.079 1.00 0.00 H new ATOM 0 HG13 ILE A 142 4.510 7.611 0.610 1.00 0.00 H new ATOM 0 HG21 ILE A 142 3.337 9.818 1.142 1.00 0.00 H new ATOM 0 HG22 ILE A 142 4.325 11.282 1.360 1.00 0.00 H new ATOM 0 HG23 ILE A 142 3.937 10.707 -0.279 1.00 0.00 H new ATOM 0 HD11 ILE A 142 4.425 7.410 -1.838 1.00 0.00 H new ATOM 0 HD12 ILE A 142 3.617 8.905 -1.310 1.00 0.00 H new ATOM 0 HD13 ILE A 142 5.252 8.977 -2.009 1.00 0.00 H new ATOM 2296 N ALA A 143 7.504 11.367 2.217 1.00 0.00 N ATOM 2297 CA ALA A 143 7.827 12.425 3.164 1.00 0.00 C ATOM 2298 C ALA A 143 8.725 13.479 2.515 1.00 0.00 C ATOM 2299 O ALA A 143 8.480 14.679 2.635 1.00 0.00 O ATOM 2300 CB ALA A 143 8.495 11.822 4.400 1.00 0.00 C ATOM 0 H ALA A 143 7.775 10.439 2.543 1.00 0.00 H new ATOM 0 HA ALA A 143 6.906 12.921 3.470 1.00 0.00 H new ATOM 0 HB1 ALA A 143 8.736 12.616 5.107 1.00 0.00 H new ATOM 0 HB2 ALA A 143 7.816 11.111 4.870 1.00 0.00 H new ATOM 0 HB3 ALA A 143 9.410 11.309 4.105 1.00 0.00 H new ATOM 2306 N ALA A 144 9.775 13.031 1.826 1.00 0.00 N ATOM 2307 CA ALA A 144 10.654 13.931 1.108 1.00 0.00 C ATOM 2308 C ALA A 144 9.878 14.679 0.024 1.00 0.00 C ATOM 2309 O ALA A 144 10.104 15.871 -0.180 1.00 0.00 O ATOM 2310 CB ALA A 144 11.833 13.145 0.536 1.00 0.00 C ATOM 0 H ALA A 144 10.031 12.046 1.755 1.00 0.00 H new ATOM 0 HA ALA A 144 11.052 14.682 1.791 1.00 0.00 H new ATOM 0 HB1 ALA A 144 12.494 13.823 -0.004 1.00 0.00 H new ATOM 0 HB2 ALA A 144 12.384 12.672 1.349 1.00 0.00 H new ATOM 0 HB3 ALA A 144 11.463 12.379 -0.145 1.00 0.00 H new ATOM 2316 N LYS A 145 8.971 13.998 -0.684 1.00 0.00 N ATOM 2317 CA LYS A 145 8.171 14.687 -1.687 1.00 0.00 C ATOM 2318 C LYS A 145 7.311 15.756 -1.014 1.00 0.00 C ATOM 2319 O LYS A 145 7.314 16.898 -1.460 1.00 0.00 O ATOM 2320 CB LYS A 145 7.309 13.731 -2.507 1.00 0.00 C ATOM 2321 CG LYS A 145 8.027 12.678 -3.365 1.00 0.00 C ATOM 2322 CD LYS A 145 9.224 13.181 -4.189 1.00 0.00 C ATOM 2323 CE LYS A 145 10.577 13.159 -3.456 1.00 0.00 C ATOM 2324 NZ LYS A 145 10.888 11.844 -2.871 1.00 0.00 N ATOM 0 H LYS A 145 8.780 13.001 -0.583 1.00 0.00 H new ATOM 0 HA LYS A 145 8.857 15.161 -2.389 1.00 0.00 H new ATOM 0 HB2 LYS A 145 6.644 13.207 -1.821 1.00 0.00 H new ATOM 0 HB3 LYS A 145 6.680 14.329 -3.167 1.00 0.00 H new ATOM 0 HG2 LYS A 145 8.373 11.879 -2.710 1.00 0.00 H new ATOM 0 HG3 LYS A 145 7.300 12.238 -4.048 1.00 0.00 H new ATOM 0 HD2 LYS A 145 9.306 12.573 -5.090 1.00 0.00 H new ATOM 0 HD3 LYS A 145 9.020 14.202 -4.512 1.00 0.00 H new ATOM 0 HE2 LYS A 145 11.367 13.437 -4.153 1.00 0.00 H new ATOM 0 HE3 LYS A 145 10.569 13.910 -2.666 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 11.879 11.830 -2.555 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 10.263 11.669 -2.