USER MOD reduce.3.24.130724 H: found=0, std=0, add=1517, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 1517 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 67 HIS HD1 : A 67 HIS ND1 : A 250 ZNZN :(H bumps) USER MOD Set 1.1: A 91 CYS SG : rot 180:sc= 0.546 USER MOD Set 1.2: A 93 THR OG1 : rot 99:sc= 0.226 USER MOD Set 2.1: A 87 TYR OH : rot 126:sc= 1.02 USER MOD Set 2.2: A 114 HIS : no HD1:sc= -5.81! C(o=-4.8!,f=-16!) USER MOD Set 3.1: A 46 ASN : amide:sc= 0 X(o=-4.5,f=-4.5) USER MOD Set 3.2: A 47 GLN :FLIP amide:sc= -4.52! C(o=-7.1!,f=-4.5!) USER MOD Set 4.1: A 11 THR OG1 : rot -84:sc= 0.062 USER MOD Set 4.2: A 17 ASN : amide:sc= 0.0583 X(o=0.12,f=0) USER MOD Set 5.1: A 6 SER OG : rot -119:sc= 1.24 USER MOD Set 5.2: A 163 HIS : no HD1:sc= -5.92! C(o=-4.7!,f=-7.3!) USER MOD Single : A 1 HIS : no HD1:sc= -0.133 X(o=-0.13,f=-0.39) USER MOD Single : A 1 HIS N :NH3+ -179:sc= -0.145 (180deg=-0.151) USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 5 HIS : no HD1:sc= -0.22 X(o=-0.22,f=-0.44) USER MOD Single : A 7 MET CE :methyl 144:sc= -0.431 (180deg=-1.83!) USER MOD Single : A 13 THR OG1 : rot -85:sc= 0.844 USER MOD Single : A 15 ASN :FLIP amide:sc= -1.95! C(o=-2.6!,f=-2!) USER MOD Single : A 18 ASN :FLIP amide:sc= -3.7! C(o=-4.6!,f=-3.7!) USER MOD Single : A 26 HIS : no HD1:sc= -2.4! C(o=-2.4!,f=-3.9!) USER MOD Single : A 28 THR OG1 : rot -43:sc= 1.79 USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 CYS SG : rot -157:sc= 0.55 USER MOD Single : A 32 TYR OH : rot 5:sc= -3.56! USER MOD Single : A 37 MET CE :methyl 157:sc= -1.26 (180deg=-3.14!) USER MOD Single : A 38 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 39 ASN : amide:sc= -3.91! C(o=-3.9!,f=-7.7!) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0.00704 USER MOD Single : A 53 CYS SG : rot -71:sc= 0.204 USER MOD Single : A 54 ASN : amide:sc= -0.547 K(o=-0.55,f=-1.7!) USER MOD Single : A 55 GLN : amide:sc= -0.0336 K(o=-0.034,f=-1.7!) USER MOD Single : A 58 HIS : no HD1:sc= 0.00676! C(o=0.0068!,f=-4.8!) USER MOD Single : A 59 LYS NZ :NH3+ -164:sc= -0.0848 (180deg=-0.583) USER MOD Single : A 60 HIS :FLIP no HD1:sc=-0.00492 F(o=-0.83,f=-0.0049) USER MOD Single : A 71 CYS SG : rot 180:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 GLN : amide:sc= -6.79! C(o=-6.8!,f=-12!) USER MOD Single : A 90 THR OG1 : rot 19:sc= 0.0729 USER MOD Single : A 94 SER OG : rot 180:sc= 0.0312 USER MOD Single : A 96 SER OG : rot 180:sc= -3.05! USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 103 GLN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : A 105 MET CE :methyl -133:sc= -4.87! (180deg=-11.4!) USER MOD Single : A 107 LYS NZ :NH3+ 161:sc=-0.00284 (180deg=-0.295) USER MOD Single : A 110 SER OG : rot 180:sc= -0.762 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 ASN : amide:sc= -0.904 K(o=-0.9,f=-5.9!) USER MOD Single : A 113 LYS NZ :NH3+ 154:sc= 0.811 (180deg=0.444) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 118 CYS SG : rot 180:sc= -0.073 USER MOD Single : A 121 THR OG1 : rot -160:sc= -1.23 USER MOD Single : A 125 TYR OH : rot 0:sc= -0.0341 USER MOD Single : A 128 GLN : amide:sc=-0.00382 X(o=-0.0038,f=-0.12) USER MOD Single : A 131 CYS SG : rot -15:sc= -4.11! USER MOD Single : A 132 GLN : amide:sc= -3.61! C(o=-3.6!,f=-5.9!) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 144 LYS NZ :NH3+ 160:sc= -0.0203 (180deg=-0.26) USER MOD Single : A 146 SER OG : rot 56:sc= 1.11 USER MOD Single : A 148 MET CE :methyl -164:sc= -0.109 (180deg=-0.35) USER MOD Single : A 149 THR OG1 : rot -81:sc= 0.0683 USER MOD Single : A 150 TYR OH : rot 180:sc= 0 USER MOD Single : A 151 SER OG : rot 48:sc= 1.88 USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 156 CYS SG : rot -67:sc= -2.48! USER MOD Single : A 159 THR OG1 : rot 97:sc= 0.221 USER MOD Single : A 164 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 166 CYS SG : rot 180:sc= -1.37 USER MOD Single : A 169 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 177 HIS : no HD1:sc= -4.4 X(o=-4.4,f=-4.5!) USER MOD Single : A 178 SER OG : rot -140:sc= -2.03! USER MOD Single : A 179 GLN :FLIP amide:sc= -0.0309 F(o=-1.4!,f=-0.031) USER MOD Single : A 182 SER OG : rot 180:sc= -0.22! USER MOD Single : A 190 GLN : amide:sc= 0 X(o=0,f=-0.49) USER MOD Single : A 191 ASN : amide:sc= -6.14! C(o=-6.1!,f=-9.9!) USER MOD Single : A 192 GLN : amide:sc= -3.19! C(o=-3.2!,f=-4.6!) USER MOD Single : A 194 ASN :FLIP amide:sc= 0.512 F(o=-1.6,f=0.51) USER MOD ----------------------------------------------------------------- ATOM 1 N HIS A 1 18.756 -19.197 -7.626 1.00 0.00 N ATOM 2 CA HIS A 1 18.231 -18.491 -6.423 1.00 0.00 C ATOM 3 C HIS A 1 18.396 -19.386 -5.200 1.00 0.00 C ATOM 4 O HIS A 1 17.460 -19.570 -4.422 1.00 0.00 O ATOM 5 CB HIS A 1 16.752 -18.164 -6.633 1.00 0.00 C ATOM 6 CG HIS A 1 16.601 -17.255 -7.821 1.00 0.00 C ATOM 7 ND1 HIS A 1 17.549 -16.298 -8.146 1.00 0.00 N ATOM 8 CD2 HIS A 1 15.617 -17.146 -8.773 1.00 0.00 C ATOM 9 CE1 HIS A 1 17.119 -15.659 -9.250 1.00 0.00 C ATOM 10 NE2 HIS A 1 15.946 -16.137 -9.673 1.00 0.00 N ATOM 0 H1 HIS A 1 18.660 -18.582 -8.459 1.00 0.00 H new ATOM 0 H2 HIS A 1 19.759 -19.430 -7.481 1.00 0.00 H new ATOM 0 H3 HIS A 1 