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 10.742 11.103 -3.586 1.00 0.00 H new ATOM 2338 N TYR A 146 6.650 15.421 0.096 1.00 0.00 N ATOM 2339 CA TYR A 146 5.821 16.350 0.853 1.00 0.00 C ATOM 2340 C TYR A 146 6.663 17.567 1.240 1.00 0.00 C ATOM 2341 O TYR A 146 6.276 18.705 0.981 1.00 0.00 O ATOM 2342 CB TYR A 146 5.250 15.648 2.094 1.00 0.00 C ATOM 2343 CG TYR A 146 4.027 14.767 1.893 1.00 0.00 C ATOM 2344 CD1 TYR A 146 3.699 14.241 0.624 1.00 0.00 C ATOM 2345 CD2 TYR A 146 3.196 14.466 2.996 1.00 0.00 C ATOM 2346 CE1 TYR A 146 2.572 13.416 0.468 1.00 0.00 C ATOM 2347 CE2 TYR A 146 2.083 13.631 2.828 1.00 0.00 C ATOM 2348 CZ TYR A 146 1.757 13.118 1.564 1.00 0.00 C ATOM 2349 OH TYR A 146 0.678 12.303 1.398 1.00 0.00 O ATOM 0 H TYR A 146 6.678 14.483 0.496 1.00 0.00 H new ATOM 0 HA TYR A 146 4.981 16.686 0.245 1.00 0.00 H new ATOM 0 HB2 TYR A 146 6.040 15.035 2.529 1.00 0.00 H new ATOM 0 HB3 TYR A 146 4.998 16.413 2.829 1.00 0.00 H new ATOM 0 HD1 TYR A 146 4.317 14.474 -0.230 1.00 0.00 H new ATOM 0 HD2 TYR A 146 3.419 14.880 3.968 1.00 0.00 H new ATOM 0 HE1 TYR A 146 2.334 13.010 -0.504 1.00 0.00 H new ATOM 0 HE2 TYR A 146 1.470 13.380 3.681 1.00 0.00 H new ATOM 0 HH TYR A 146 0.170 12.258 2.235 1.00 0.00 H new ATOM 2359 N LYS A 147 7.845 17.339 1.819 1.00 0.00 N ATOM 2360 CA LYS A 147 8.738 18.421 2.201 1.00 0.00 C ATOM 2361 C LYS A 147 9.095 19.293 0.990 1.00 0.00 C ATOM 2362 O LYS A 147 9.017 20.516 1.078 1.00 0.00 O ATOM 2363 CB LYS A 147 9.979 17.845 2.897 1.00 0.00 C ATOM 2364 CG LYS A 147 10.870 18.962 3.461 1.00 0.00 C ATOM 2365 CD LYS A 147 11.942 18.426 4.419 1.00 0.00 C ATOM 2366 CE LYS A 147 12.913 17.465 3.724 1.00 0.00 C ATOM 2367 NZ LYS A 147 14.003 17.059 4.631 1.00 0.00 N ATOM 0 H LYS A 147 8.201 16.407 2.032 1.00 0.00 H new ATOM 0 HA LYS A 147 8.232 19.075 2.911 1.00 0.00 H new ATOM 0 HB2 LYS A 147 9.671 17.180 3.704 1.00 0.00 H new ATOM 0 HB3 LYS A 147 10.550 17.244 2.189 1.00 0.00 H new ATOM 0 HG2 LYS A 147 11.353 19.489 2.638 1.00 0.00 H new ATOM 0 HG3 LYS A 147 10.249 19.689 3.985 1.00 0.00 H new ATOM 0 HD2 LYS A 147 12.500 19.262 4.841 1.00 0.00 H new ATOM 0 HD3 LYS A 147 11.459 17.913 5.251 1.00 0.00 H new ATOM 0 HE2 LYS A 147 12.373 16.582 3.383 1.00 0.00 H new ATOM 0 HE3 LYS A 147 13.332 17.944 2.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 14.644 16.409 4.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 14.532 17.901 4.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 13.602 16.581 5.463 1.00 0.00 H new ATOM 2381 N GLU A 148 9.486 18.678 -0.130 1.00 0.00 N ATOM 2382 CA GLU A 148 9.816 19.396 -1.358 1.00 0.00 C ATOM 2383 C GLU A 148 8.630 20.240 -1.842 1.00 0.00 C ATOM 2384 O GLU A 148 8.794 21.411 -2.174 1.00 0.00 O ATOM 2385 CB GLU A 148 10.254 18.388 -2.426 1.00 0.00 C ATOM 2386 CG GLU A 148 11.635 17.788 -2.125 1.00 0.00 C ATOM 2387 CD GLU A 148 11.881 16.490 -2.892 1.00 0.00 C ATOM 2388 OE1 GLU A 148 11.318 16.359 -4.003 1.00 0.00 O ATOM 2389 OE2 GLU A 148 12.627 15.643 -2.355 1.00 0.00 O ATOM 0 H GLU A 148 9.582 17.665 -0.208 1.00 0.00 H new ATOM 0 HA GLU A 148 10.637 20.086 -1.161 1.00 0.00 H new ATOM 0 HB2 GLU A 148 9.518 17.587 -2.491 1.00 0.00 H new ATOM 0 HB3 GLU A 148 10.277 18.879 -3.399 1.00 0.00 H new ATOM 0 HG2 GLU A 148 12.408 18.512 -2.383 1.00 0.00 H new ATOM 0 HG3 GLU A 148 11.721 17.598 -1.055 1.00 0.00 H new ATOM 2396 N LEU A 149 7.435 19.647 -1.881 1.00 0.00 N ATOM 2397 CA LEU A 149 6.210 20.326 -2.280 1.00 0.00 C ATOM 2398 C LEU A 149 5.840 21.422 -1.275 1.00 0.00 C ATOM 2399 O LEU A 149 5.182 22.392 -1.642 1.00 0.00 O ATOM 2400 CB LEU A 149 5.072 19.301 -2.448 1.00 0.00 C ATOM 2401 CG LEU A 149 5.298 18.296 -3.592 1.00 0.00 C ATOM 2402 CD1 LEU A 149 4.259 17.173 -3.491 1.00 0.00 C ATOM 2403 CD2 LEU A 149 5.183 18.962 -4.970 1.00 0.00 C ATOM 0 H LEU A 149 7.294 18.668 -1.632 1.00 0.00 H new ATOM 0 HA LEU A 149 6.373 20.814 -3.241 1.00 0.00 H new ATOM 0 HB2 LEU A 149 4.951 18.752 -1.514 1.00 0.00 H new ATOM 0 HB3 LEU A 149 4.139 19.835 -2.627 1.00 0.00 H new ATOM 0 HG LEU A 149 6.308 17.898 -3.492 1.00 0.00 H new ATOM 0 HD11 LEU A 149 4.415 16.459 -4.299 1.00 0.00 H new ATOM 0 HD12 LEU A 149 4.364 16.665 -2.532 1.00 0.00 H new ATOM 0 HD13 LEU A 149 3.257 17.596 -3.569 1.00 0.00 H new ATOM 0 HD21 LEU A 149 5.349 18.218 -5.749 1.00 0.00 H new ATOM 0 HD22 LEU A 149 4.188 19.391 -5.085 1.00 0.00 H new ATOM 0 HD23 LEU A 149 5.930 19.751 -5.056 1.00 0.00 H new ATOM 2415 N GLY A 150 6.215 21.249 -0.005 1.00 0.00 N ATOM 