18.216 -20.072 -7.778 1.00 0.00 H new ATOM 0 HA HIS A 1 18.785 -17.565 -6.268 1.00 0.00 H new ATOM 0 HB2 HIS A 1 16.185 -19.082 -6.790 1.00 0.00 H new ATOM 0 HB3 HIS A 1 16.345 -17.686 -5.742 1.00 0.00 H new ATOM 0 HD2 HIS A 1 14.724 -17.751 -8.816 1.00 0.00 H new ATOM 0 HE1 HIS A 1 17.657 -14.858 -9.734 1.00 0.00 H new ATOM 0 HE2 HIS A 1 15.407 -15.829 -10.482 1.00 0.00 H new ATOM 21 N MET A 2 19.592 -19.942 -5.034 1.00 0.00 N ATOM 22 CA MET A 2 19.865 -20.818 -3.901 1.00 0.00 C ATOM 23 C MET A 2 20.015 -20.006 -2.618 1.00 0.00 C ATOM 24 O MET A 2 20.074 -20.563 -1.522 1.00 0.00 O ATOM 25 CB MET A 2 21.145 -21.621 -4.153 1.00 0.00 C ATOM 26 CG MET A 2 21.497 -22.441 -2.908 1.00 0.00 C ATOM 27 SD MET A 2 22.342 -23.961 -3.407 1.00 0.00 S ATOM 28 CE MET A 2 24.006 -23.262 -3.550 1.00 0.00 C ATOM 0 H MET A 2 20.382 -19.803 -5.664 1.00 0.00 H new ATOM 0 HA MET A 2 19.025 -21.503 -3.788 1.00 0.00 H new ATOM 0 HB2 MET A 2 21.008 -22.282 -5.008 1.00 0.00 H new ATOM 0 HB3 MET A 2 21.965 -20.947 -4.400 1.00 0.00 H new ATOM 0 HG2 MET A 2 22.136 -21.858 -2.244 1.00 0.00 H new ATOM 0 HG3 MET A 2 20.592 -22.682 -2.350 1.00 0.00 H new ATOM 0 HE1 MET A 2 24.704 -24.042 -3.854 1.00 0.00 H new ATOM 0 HE2 MET A 2 24.004 -22.467 -4.295 1.00 0.00 H new ATOM 0 HE3 MET A 2 24.314 -22.855 -2.587 1.00 0.00 H new ATOM 38 N LEU A 3 20.072 -18.687 -2.764 1.00 0.00 N ATOM 39 CA LEU A 3 20.211 -17.807 -1.610 1.00 0.00 C ATOM 40 C LEU A 3 18.855 -17.574 -0.952 1.00 0.00 C ATOM 41 O LEU A 3 18.601 -18.049 0.155 1.00 0.00 O ATOM 42 CB LEU A 3 20.809 -16.467 -2.044 1.00 0.00 C ATOM 43 CG LEU A 3 22.331 -16.588 -2.133 1.00 0.00 C ATOM 44 CD1 LEU A 3 22.700 -17.646 -3.173 1.00 0.00 C ATOM 45 CD2 LEU A 3 22.925 -15.239 -2.545 1.00 0.00 C ATOM 0 H LEU A 3 20.025 -18.207 -3.663 1.00 0.00 H new ATOM 0 HA LEU A 3 20.876 -18.283 -0.889 1.00 0.00 H new ATOM 0 HB2 LEU A 3 20.401 -16.171 -3.010 1.00 0.00 H new ATOM 0 HB3 LEU A 3 20.537 -15.688 -1.331 1.00 0.00 H new ATOM 0 HG LEU A 3 22.730 -16.881 -1.162 1.00 0.00 H new ATOM 0 HD11 LEU A 3 23.785 -17.732 -3.236 1.00 0.00 H new ATOM 0 HD12 LEU A 3 22.276 -18.607 -2.881 1.00 0.00 H new ATOM 0 HD13 LEU A 3 22.302 -17.355 -4.145 1.00 0.00 H new ATOM 0 HD21 LEU A 3 24.010 -15.323 -2.609 1.00 0.00 H new ATOM 0 HD22 LEU A 3 22.526 -14.947 -3.516 1.00 0.00 H new ATOM 0 HD23 LEU A 3 22.663 -14.484 -1.803 1.00 0.00 H new ATOM 57 N ARG A 4 17.987 -16.843 -1.644 1.00 0.00 N ATOM 58 CA ARG A 4 16.656 -16.554 -1.122 1.00 0.00 C ATOM 59 C ARG A 4 16.740 -15.923 0.264 1.00 0.00 C ATOM 60 O ARG A 4 16.648 -14.704 0.406 1.00 0.00 O ATOM 61 CB ARG A 4 15.831 -17.842 -1.051 1.00 0.00 C ATOM 62 CG ARG A 4 14.378 -17.500 -0.717 1.00 0.00 C ATOM 63 CD ARG A 4 13.529 -18.769 -0.774 1.00 0.00 C ATOM 64 NE ARG A 4 13.374 -19.213 -2.155 1.00 0.00 N ATOM 65 CZ ARG A 4 12.610 -20.257 -2.459 1.00 0.00 C ATOM 66 NH1 ARG A 4 11.982 -20.903 -1.515 1.00 0.00 N ATOM 67 NH2 ARG A 4 12.487 -20.636 -3.702 1.00 0.00 N ATOM 0 H ARG A 4 18.179 -16.442 -2.562 1.00 0.00 H new ATOM 0 HA ARG A 4 16.172 -15.848 -1.796 1.00 0.00 H new ATOM 0 HB2 ARG A 4 15.882 -18.372 -2.002 1.00 0.00 H new ATOM 0 HB3 ARG A 4 16.242 -18.508 -0.293 1.00 0.00 H new ATOM 0 HG2 ARG A 4 14.317 -17.054 0.276 1.00 0.00 H new ATOM 0 HG3 ARG A 4 13.996 -16.762 -1.422 1.00 0.00 H new ATOM 0 HD2 ARG A 4 13.998 -19.555 -0.183 1.00 0.00 H new ATOM 0 HD3 ARG A 4 12.550 -18.580 -0.334 1.00 0.00 H new ATOM 0 HE ARG A 4 13.860 -18.714 -2.900 1.00 0.00 H new ATOM 0 HH11 ARG A 4 12.077 -20.607 -0.544 1.00 0.00 H new ATOM 0 HH12 ARG A 4 11.396 -21.704 -1.748 1.00 0.00 H new ATOM 0 HH21 ARG A 4 12.977 -20.131 -4.440 1.00 0.00 H new ATOM 0 HH22 ARG A 4 11.901 -21.437 -3.935 1.00 0.00 H new ATOM 81 N HIS A 5 16.912 -16.759 1.284 1.00 0.00 N ATOM 82 CA HIS A 5 17.000 -16.264 2.654 1.00 0.00 C ATOM 83 C HIS A 5 15.839 -15.320 2.950 1.00 0.00 C ATOM 84 O HIS A 5 14.813 -15.731 3.490 1.00 0.00 O ATOM 85 CB HIS A 5 18.326 -15.531 2.863 1.00 0.00 C ATOM 86 CG HIS A 5 19.429 -16.536 3.060 1.00 0.00 C ATOM 87 ND1 HIS A 5 19.307 -17.606 3.932 1.00 0.00 N ATOM 88 CD2 HIS A 5 20.679 -16.648 2.503 1.00 0.00 C ATOM 89 CE1 HIS A 5 20.452 -18.308 3.877 1.00 0.00 C ATOM 90 NE2 HIS A 5 21.323 -17.768 3.020 1.00 0.00 N ATOM 0 H HIS A 5 16.992 -17.771 1.190 1.00 0.00 H new ATOM 0 HA HIS A 5 16.949 -17.114 3.335 1.00 0.00 H new ATOM 0 HB2 HIS A 5 18.544 -14.899 2.002 1.00 0.00 H new ATOM 0 HB3 HIS A 5 18.258 -14.875 3.731 1.00 0.00 H new ATOM 0 HD2 HIS A 5 21.099 -15.970 1.774 1.00 0.00 H new ATOM 0 HE1 HIS A 5 20.644 -19.200 4.455 1.00 0.00 H new ATOM 0 HE2 HIS A 5 22.259 -18.104 2.793 1.00 0.00 H new ATOM 99 N SER A 6 16.008 -14.051 2.586 1.00 0.00 N ATOM 100 CA SER A 6 14.968 -13.051 2.809 1.00 0.00 C ATOM 101 C SER A 6 14.219 -12.767 1.510 1.00 0.00 C ATOM 102 O SER A 6 13.862 -13.688 0.775 1.00 0.00 O ATOM 103 CB SER A 6 15.593 -11.759 3.335 1.00 0.00 C ATOM 104 OG SER A 6 14.620 -11.037 4.079 1.00 0.00 O ATOM 0 H SER A 6 16.851 -13.692 2.138 1.00 0.00 H new ATOM 0 HA SER A 6 14.264 -13.438 3.546 1.00 0.00 H new ATOM 0 HB2 SER A 6 16.453 -11.987 3.964 1.00 0.00 H new ATOM 0 HB3 SER A 6 15.957 -11.153 2.505 1.00 0.00 H new ATOM 0 HG SER A 6 14.472 -10.163 3.662 1.00 0.00 H new