2416 CA GLY A 150 5.949 22.184 1.077 1.00 0.00 C ATOM 2417 C GLY A 150 4.696 21.779 1.845 1.00 0.00 C ATOM 2418 O GLY A 150 3.796 22.589 2.046 1.00 0.00 O ATOM 0 H GLY A 150 6.730 20.424 0.303 1.00 0.00 H new ATOM 0 HA2 GLY A 150 6.802 22.216 1.755 1.00 0.00 H new ATOM 0 HA3 GLY A 150 5.825 23.189 0.673 1.00 0.00 H new ATOM 2422 N TYR A 151 4.638 20.516 2.278 1.00 0.00 N ATOM 2423 CA TYR A 151 3.524 19.939 3.015 1.00 0.00 C ATOM 2424 C TYR A 151 4.068 19.180 4.218 1.00 0.00 C ATOM 2425 O TYR A 151 5.033 18.433 4.090 1.00 0.00 O ATOM 2426 CB TYR A 151 2.724 18.983 2.118 1.00 0.00 C ATOM 2427 CG TYR A 151 1.887 19.673 1.059 1.00 0.00 C ATOM 2428 CD1 TYR A 151 2.507 20.233 -0.070 1.00 0.00 C ATOM 2429 CD2 TYR A 151 0.486 19.744 1.188 1.00 0.00 C ATOM 2430 CE1 TYR A 151 1.744 20.902 -1.040 1.00 0.00 C ATOM 2431 CE2 TYR A 151 -0.284 20.352 0.181 1.00 0.00 C ATOM 2432 CZ TYR A 151 0.350 20.974 -0.907 1.00 0.00 C ATOM 2433 OH TYR A 151 -0.378 21.693 -1.808 1.00 0.00 O ATOM 0 H TYR A 151 5.393 19.850 2.117 1.00 0.00 H new ATOM 0 HA TYR A 151 2.860 20.738 3.346 1.00 0.00 H new ATOM 0 HB2 TYR A 151 3.417 18.299 1.628 1.00 0.00 H new ATOM 0 HB3 TYR A 151 2.069 18.378 2.745 1.00 0.00 H new ATOM 0 HD1 TYR A 151 3.577 20.148 -0.193 1.00 0.00 H new ATOM 0 HD2 TYR A 151 0.003 19.331 2.061 1.00 0.00 H new ATOM 0 HE1 TYR A 151 2.230 21.361 -1.888 1.00 0.00 H new ATOM 0 HE2 TYR A 151 -1.362 20.341 0.244 1.00 0.00 H new ATOM 0 HH TYR A 151 -1.329 21.641 -1.576 1.00 0.00 H new ATOM 2443 N GLN A 152 3.405 19.318 5.368 1.00 0.00 N ATOM 2444 CA GLN A 152 3.797 18.675 6.611 1.00 0.00 C ATOM 2445 C GLN A 152 3.477 17.177 6.549 1.00 0.00 C ATOM 2446 O GLN A 152 4.371 16.342 6.643 1.00 0.00 O ATOM 2447 CB GLN A 152 3.092 19.349 7.805 1.00 0.00 C ATOM 2448 CG GLN A 152 3.359 20.864 7.890 1.00 0.00 C ATOM 2449 CD GLN A 152 2.493 21.711 6.955 1.00 0.00 C ATOM 2450 OE1 GLN A 152 1.601 21.202 6.281 1.00 0.00 O ATOM 2451 NE2 GLN A 152 2.758 23.011 6.883 1.00 0.00 N ATOM 0 H GLN A 152 2.566 19.891 5.457 1.00 0.00 H new ATOM 0 HA GLN A 152 4.872 18.787 6.750 1.00 0.00 H new ATOM 0 HB2 GLN A 152 2.018 19.180 7.728 1.00 0.00 H new ATOM 0 HB3 GLN A 152 3.424 18.876 8.729 1.00 0.00 H new ATOM 0 HG2 GLN A 152 3.194 21.193 8.916 1.00 0.00 H new ATOM 0 HG3 GLN A 152 4.408 21.049 7.661 1.00 0.00 H new ATOM 0 HE21 GLN A 152 3.504 23.412 7.452 1.00 0.00 H new ATOM 0 HE22 GLN A 152 2.216 23.608 6.259 1.00 0.00 H new ATOM 2460 N GLY A 153 2.181 16.852 6.439 1.00 0.00 N ATOM 2461 CA GLY A 153 1.630 15.500 6.369 1.00 0.00 C ATOM 2462 C GLY A 153 2.498 14.414 7.005 1.00 0.00 C ATOM 2463 O GLY A 153 2.127 13.238 6.971 1.00 0.00 O ATOM 0 H GLY A 153 1.454 17.566 6.394 1.00 0.00 H new ATOM 0 HA2 GLY A 153 0.655 15.496 6.856 1.00 0.00 H new ATOM 0 HA3 GLY A 153 1.465 15.245 5.322 1.00 0.00 H new TER 2467 GLY A 153 HETATM 2468 FE HEM A 154 -3.531 5.695 -2.641 1.00 0.00 FE HETATM 2469 CHA HEM A 154 -5.254 6.862 -5.323 1.00 0.00 C HETATM 2470 CHB HEM A 154 -1.179 4.301 -4.769 1.00 0.00 C HETATM 2471 CHC HEM A 154 -1.914 4.292 0.006 1.00 0.00 C HETATM 2472 CHD HEM A 154 -5.986 6.837 -0.525 1.00 0.00 C HETATM 2473 NA HEM A 154 -3.319 5.524 -4.658 1.00 0.00 N HETATM 2474 C1A HEM A 154 -4.060 6.203 -5.605 1.00 0.00 C HETATM 2475 C2A HEM A 154 -3.479 6.014 -6.926 1.00 0.00 C HETATM 2476 C3A HEM A 154 -2.411 5.192 -6.768 1.00 0.00 C HETATM 2477 C4A HEM A 154 -2.268 4.947 -5.351 1.00 0.00 C HETATM 2478 CMA HEM A 154 -1.461 4.689 -7.822 1.00 0.00 C HETATM 2479 CAA HEM A 154 -3.968 6.627 -8.222 1.00 0.00 C HETATM 2480 CBA HEM A 154 -2.998 7.641 -8.839 1.00 0.00 C HETATM 2481 CGA HEM A 154 -2.683 8.769 -7.870 1.00 0.00 C HETATM 2482 O1A HEM A 154 -1.599 8.693 -7.255 1.00 0.00 O HETATM 2483 O2A HEM A 154 -3.616 9.552 -7.588 1.00 0.00 O HETATM 2484 NB HEM A 154 -1.813 4.640 -2.418 1.00 0.00 N HETATM 2485 C1B HEM A 154 -0.959 4.169 -3.402 1.00 0.00 C HETATM 2486 C2B HEM A 154 0.133 3.429 -2.803 1.00 0.00 C HETATM 2487 C3B HEM A 154 -0.166 3.300 -1.487 1.00 0.00 C HETATM 2488 C4B HEM A 154 -1.335 4.114 -1.241 1.00 0.00 C HETATM 2489 CMB HEM A 154 1.299 2.829 -3.539 1.00 0.00 C HETATM 2490 CAB HEM A 154 0.560 2.483 -0.454 1.00 0.00 C HETATM 2491 CBB HEM A 154 0.687 1.167 -0.665 1.00 0.00 C HETATM 2492 NC HEM A 154 -3.796 5.729 -0.612 1.00 0.00 N HETATM 2493 C1C HEM A 154 -3.032 5.059 0.322 1.00 0.00 C HETATM 2494 C2C HEM A 154 -3.740 4.982 1.586 1.00 0.00 C HETATM 2495 C3C HEM A 154 -4.949 5.585 1.398 1.00 0.00 C HETATM 2496 C4C HEM A 154 -4.927 6.149 0.064 1.00 0.00 C HETATM 2497 CMC HEM A 154 -3.282 4.173 2.779 1.00 0.00 C HETATM 2498 CAC HEM A 154 -6.188 5.533 2.272 1.00 0.00 C HETATM 2499 CBC HEM A 154 -6.130 5.256 3.581 1.00 0.00 C HETATM 2500 ND HEM A 154 -5.194 6.749 -2.865 1.00 0.00 N HETATM 2501 C1D HEM A 154 -6.106 7.107 -1.887 1.00 0.00 C HETATM 2502 C2D HEM