ATOM 110 N MET A 7 13.989 -11.488 1.229 1.00 0.00 N ATOM 111 CA MET A 7 13.285 -11.100 0.013 1.00 0.00 C ATOM 112 C MET A 7 14.125 -11.442 -1.215 1.00 0.00 C ATOM 113 O MET A 7 13.762 -12.307 -2.011 1.00 0.00 O ATOM 114 CB MET A 7 12.986 -9.593 0.035 1.00 0.00 C ATOM 115 CG MET A 7 13.001 -9.086 1.479 1.00 0.00 C ATOM 116 SD MET A 7 14.707 -8.741 1.981 1.00 0.00 S ATOM 117 CE MET A 7 15.007 -7.358 0.852 1.00 0.00 C ATOM 0 H MET A 7 14.277 -10.709 1.821 1.00 0.00 H new ATOM 0 HA MET A 7 12.345 -11.650 -0.036 1.00 0.00 H new ATOM 0 HB2 MET A 7 13.728 -9.056 -0.557 1.00 0.00 H new ATOM 0 HB3 MET A 7 12.014 -9.398 -0.419 1.00 0.00 H new ATOM 0 HG2 MET A 7 12.396 -8.183 1.565 1.00 0.00 H new ATOM 0 HG3 MET A 7 12.559 -9.830 2.142 1.00 0.00 H new ATOM 0 HE1 MET A 7 15.638 -6.617 1.344 1.00 0.00 H new ATOM 0 HE2 MET A 7 15.507 -7.723 -0.045 1.00 0.00 H new ATOM 0 HE3 MET A 7 14.057 -6.900 0.577 1.00 0.00 H new ATOM 127 N ASP A 8 15.252 -10.753 -1.355 1.00 0.00 N ATOM 128 CA ASP A 8 16.147 -10.982 -2.481 1.00 0.00 C ATOM 129 C ASP A 8 17.508 -10.355 -2.197 1.00 0.00 C ATOM 130 O ASP A 8 17.893 -9.373 -2.830 1.00 0.00 O ATOM 131 CB ASP A 8 15.555 -10.369 -3.752 1.00 0.00 C ATOM 132 CG ASP A 8 16.113 -11.078 -4.981 1.00 0.00 C ATOM 133 OD1 ASP A 8 15.718 -12.207 -5.220 1.00 0.00 O ATOM 134 OD2 ASP A 8 16.926 -10.480 -5.667 1.00 0.00 O ATOM 0 H ASP A 8 15.566 -10.033 -0.704 1.00 0.00 H new ATOM 0 HA ASP A 8 16.268 -12.056 -2.624 1.00 0.00 H new ATOM 0 HB2 ASP A 8 14.468 -10.454 -3.735 1.00 0.00 H new ATOM 0 HB3 ASP A 8 15.791 -9.306 -3.797 1.00 0.00 H new ATOM 139 N PRO A 9 18.232 -10.902 -1.257 1.00 0.00 N ATOM 140 CA PRO A 9 19.572 -10.385 -0.871 1.00 0.00 C ATOM 141 C PRO A 9 20.427 -9.964 -2.075 1.00 0.00 C ATOM 142 O PRO A 9 20.941 -8.846 -2.092 1.00 0.00 O ATOM 143 CB PRO A 9 20.201 -11.539 -0.091 1.00 0.00 C ATOM 144 CG PRO A 9 19.050 -12.320 0.462 1.00 0.00 C ATOM 145 CD PRO A 9 17.849 -12.078 -0.460 1.00 0.00 C ATOM 0 HA PRO A 9 19.498 -9.471 -0.282 1.00 0.00 H new ATOM 0 HB2 PRO A 9 20.821 -12.159 -0.739 1.00 0.00 H new ATOM 0 HB3 PRO A 9 20.844 -11.169 0.707 1.00 0.00 H new ATOM 0 HG2 PRO A 9 19.292 -13.382 0.507 1.00 0.00 H new ATOM 0 HG3 PRO A 9 18.823 -12.002 1.480 1.00 0.00 H new ATOM 0 HD2 PRO A 9 17.655 -12.942 -1.095 1.00 0.00 H new ATOM 0 HD3 PRO A 9 16.940 -11.892 0.112 1.00 0.00 H new ATOM 153 N PRO A 10 20.597 -10.798 -3.085 1.00 0.00 N ATOM 154 CA PRO A 10 21.411 -10.423 -4.279 1.00 0.00 C ATOM 155 C PRO A 10 21.038 -9.037 -4.804 1.00 0.00 C ATOM 156 O PRO A 10 21.786 -8.429 -5.569 1.00 0.00 O ATOM 157 CB PRO A 10 21.092 -11.519 -5.317 1.00 0.00 C ATOM 158 CG PRO A 10 19.965 -12.317 -4.742 1.00 0.00 C ATOM 159 CD PRO A 10 20.060 -12.161 -3.231 1.00 0.00 C ATOM 0 HA PRO A 10 22.475 -10.365 -4.048 1.00 0.00 H new ATOM 0 HB2 PRO A 10 20.810 -11.080 -6.274 1.00 0.00 H new ATOM 0 HB3 PRO A 10 21.963 -12.149 -5.499 1.00 0.00 H new ATOM 0 HG2 PRO A 10 19.005 -11.956 -5.111 1.00 0.00 H new ATOM 0 HG3 PRO A 10 20.044 -13.365 -5.031 1.00 0.00 H new ATOM 0 HD2 PRO A 10 19.088 -12.268 -2.750 1.00 0.00 H new ATOM 0 HD3 PRO A 10 20.719 -12.907 -2.787 1.00 0.00 H new ATOM 167 N THR A 11 19.874 -8.547 -4.387 1.00 0.00 N ATOM 168 CA THR A 11 19.408 -7.239 -4.819 1.00 0.00 C ATOM 169 C THR A 11 20.158 -6.126 -4.092 1.00 0.00 C ATOM 170 O THR A 11 20.293 -5.016 -4.607 1.00 0.00 O ATOM 171 CB THR A 11 17.902 -7.108 -4.554 1.00 0.00 C ATOM 172 OG1 THR A 11 17.369 -6.072 -5.366 1.00 0.00 O ATOM 173 CG2 THR A 11 17.652 -6.780 -3.077 1.00 0.00 C ATOM 0 H THR A 11 19.241 -9.035 -3.754 1.00 0.00 H new ATOM 0 HA THR A 11 19.599 -7.143 -5.888 1.00 0.00 H new ATOM 0 HB THR A 11 17.414 -8.053 -4.795 1.00 0.00 H new ATOM 0 HG1 THR A 11 17.506 -5.208 -4.925 1.00 0.00 H new ATOM 0 HG21 THR A 11 16.580 -6.689 -2.901 1.00 0.00 H new ATOM 0 HG22 THR A 11 18.056 -7.578 -2.454 1.00 0.00 H new ATOM 0 HG23 THR A 11 18.142 -5.839 -2.825 1.00 0.00 H new ATOM 181 N PHE A 12 20.638 -6.428 -2.890 1.00 0.00 N ATOM 182 CA PHE A 12 21.363 -5.443 -2.097 1.00 0.00 C ATOM 183 C PHE A 12 22.792 -5.276 -2.609 1.00 0.00 C ATOM 184 O PHE A 12 23.413 -4.232 -2.410 1.00 0.00 O ATOM 185 CB PHE A 12 21.393 -5.874 -0.630 1.00 0.00 C ATOM 186 CG PHE A 12 21.939 -4.746 0.212 1.00 0.00 C ATOM 187 CD1 PHE A 12 21.157 -3.609 0.451 1.00 0.00 C ATOM 188 CD2 PHE A 12 23.228 -4.836 0.750 1.00 0.00 C ATOM 189 CE1 PHE A 12 21.665 -2.562 1.230 1.00 0.00 C ATOM 190 CE2 PHE A 12 23.737 -3.789 1.528 1.00 0.00 C ATOM 191 CZ PHE A 12 22.956 -2.651 1.768 1.00 0.00 C ATOM 0 H PHE A 12 20.539 -7.341 -2.446 1.00 0.00 H new ATOM 0 HA PHE A 12 20.847 -4.487 -2.187 1.00 0.00 H new ATOM 0 HB2 PHE A 12 20.390 -6.139 -0.297 1.00 0.00 H new ATOM 0 HB3 PHE A 12 22.013 -6.763 -0.513 1.00 0.00 H new ATOM 0 HD1 PHE A 12 20.163 -3.540 0.035 1.00 0.00 H new ATOM 0 HD2 PHE A 12 23.830 -5.713 0.565 1.00 0.00 H new ATOM 0 HE1 PHE A 12 21.062 -1.686 1.416 1.00 0.00 H new ATOM 0 HE2 PHE A 12 24.732 -3.859 1.943 1.00 0.00 H new ATOM 0 HZ PHE A 12 23.349 -1.843 2.367 1.00 0.00 H new ATOM 201 N THR A 13 23.308 -6.309 -3.267 1.00 0.00 N ATOM 202 CA THR A 13 24.663 -6.263 -3.799 1.00 0.00 C ATOM 203 C THR A 13 24.820 -5.105 -4.781 1.00 0.00 C ATOM 204 O THR A 13 25.922 -4.596 -4.984 1.00 0.00 O ATOM 205 CB THR A 13 24.987 -7.581 -4.505 1.00 0.00 C ATOM 206 OG1 THR A 13 24.067 -7.785 -5.569 1.00 0.00 O ATOM 207 CG2 THR A 13 24.886 -8.737 -3.510 1.00 0.00 C ATOM 0 H THR A 13 22.811 -7.182 -3.443 1.00 0.00 H new ATOM 0 HA THR A 13 25.354 -6.112 -2.969 1.00 0.00 H new ATOM 0 HB THR A 13 26.001 -7.539 -4.904 1.00 0.00 H new ATOM 0 HG1 THR A 13 23.258 -8.216 -5.223 1.00 0.00 H new ATOM 0 HG21 THR A 13 25.117 -9.674 -4.016 1.00 0.00 H new ATOM 0 HG22 THR A 13 25.594 -8.580 -2.696 1.00 0.00 H new ATOM 0 HG23 THR A 13 23.874 -8.783 -3.107 1.00 0.00 H new ATOM 215 N PHE A 14 23.712 -4.697 -5.391 1.00 0.00 N ATOM 216 CA PHE A 14 23.737 -3.605 -6.354 1.00 0.00 C ATOM 217 C PHE A 14 23.727 -2.252 -5.641 1.00 0.00 C ATOM 218 O PHE A 14 24.229 -1.261 -6.171 1.00 0.00 O ATOM 219 CB PHE A 14 22.521 -3.710 -7.292 1.00 0.00 C ATOM 220 CG PHE A 14 22.910 -4.423 -8.569 1.00 0.00 C ATOM 221 CD1 PHE A 14 23.206 -5.791 -8.545 1.00 0.00 C ATOM 222 CD2 PHE A 14 22.977 -3.714 -9.772 1.00 0.00 C ATOM 223 CE1 PHE A 14 23.566 -6.450 -9.726 1.00 0.00 C ATOM 224 CE2 PHE A 14 23.339 -4.372 -10.955 1.00 0.00 C ATOM 225 CZ PHE A 14 23.633 -5.741 -10.931 1.00 0.00 C ATOM 0 H PHE A 14 22.790 -5.105 -5.236 1.00 0.00 H new ATOM 0 HA PHE A 14 24.654 -3.680 -6.938 1.00 0.00 H new ATOM 0 HB2 PHE A 14 21.715 -4.250 -6.796 1.00 0.00 H new ATOM 0 HB3 PHE A 14 22.143 -2.714 -7.523 1.00 0.00 H new ATOM 0 HD1 PHE A 14 23.157 -6.338 -7.615 1.00 0.00 H new ATOM 0 HD2 PHE A 14 22.750 -2.658 -9.790 1.00 0.00 H new ATOM 0 HE1 PHE A 14 23.792 -7.506 -9.708 1.00 0.00 H new ATOM 0 HE2 PHE A 14 23.391 -3.824 -11.884 1.00 0.00 H new ATOM 0 HZ PHE A 14 23.911 -6.250 -11.842 1.00 0.00 H new ATOM 235 N ASN A 15 23.147 -2.216 -4.446 1.00 0.00 N ATOM 236 CA ASN A 15 23.076 -0.973 -3.684 1.00 0.00 C ATOM 237 C ASN A 15 22.047 -0.033 -4.301 1.00 0.00 C ATOM 238 O ASN A 15 21.054 0.324 -3.665 1.00 0.00 O ATOM 239 CB ASN A 15 24.446 -0.290 -3.663 1.00 0.00 C ATOM 240 CG ASN A 15 25.551 -1.340 -3.663 1.00 0.00 C ATOM 241 OD1 ASN A 15 26.349 -1.432 -4.691 1.00 0.00 O flip ATOM 242 ND2 ASN A 15 25.693 -2.096 -2.701 1.00 0.00 N flip ATOM 0 H ASN A 15 22.724 -3.023 -3.988 1.00 0.00 H new ATOM 0 HA ASN A 15 22.776 -1.209 -2.663 1.00 0.00 H new ATOM 0 HB2 ASN A 15 24.551 0.360 -4.531 1.00 0.00 H new ATOM 0 HB3 ASN A 15 24.533 0.342 -2.779 1.00 0.00 H new ATOM 0 HD21 ASN A 15 25.068 -2.023 -1.898 1.00 0.00 H new ATOM 0 HD22 ASN A 15 26.435 -2.795 -2.707 1.00 0.00 H new ATOM 249 N PHE A 16 22.293 0.362 -5.543 1.00 0.00 N ATOM 250 CA PHE A 16 21.384 1.260 -6.246 1.00 0.00 C ATOM 251 C PHE A 16 20.265 0.472 -6.913 1.00 0.00 C ATOM 252 O PHE A 16 19.519 1.008 -7.732 1.00 0.00 O ATOM 253 CB PHE A 16 22.149 2.057 -7.304 1.00 0.00 C ATOM 254 CG PHE A 16 21.200 2.987 -8.021 1.00 0.00 C ATOM 255 CD1 PHE A 16 20.799 4.183 -7.415 1.00 0.00 C ATOM 256 CD2 PHE A 16 20.721 2.653 -9.294 1.00 0.00 C ATOM 257 CE1 PHE A 16 19.918 5.045 -8.079 1.00 0.00 C ATOM 258 CE2 PHE A 16 19.841 3.515 -9.960 1.00 0.00 C ATOM 259 CZ PHE A 16 19.439 4.712 -9.352 1.00 0.00 C ATOM 0 H PHE A 16 23.110 0.077 -6.083 1.00 0.00 H new ATOM 0 HA PHE A 16 20.949 1.946 -5.520 1.00 0.00 H new ATOM 0 HB2 PHE A 16 22.950 2.629 -6.835 1.00 0.00 H new ATOM 0 HB3 PHE A 16 22.617 1.378 -8.017 1.00 0.00 H new ATOM 0 HD1 PHE A 16 21.170 4.441 -6.434 1.00 0.00 H new ATOM 0 HD2 PHE A 16 21.030 1.730 -9.762 1.00 0.00 H new ATOM 0 HE1 PHE A 16 19.608 5.967 -7.609 1.00 0.00 H new ATOM 0 HE2 PHE A 16 19.472 3.257 -10.942 1.00 0.00 H new ATOM 0 HZ PHE A 16 18.760 5.377 -9.865 1.00 0.00 H new ATOM 269 N ASN A 17 20.151 -0.802 -6.554 1.00 0.00 N ATOM 270 CA ASN A 17 19.116 -1.654 -7.121 1.00 0.00 C ATOM 271 C ASN A 17 19.150 -1.601 -8.646 1.00 0.00 C ATOM 272 O ASN A 17 19.777 -0.720 -9.234 1.00 0.00 O ATOM 273 CB ASN A 17 17.745 -1.200 -6.619 1.00 0.00 C ATOM 274 CG ASN A 17 17.458 -1.815 -5.254 1.00 0.00 C ATOM 275 OD1 ASN A 17 17.107 -2.991 -5.163 1.00 0.00 O ATOM 276 ND2 ASN A 17 17.589 -1.086 -4.180 1.00 0.00 N ATOM 0 H ASN A 17 20.759 -1.264 -5.877 1.00 0.00 H new ATOM 0 HA ASN A 17 19.299 -2.681 -6.806 1.00 0.00 H new ATOM 0 HB2 ASN A 17 17.716 -0.113 -6.550 1.00 0.00 H new ATOM 0 HB3 ASN A 17 16.973 -1.495 -7.329 1.00 0.00 H new ATOM 0 HD21 ASN A 17 17.400 -1.491 -3.263 1.00 0.00 H new ATOM 0 HD22 ASN A 17 17.880 -0.111 -4.257 1.00 0.00 H new ATOM 283 N ASN A 18 18.469 -2.551 -9.281 1.00 0.00 N ATOM 284 CA ASN A 18 18.422 -2.609 -10.739 1.00 0.00 C ATOM 285 C ASN A 18 17.024 -2.259 -11.239 1.00 0.00 C ATOM 286 O ASN A 18 16.857 -1.396 -12.100 1.00 0.00 O ATOM 287 CB ASN A 18 18.804 -4.012 -11.217 1.00 0.00 C ATOM 288 CG ASN A 18 17.644 -4.976 -10.996 1.00 0.00 C ATOM 289 OD1 ASN A 18 17.326 -5.335 -9.782 1.00 0.00 O flip ATOM 290 ND2 ASN A 18 17.010 -5.417 -11.955 1.00 0.00 N flip ATOM 0 H ASN A 18 17.944 -3.289 -8.811 1.00 0.00 H new ATOM 0 HA ASN A 18 19.132 -1.885 -11.140 1.00 0.00 H new ATOM 0 HB2 ASN A 18 19.068 -3.985 -12.274 1.00 0.00 H new ATOM 0 HB3 ASN A 18 19.685 -4.361 -10.678 1.00 0.00 H new ATOM 0 HD21 ASN A 18 17.259 -5.136 -12.903 1.00 0.00 H new ATOM 0 HD22 ASN A 18 16.236 -6.063 -11.801 1.00 0.00 H new ATOM 297 N GLU A 19 16.022 -2.937 -10.689 1.00 0.00 N ATOM 