A 154 -7.309 7.628 -2.496 1.00 0.00 C HETATM 2503 C3D HEM A 154 -7.210 7.376 -3.823 1.00 0.00 C HETATM 2504 C4D HEM A 154 -5.834 6.985 -4.064 1.00 0.00 C HETATM 2505 CMD HEM A 154 -8.510 8.126 -1.735 1.00 0.00 C HETATM 2506 CAD HEM A 154 -8.320 7.409 -4.853 1.00 0.00 C HETATM 2507 CBD HEM A 154 -8.580 8.743 -5.556 1.00 0.00 C HETATM 2508 CGD HEM A 154 -9.788 8.714 -6.484 1.00 0.00 C HETATM 2509 O1D HEM A 154 -10.723 7.947 -6.167 1.00 0.00 O HETATM 2510 O2D HEM A 154 -9.888 9.686 -7.263 1.00 0.00 O HETATM 0 HMA1 HEM A 154 -2.004 4.526 -8.753 1.00 0.00 H new HETATM 0 HMA2 HEM A 154 -1.016 3.750 -7.493 1.00 0.00 H new HETATM 0 HMA3 HEM A 154 -0.674 5.426 -7.984 1.00 0.00 H new HETATM 0 HMB1 HEM A 154 2.173 2.817 -2.888 1.00 0.00 H new HETATM 0 HMB2 HEM A 154 1.515 3.425 -4.426 1.00 0.00 H new HETATM 0 HMB3 HEM A 154 1.055 1.810 -3.838 1.00 0.00 H new HETATM 0 HMC1 HEM A 154 -2.723 3.303 2.435 1.00 0.00 H new HETATM 0 HMC2 HEM A 154 -4.150 3.844 3.351 1.00 0.00 H new HETATM 0 HMC3 HEM A 154 -2.642 4.788 3.412 1.00 0.00 H new HETATM 0 HMD1 HEM A 154 -8.592 7.587 -0.791 1.00 0.00 H new HETATM 0 HMD2 HEM A 154 -9.410 7.960 -2.327 1.00 0.00 H new HETATM 0 HMD3 HEM A 154 -8.398 9.192 -1.536 1.00 0.00 H new HETATM 0 HBB1 HEM A 154 1.208 0.546 0.064 1.00 0.00 H new HETATM 0 HBB2 HEM A 154 0.270 0.717 -1.566 1.00 0.00 H new HETATM 0 HBC1 HEM A 154 -7.045 5.229 4.173 1.00 0.00 H new HETATM 0 HBC2 HEM A 154 -5.168 5.058 4.054 1.00 0.00 H new HETATM 0 HBA1 HEM A 154 -3.431 8.053 -9.750 1.00 0.00 H new HETATM 0 HBA2 HEM A 154 -2.075 7.136 -9.124 1.00 0.00 H new HETATM 0 HAA1 HEM A 154 -4.924 7.118 -8.041 1.00 0.00 H new HETATM 0 HAA2 HEM A 154 -4.150 5.830 -8.943 1.00 0.00 H new HETATM 0 HBD1 HEM A 154 -7.696 9.020 -6.131 1.00 0.00 H new HETATM 0 HBD2 HEM A 154 -8.727 9.518 -4.804 1.00 0.00 H new HETATM 0 HAD1 HEM A 154 -9.244 7.098 -4.365 1.00 0.00 H new HETATM 0 HAD2 HEM A 154 -8.096 6.663 -5.615 1.00 0.00 H new HETATM 0 HHA HEM A 154 -5.775 7.317 -6.153 1.00 0.00 H new HETATM 0 HHB HEM A 154 -0.446 3.868 -5.433 1.00 0.00 H new HETATM 0 HHC HEM A 154 -1.442 3.775 0.829 1.00 0.00 H new HETATM 0 HHD HEM A 154 -6.775 7.188 0.124 1.00 0.00 H new HETATM 0 HAB HEM A 154 0.971 2.949 0.441 1.00 0.00 H new HETATM 0 HAC HEM A 154 -7.160 5.728 1.818 1.00 0.00 H new HETATM 2541 C CMO A 155 -4.550 4.281 -2.567 1.00 0.00 C HETATM 2542 O CMO A 155 -5.243 3.407 -2.460 1.00 0.00 O