298 CA GLU A 19 14.638 -2.695 -11.079 1.00 0.00 C ATOM 299 C GLU A 19 14.063 -1.509 -10.304 1.00 0.00 C ATOM 300 O GLU A 19 14.505 -1.213 -9.194 1.00 0.00 O ATOM 301 CB GLU A 19 13.800 -3.946 -10.793 1.00 0.00 C ATOM 302 CG GLU A 19 13.920 -4.934 -11.961 1.00 0.00 C ATOM 303 CD GLU A 19 12.782 -4.719 -12.955 1.00 0.00 C ATOM 304 OE1 GLU A 19 12.894 -3.820 -13.771 1.00 0.00 O ATOM 305 OE2 GLU A 19 11.813 -5.460 -12.884 1.00 0.00 O ATOM 0 H GLU A 19 16.142 -3.655 -9.975 1.00 0.00 H new ATOM 0 HA GLU A 19 14.609 -2.466 -12.144 1.00 0.00 H new ATOM 0 HB2 GLU A 19 14.138 -4.418 -9.870 1.00 0.00 H new ATOM 0 HB3 GLU A 19 12.756 -3.669 -10.645 1.00 0.00 H new ATOM 0 HG2 GLU A 19 14.879 -4.801 -12.462 1.00 0.00 H new ATOM 0 HG3 GLU A 19 13.895 -5.957 -11.585 1.00 0.00 H new ATOM 312 N PRO A 20 13.087 -0.837 -10.860 1.00 0.00 N ATOM 313 CA PRO A 20 12.437 0.334 -10.199 1.00 0.00 C ATOM 314 C PRO A 20 11.584 -0.093 -9.006 1.00 0.00 C ATOM 315 O PRO A 20 12.088 -0.236 -7.892 1.00 0.00 O ATOM 316 CB PRO A 20 11.570 0.938 -11.307 1.00 0.00 C ATOM 317 CG PRO A 20 11.283 -0.192 -12.237 1.00 0.00 C ATOM 318 CD PRO A 20 12.498 -1.116 -12.180 1.00 0.00 C ATOM 0 HA PRO A 20 13.163 1.039 -9.793 1.00 0.00 H new ATOM 0 HB2 PRO A 20 10.650 1.358 -10.902 1.00 0.00 H new ATOM 0 HB3 PRO A 20 12.092 1.747 -11.819 1.00 0.00 H new ATOM 0 HG2 PRO A 20 10.378 -0.721 -11.938 1.00 0.00 H new ATOM 0 HG3 PRO A 20 11.119 0.172 -13.251 1.00 0.00 H new ATOM 0 HD2 PRO A 20 12.210 -2.163 -12.277 1.00 0.00 H new ATOM 0 HD3 PRO A 20 13.201 -0.903 -12.985 1.00 0.00 H new ATOM 326 N TRP A 21 10.293 -0.305 -9.247 1.00 0.00 N ATOM 327 CA TRP A 21 9.387 -0.729 -8.184 1.00 0.00 C ATOM 328 C TRP A 21 8.034 -1.147 -8.765 1.00 0.00 C ATOM 329 O TRP A 21 7.941 -2.159 -9.461 1.00 0.00 O ATOM 330 CB TRP A 21 9.204 0.397 -7.153 1.00 0.00 C ATOM 331 CG TRP A 21 10.299 0.336 -6.132 1.00 0.00 C ATOM 332 CD1 TRP A 21 10.602 -0.750 -5.383 1.00 0.00 C ATOM 333 CD2 TRP A 21 11.228 1.384 -5.728 1.00 0.00 C ATOM 334 NE1 TRP A 21 11.660 -0.436 -4.549 1.00 0.00 N ATOM 335 CE2 TRP A 21 12.081 0.867 -4.724 1.00 0.00 C ATOM 336 CE3 TRP A 21 11.412 2.719 -6.131 1.00 0.00 C ATOM 337 CZ2 TRP A 21 13.081 1.647 -4.140 1.00 0.00 C ATOM 338 CZ3 TRP A 21 12.419 3.507 -5.546 1.00 0.00 C ATOM 339 CH2 TRP A 21 13.251 2.971 -4.552 1.00 0.00 C ATOM 0 H TRP A 21 9.854 -0.191 -10.161 1.00 0.00 H new ATOM 0 HA TRP A 21 9.826 -1.591 -7.681 1.00 0.00 H new ATOM 0 HB2 TRP A 21 9.215 1.365 -7.653 1.00 0.00 H new ATOM 0 HB3 TRP A 21 8.234 0.301 -6.665 1.00 0.00 H new ATOM 0 HD1 TRP A 21 10.100 -1.705 -5.429 1.00 0.00 H new ATOM 0 HE1 TRP A 21 12.078 -1.088 -3.885 1.00 0.00 H new ATOM 0 HE3 TRP A 21 10.776 3.141 -6.895 1.00 0.00 H new ATOM 0 HZ2 TRP A 21 13.719 1.230 -3.375 1.00 0.00 H new ATOM 0 HZ3 TRP A 21 12.553 4.531 -5.864 1.00 0.00 H new ATOM 0 HH2 TRP A 21 14.022 3.581 -4.106 1.00 0.00 H new ATOM 350 N VAL A 22 6.987 -0.380 -8.470 1.00 0.00 N ATOM 351 CA VAL A 22 5.653 -0.705 -8.958 1.00 0.00 C ATOM 352 C VAL A 22 5.537 -0.458 -10.461 1.00 0.00 C ATOM 353 O VAL A 22 4.448 -0.536 -11.027 1.00 0.00 O ATOM 354 CB VAL A 22 4.617 0.140 -8.221 1.00 0.00 C ATOM 355 CG1 VAL A 22 4.617 -0.222 -6.732 1.00 0.00 C ATOM 356 CG2 VAL A 22 4.962 1.618 -8.387 1.00 0.00 C ATOM 0 H VAL A 22 7.037 0.464 -7.900 1.00 0.00 H new ATOM 0 HA VAL A 22 5.472 -1.763 -8.770 1.00 0.00 H new ATOM 0 HB VAL A 22 3.628 -0.055 -8.637 1.00 0.00 H new ATOM 0 HG11 VAL A 22 3.876 0.384 -6.210 1.00 0.00 H new ATOM 0 HG12 VAL A 22 4.371 -1.277 -6.614 1.00 0.00 H new ATOM 0 HG13 VAL A 22 5.604 -0.030 -6.311 1.00 0.00 H new ATOM 0 HG21 VAL A 22 4.224 2.225 -7.862 1.00 0.00 H new ATOM 0 HG22 VAL A 22 5.951 1.810 -7.972 1.00 0.00 H new ATOM 0 HG23 VAL A 22 4.957 1.876 -9.446 1.00 0.00 H new ATOM 366 N ARG A 23 6.662 -0.165 -11.103 1.00 0.00 N ATOM 367 CA ARG A 23 6.660 0.084 -12.541 1.00 0.00 C ATOM 368 C ARG A 23 6.740 -1.232 -13.309 1.00 0.00 C ATOM 369 O ARG A 23 7.667 -1.450 -14.090 1.00 0.00 O ATOM 370 CB ARG A 23 7.847 0.973 -12.925 1.00 0.00 C ATOM 371 CG ARG A 23 7.565 1.681 -14.264 1.00 0.00 C ATOM 372 CD ARG A 23 8.829 1.671 -15.133 1.00 0.00 C ATOM 373 NE ARG A 23 8.756 2.714 -16.151 1.00 0.00 N ATOM 374 CZ ARG A 23 9.656 2.781 -17.128 1.00 0.00 C ATOM 375 NH1 ARG A 23 10.632 1.917 -17.176 1.00 0.00 N ATOM 376 NH2 ARG A 23 9.565 3.714 -18.036 1.00 0.00 N ATOM 0 H ARG A 23 7.577 -0.094 -10.658 1.00 0.00 H new ATOM 0 HA ARG A 23 5.731 0.592 -12.800 1.00 0.00 H new ATOM 0 HB2 ARG A 23 8.026 1.712 -12.144 1.00 0.00 H new ATOM 0 HB3 ARG A 23 8.752 0.370 -13.006 1.00 0.00 H new ATOM 0 HG2 ARG A 23 6.750 1.180 -14.786 1.00 0.00 H new ATOM 0 HG3 ARG A 23 7.245 2.707 -14.083 1.00 0.00 H new ATOM 0 HD2 ARG A 23 9.709 1.825 -14.508 1.00 0.00 H new ATOM 0 HD3 ARG A 23 8.943 0.697 -15.609 1.00 0.00 H new ATOM 0 HE ARG A 23 8.004 3.402 -16.113 1.00 0.00 H new ATOM 0 HH11 ARG A 23 10.705 1.190 -16.464 1.00 0.00 H new ATOM 0 HH12 ARG A 23 11.322 1.968 -17.925 1.00 0.00 H new ATOM 0 HH21 ARG A 23 8.804 4.392 -17.996 1.00 0.00 H new ATOM 0 HH22 ARG A 23 10.255 3.765 -18.785 1.00 0.00 H new ATOM 390 N GLY A 24 5.762 -2.107 -13.080 1.00 0.00 N ATOM 391 CA GLY A 24 5.724 -3.403 -13.755 1.00 0.00 C ATOM 392 C GLY A 24 4.467 -3.529 -14.608 1.00 0.00 C ATOM 393 O GLY A 24 3.942 -4.627 -14.801 1.00 0.00 O ATOM 0 H GLY A 24 4.989 -1.943 -12.435 1.00 0.00 H new ATOM 0 HA2 GLY A 24 6.608 -3.518 -14.382 1.00 0.00 H new ATOM 0 HA3 GLY A 24 5.750 -4.204 -13.017 1.00 0.00 H new ATOM 397 N ARG A 25 3.990 -2.398 -15.115 1.00 0.00 N ATOM 398 CA ARG A 25 2.793 -2.387 -15.949 1.00 0.00 C ATOM 399 C ARG A 25 1.551 -2.695 -15.114 1.00 0.00 C ATOM 400 O ARG A 25 0.599 -1.914 -15.095 1.00 0.00 O ATOM 401 CB ARG A 25 2.931 -3.416 -17.076 1.00 0.00 C ATOM 402 CG ARG A 25 2.016 -3.039 -18.249 1.00 0.00 C ATOM 403 CD ARG A 25 2.429 -3.829 -19.492 1.00 0.00 C ATOM 404 NE ARG A 25 2.590 -5.241 -19.165 1.00 0.00 N ATOM 405 CZ ARG A 25 3.006 -6.113 -20.078 1.00 0.00 C ATOM 406 NH1 ARG A 25 3.263 -5.713 -21.294 1.00 0.00 N ATOM 407 NH2 ARG A 25 3.154 -7.370 -19.761 1.00 0.00 N ATOM 0 H ARG A 25 4.411 -1.481 -14.965 1.00 0.00 H new ATOM 0 HA ARG A 25 2.683 -1.392 -16.381 1.00 0.00 H new ATOM 0 HB2 ARG A 25 3.967 -3.462 -17.413 1.00 0.00 H new ATOM 0 HB3 ARG A 25 2.672 -4.408 -16.707 1.00 0.00 H new ATOM 0 HG2 ARG A 25 0.977 -3.253 -17.997 1.00 0.00 H new ATOM 0 HG3 ARG A 25 2.082 -1.969 -18.446 1.00 0.00 H new ATOM 0 HD2 ARG A 25 1.676 -3.713 -20.272 1.00 0.00 H new ATOM 0 HD3 ARG A 25 3.363 -3.432 -19.890 1.00 0.00 H new ATOM 0 HE ARG A 25 2.380 -5.565 -18.221 1.00 0.00 H new ATOM 0 HH11 ARG A 25 3.145 -4.731 -21.544 1.00 0.00 H new ATOM 0 HH12 ARG A 25 3.582 -6.382 -21.994 1.00 0.00 H new ATOM 0 HH21 ARG A 25 2.950 -7.684 -18.812 1.00 0.00 H new ATOM 0 HH22 ARG A 25 3.473 -8.039 -20.462 1.00 0.00 H new ATOM 421 N HIS A 26 1.568 -3.834 -14.424 1.00 0.00 N ATOM 422 CA HIS A 26 0.438 -4.235 -13.585 1.00 0.00 C ATOM 423 C HIS A 26 0.815 -4.151 -12.110 1.00 0.00 C ATOM 424 O HIS A 26 0.193 -4.793 -11.263 1.00 0.00 O ATOM 425 CB HIS A 26 0.015 -5.668 -13.922 1.00 0.00 C ATOM 426 CG HIS A 26 -1.204 -6.032 -13.120 1.00 0.00 C ATOM 427 ND1 HIS A 26 -1.962 -5.079 -12.459 1.00 0.00 N ATOM 428 CD2 HIS A 26 -1.812 -7.237 -12.865 1.00 0.00 C ATOM 429 CE1 HIS A 26 -2.973 -5.718 -11.844 1.00 0.00 C ATOM 430 NE2 HIS A 26 -2.930 -7.035 -12.058 1.00 0.00 N ATOM 0 H HIS A 26 2.347 -4.493 -14.428 1.00 0.00 H new ATOM 0 HA HIS A 26 -0.393 -3.557 -13.780 1.00 0.00 H new ATOM 0 HB2 HIS A 26 -0.198 -5.755 -14.987 1.00 0.00 H new ATOM 0 HB3 HIS A 26 0.828 -6.360 -13.702 1.00 0.00 H new ATOM 0 HD2 HIS A 26 -1.475 -8.195 -13.234 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -3.728 -5.225 -11.249 1.00 0.00 H new ATOM 0 HE2 HIS A 26 -3.576 -7.741 -11.706 1.00 0.00 H new ATOM 439 N GLU A 27 1.841 -3.361 -11.811 1.00 0.00 N ATOM 440 CA GLU A 27 2.297 -3.202 -10.437 1.00 0.00 C ATOM 441 C GLU A 27 2.622 -4.558 -9.825 1.00 0.00 C ATOM 442 O GLU A 27 1.739 -5.257 -9.328 1.00 0.00 O ATOM 443 CB GLU A 27 1.219 -2.498 -9.606 1.00 0.00 C ATOM 444 CG GLU A 27 0.670 -1.279 -10.381 1.00 0.00 C ATOM 445 CD GLU A 27 0.734 -0.020 -9.519 1.00 0.00 C ATOM 446 OE1 GLU A 27 -0.003 0.050 -8.550 1.00 0.00 O ATOM 447 OE2 GLU A 27 1.516 0.857 -9.845 1.00 0.00 O ATOM 0 H GLU A 27 2.369 -2.824 -12.499 1.00 0.00 H new ATOM 0 HA GLU A 27 3.201 -2.594 -10.438 1.00 0.00 H new ATOM 0 HB2 GLU A 27 0.409 -3.192 -9.382 1.00 0.00 H new ATOM 0 HB3 GLU A 27 1.636 -2.176 -8.652 1.00 0.00 H new ATOM 0 HG2 GLU A 27 1.248 -1.131 -11.293 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -0.360 -1.467 -10.683 1.00 0.00 H new ATOM 454 N THR A 28 3.899 -4.926 -9.871 1.00 0.00 N ATOM 455 CA THR A 28 4.345 -6.205 -9.329 1.00 0.00 C ATOM 456 C THR A 28 5.215 -5.998 -8.096 1.00 0.00 C ATOM 457 O THR A 28 5.948 -6.896 -7.684 1.00 0.00 O ATOM 458 CB THR A 28 5.146 -6.959 -10.390 1.00 0.00 C ATOM 459 OG1 THR A 28 5.526 -8.229 -9.880 1.00 0.00 O ATOM 460 CG2 THR A 28 6.394 -6.154 -10.751 1.00 0.00 C ATOM 0 H THR A 28 4.642 -4.358 -10.277 1.00 0.00 H new ATOM 0 HA THR A 28 3.466 -6.783 -9.044 1.00 0.00 H new ATOM 0 HB THR A 28 4.535 -7.096 -11.282 1.00 0.00 H new ATOM 0 HG1 THR A 28 5.838 -8.130 -8.956 1.00 0.00 H new ATOM 0 HG21 THR A 28 6.967 -6.690 -11.508 1.00 0.00 H new ATOM 0 HG22 THR A 28 6.098 -5.180 -11.142 1.00 0.00 H new ATOM 0 HG23 THR A 28 7.008 -6.016 -9.861 1.00 0.00 H new ATOM 468 N TYR A 29 5.136 -4.806 -7.515 1.00 0.00 N ATOM 469 CA TYR A 29 5.933 -4.490 -6.331 1.00 0.00 C ATOM 470 C TYR A 29 5.086 -3.794 -5.266 1.00 0.00 C ATOM 471 O TYR A 29 5.006 -2.566 -5.229 1.00 0.00 O ATOM 472 CB TYR A 29 7.110 -3.583 -6.733 1.00 0.00 C ATOM 473 CG TYR A 29 8.367 -4.405 -6.910 1.00 0.00 C ATOM 474 CD1 TYR A 29 8.909 -5.095 -5.820 1.00 0.00 C ATOM 475 CD2 TYR A 29 8.992 -4.471 -8.161 1.00 0.00 C ATOM 476 CE1 TYR A 29 10.075 -5.851 -5.978 1.00 0.00 C ATOM 477 CE2 TYR A 29 10.158 -5.229 -8.321 1.00 0.00 C ATOM 478 CZ TYR A 29 10.700 -5.918 -7.230 1.00 0.00 C ATOM 479 OH TYR A 29 11.852 -6.664 -7.386 1.00 0.00 O ATOM 0 H TYR A 29 4.535 -4.048 -7.839 1.00 0.00 H new ATOM 0 HA TYR A 29 6.310 -5.422 -5.910 1.00 0.00 H new ATOM 0 HB2 TYR A 29 6.875 -3.060 -7.660 1.00 0.00 H new ATOM 0 HB3 TYR A 29 7.269 -2.822 -5.969 1.00 0.00 H new ATOM 0 HD1 TYR A 29 8.426 -5.044 -4.855 1.00 0.00 H new ATOM 0 HD2 TYR A 29 8.575 -3.937 -9.002 1.00 0.00 H new ATOM 0 HE1 TYR A 29 10.493 -6.382 -5.136 1.00 0.00 H new ATOM 0 HE2 TYR A 29 10.639 -5.282 -9.286 1.00 0.00 H new ATOM 0 HH TYR A 29 12.156 -6.605 -8.316 1.00 0.00 H new ATOM 489 N LEU A 30 4.476 -4.584 -4.389 1.00 0.00 N ATOM 490 CA LEU A 30 3.664 -4.028 -3.313 1.00 0.00 C ATOM 491 C LEU A 30 3.411 -5.078 -2.249 1.00 0.00 C ATOM 492 O LEU A 30 3.565 -6.269 -2.494 1.00 0.00 O ATOM 493 CB LEU A 30 2.325 -3.502 -3.855 1.00 0.00 C ATOM 494 CG LEU A 30 1.371 -4.673 -4.177 1.00 0.00 C ATOM 495 CD1 LEU A 30 0.431 -4.966 -2.993 1.00 0.00 C ATOM 496 CD2 LEU A 30 0.517 -4.306 -5.392 1.00 0.00 C ATOM 0 H LEU A 30 4.527 -5.603 -4.401 1.00 0.00 H new ATOM 0 HA LEU A 30 4.211 -3.196 -2.871 1.00 0.00 H new ATOM 0 HB2 LEU A 30 1.864 -2.841 -3.121 1.00 0.00 H new ATOM 0 HB3 LEU A 30 2.498 -2.909 -4.753 1.00 0.00 H new ATOM 0 HG LEU A 30 1.975 -5.558 -4.378 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -0.229 -5.795 -3.249 1.00 0.00 H new ATOM 0 HD12 LEU A 30 1.022 -5.230 -2.116 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -0.166 -4.081 -2.775 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -0.159 -5.129 -5.624 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -0.064 -3.411 -5.171 1.00 0.00 H new ATOM 0 HD23 LEU A 30 1.165 -4.116 -6.248 1.00 0.00 H new ATOM 508 N CYS A 31 3.005 -4.632 -1.070 1.00 0.00 N ATOM 509 CA CYS A 31 2.706 -5.547 0.022 1.00 0.00 C ATOM 510 C CYS A 31 1.476 -5.048 0.762 1.00 0.00 C ATOM 511 O CYS A 31 1.269 -3.842 0.887 1.00 0.00 O ATOM 512 CB CYS A 31 3.907 -5.678 0.969 1.00 0.00 C ATOM 513 SG CYS A 31 5.343 -4.852 0.240 1.00 0.00 S ATOM 0 H CYS A 31 2.875 -3.646 -0.845 1.00 0.00 H new ATOM 0 HA CYS A 31 2.503 -6.539 -0.381 1.00 0.00 H new ATOM 0 HB2 CYS A 31 3.671 -5.234 1.936 1.00 0.00 H new ATOM 0 HB3 CYS A 31 4.131 -6.730 1.147 1.00 0.00 H new ATOM 0 HG CYS A 31 6.433 -5.350 0.745 1.00 0.00 H new ATOM 519 N TYR A 32 0.653 -5.973 1.240 1.00 0.00 N ATOM 520 CA TYR A 32 -0.560 -5.590 1.949 1.00 0.00 C ATOM 521 C TYR A 32 -0.696 -6.412 3.216 1.00 0.00 C ATOM 522 O TYR A 32 -0.590 -7.639 3.203 1.00 0.00 O ATOM 523 CB TYR A 32 -1.776 -5.759 1.011 1.00 0.00 C ATOM 524 CG TYR A 32 -2.808 -6.709 1.580 1.00 0.00 C ATOM 525 CD1 TYR A 32 -2.661 -8.087 1.408 1.00 0.00 C ATOM 526 CD2 TYR A 32 -3.923 -6.206 2.252 1.00 0.00 C ATOM 527 CE1 TYR A 32 -3.623 -8.965 1.905 1.00 0.00 C ATOM 528 CE2 TYR A 32 -4.893 -7.083 2.748 1.00 0.00 C ATOM 529 CZ TYR A 32 -4.740 -8.466 2.572 1.00 0.00 C ATOM 530 OH TYR A 32 -5.690 -9.337 3.053 1.00 0.00 O ATOM 0 H TYR A 32 0.800 -6.978 1.152 1.00 0.00 H new ATOM 0 HA TYR A 32 -0.510 -4.542 2.245 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -2.237 -4.787 0.837 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -1.438 -6.129 0.043 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -1.798 -8.474 0.887 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -4.037 -5.141 2.389 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -3.503 -10.030 1.773 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -5.758 -6.696 3.266 1.00 0.00 H new ATOM 0 HH TYR A 32 -5.389 -10.259 2.913 1.00 0.00 H new ATOM 540 N GLU A 33 -0.912 -5.707 4.306 1.00 0.00 N ATOM 541 CA GLU A 33 -1.045 -6.315 5.606 1.00 0.00 C ATOM 542 C GLU A 33 -2.343 -5.865 6.249 1.00 0.00 C ATOM 543 O GLU A 33 -2.621 -4.674 6.342 1.00 0.00 O ATOM 544 CB GLU A 33 0.153 -5.887 6.440 1.00 0.00 C ATOM 545 CG GLU A 33 1.403 -6.542 5.855 1.00 0.00 C ATOM 546 CD GLU A 33 2.592 -6.327 6.785 1.00 0.00 C ATOM 547 OE1 GLU A 33 2.366 -6.068 7.956 1.00 0.00 O ATOM 548 OE2 GLU A 33 3.713 -6.421 6.312 1.00 0.00 O ATOM 0 H GLU A 33 -1.000 -4.691 4.312 1.00 0.00 H new ATOM 0 HA GLU A 33 -1.071 -7.402 5.530 1.00 0.00 H new ATOM 0 HB2 GLU A 33 0.254 -4.802 6.431 1.00 0.00 H new ATOM 0 HB3 GLU A 33 0.019 -6.186 7.479 1.00 0.00 H new ATOM 0 HG2 GLU A 33 1.231 -7.609 5.713 1.00 0.00 H new ATOM 0 HG3 GLU A 33 1.618 -6.120 4.873 1.00 0.00 H new ATOM 555 N VAL A 34 -3.154 -6.821 6.668 1.00 0.00 N ATOM 556 CA VAL A 34 -4.432 -6.491 7.273 1.00 0.00 C ATOM 557 C VAL A 34 -4.711 -7.359 8.479 1.00 0.00 C ATOM 558 O VAL A 34 -4.278 -8.508 8.554 1.00 0.00 O ATOM 559 CB VAL A 34 -5.546 -6.683 6.255 1.00 0.00 C ATOM 560 CG1 VAL A 34 -5.409 -8.056 5.594 1.00 0.00 C ATOM 561 CG2 VAL A 34 -6.903 -6.571 6.965 1.00 0.00 C ATOM 0 H VAL A 34 -2.954 -7.819 6.602 1.00 0.00 H new ATOM 0 HA VAL A 34 -4.391 -5.451 7.596 1.00 0.00 H new ATOM 0 HB VAL A 34 -5.478 -5.914 5.485 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -6.208 -8.190 4.865 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -4.444 -8.123 5.091 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -5.476 -8.834 6.354 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -7.705 -6.708 6.240 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -6.975 -7.339 7.735 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -6.993 -5.587 7.424 1.00 0.00 H new ATOM 571 N GLU A 35 -5.458 -6.796 9.415 1.00 0.00 N ATOM 572 CA GLU A 35 -5.827 -7.508 10.619 1.00 0.00 C ATOM 573 C GLU A 35 -7.328 -7.452 10.812 1.00 0.00 C ATOM 574 O GLU A 35 -7.966 -6.436 10.537 1.00 0.00 O ATOM 575 CB GLU A 35 -5.118 -6.896 11.827 1.00 0.00 C ATOM 576 CG GLU A 35 -3.609 -7.051 11.652 1.00 0.00 C ATOM 577 CD GLU A 35 -2.926 -7.112 13.014 1.00 0.00 C ATOM 578 OE1 GLU A 35 -3.439 -6.502 13.939 1.00 0.00 O ATOM 579 OE2 GLU A 35 -1.901 -7.766 13.114 1.00 0.00 O ATOM 0 H GLU A 35 -5.820 -5.844 9.360 1.00 0.00 H new ATOM 0 HA GLU A 35 -5.522 -8.550 10.523 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -5.379 -5.842 11.922 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -5.443 -7.389 12.743 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -3.392 -7.958 11.087 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -3.214 -6.214 11.076 1.00 0.00 H new ATOM 586 N ARG A 36 -7.888 -8.556 11.277 1.00 0.00 N ATOM 587 CA ARG A 36 -9.322 -8.633 11.495 1.00 0.00 C ATOM 588 C ARG A 36 -9.642 -8.537 12.976 1.00 0.00 C ATOM 589 O ARG A 36 -8.839 -8.918 13.831 1.00 0.00 O ATOM 590 CB ARG A 36 -9.872 -9.949 10.944 1.00 0.00 C ATOM 591 CG ARG A 36 -8.893 -11.084 11.246 1.00 0.00 C ATOM 592 CD ARG A 36 -9.641 -12.422 11.245 1.00 0.00 C ATOM 593 NE ARG A 36 -10.199 -12.691 12.568 1.00 0.00 N ATOM 594 CZ ARG A 36 -11.125 -13.629 12.747 1.00 0.00 C ATOM 595 NH1 ARG A 36 -11.562 -14.322 11.730 1.00 0.00 N ATOM 596 NH2 ARG A 36 -11.600 -13.857 13.942 1.00 0.00 N ATOM 0 H ARG A 36 -7.375 -9.406 11.510 1.00 0.00 H new ATOM 0 HA ARG A 36 -9.790 -7.798 10.973 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -10.842 -10.164 11.391 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -10.028 -9.867 9.868 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -8.098 -11.100 10.501 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -8.419 -10.921 12.214 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -10.440 -12.400 10.504 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -8.963 -13.226 10.959 1.00 0.00 H new ATOM 0 HE ARG A 36 -9.873 -12.150 13.369 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -11.193 -14.145 10.796 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -12.272 -15.041 11.870 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -11.261 -13.316 14.737 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -12.310 -14.576 14.080 1.00 0.00 H new ATOM 610 N MET A 37 -10.829 -8.029 13.266 1.00 0.00 N ATOM 611 CA MET A 37 -11.277 -7.884 14.638 1.00 0.00 C ATOM 612 C MET A 37 -12.337 -8.920 14.941 1.00 0.00 C ATOM 613 O MET A 37 -13.287 -9.072 14.179 1.00 0.00 O ATOM 614 CB MET A 37 -11.857 -6.495 14.860 1.00 0.00 C ATOM 615 CG MET A 37 -10.780 -5.443 14.589 1.00 0.00 C ATOM 616 SD MET A 37 -11.301 -3.853 15.275 1.00 0.00 S ATOM 617 CE MET A 37 -11.377 -4.386 16.997 1.00 0.00 C ATOM 0 H MET A 37 -11.500 -7.710 12.567 1.00 0.00 H new ATOM 0 HA MET A 37 -10.423 -8.026 15.300 1.00 0.00 H new ATOM 0 HB2 MET A 37 -12.710 -6.336 14.200 1.00 0.00 H new ATOM 0 HB3 MET A 37 -12.223 -6.401 15.882 1.00 0.00 H new ATOM 0 HG2 MET A 37 -9.835 -5.752 15.036 1.00 0.00 H new ATOM 0 HG3 MET A 37 -10.610 -5.350 13.516 1.00 0.00 H new ATOM 0 HE1 MET A 37 -11.278 -3.520 17.651 1.00 0.00 H new ATOM 0 HE2 MET A 37 -12.333 -4.875 17.185 1.00 0.00 H new ATOM 0 HE3 MET A 37 -10.566 -5.086 17.197 1.00 0.00 H new ATOM 627 N HIS A 38 -12.188 -9.611 16.064 1.00 0.00 N ATOM 628 CA HIS A 38 -13.160 -10.616 16.461 1.00 0.00 C ATOM 629 C HIS A 38 -14.036 -10.019 17.532 1.00 0.00 C ATOM 630 O HIS A 38 -13.642 -9.934 18.689 1.00 0.00 O ATOM 631 CB HIS A 38 -12.458 -11.865 17.000 1.00 0.00 C ATOM 632 CG HIS A 38 -13.485 -12.821 17.539 1.00 0.00 C ATOM 633 ND1 HIS A 38 -14.396 -13.468 16.718 1.00 0.00 N ATOM 634 CD2 HIS A 38 -13.758 -13.252 18.814 1.00 0.00 C ATOM 635 CE1 HIS A 38 -15.166 -14.246 17.501 1.00 0.00 C ATOM 636 NE2 HIS A 38 -14.821 -14.151 18.788 1.00 0.00 N ATOM 0 H HIS A 38 -11.408 -9.494 16.711 1.00 0.00 H new ATOM 0 HA HIS A 38 -13.757 -10.913 15.598 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -11.881 -12.342 16.208 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -11.754 -11.590 17.785 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -13.228 -12.941 19.702 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -15.966 -14.871 17.133 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -15.245 -14.633 19.581 1.00 0.00 H new ATOM 645 N ASN A 39 -15.207 -9.565 17.149 1.00 0.00 N ATOM 646 CA ASN A 39 -16.074 -8.943 18.118 1.00 0.00 C ATOM 647 C ASN A 39 -15.426 -7.655 18.600 1.00 0.00 C ATOM 648 O ASN A 39 -14.573 -7.078 17.926 1.00 0.00 O ATOM 649 CB ASN A 39 -16.281 -9.878 19.313 1.00 0.00 C ATOM 650 CG ASN A 39 -17.554 -9.509 20.051 1.00 0.00 C ATOM 651 OD1 ASN A 39 -18.215 -8.528 19.709 1.00 0.00 O ATOM 652 ND2 ASN A 39 -17.936 -10.243 21.053 1.00 0.00 N ATOM 0 H ASN A 39 -15.573 -9.613 16.198 1.00 0.00 H new ATOM 0 HA ASN A 39 -17.040 -8.732 17.658 1.00 0.00 H new ATOM 0 HB2 ASN A 39 -16.337 -10.911 18.970 1.00 0.00 H new ATOM 0 HB3 ASN A 39 -15.428 -9.812 19.988 1.00 0.00 H new ATOM 0 HD21 ASN A 39 -18.788 -10.008 21.562 1.00 0.00 H new ATOM 0 HD22 ASN A 39 -17.384 -11.054 21.331 1.00 0.00 H new ATOM 659 N ASP A 40 -15.841 -7.220 19.767 1.00 0.00 N ATOM 660 CA ASP A 40 -15.318 -6.005 20.368 1.00 0.00 C ATOM 661 C ASP A 40 -13.797 -6.027 20.539 1.00 0.00 C ATOM 662 O ASP A 40 -13.267 -5.189 21.269 1.00 0.00 O ATOM 663 CB ASP A 40 -15.941 -5.824 21.748 1.00 0.00 C ATOM 664 CG ASP A 40 -17.389 -5.365 21.613 1.00 0.00 C ATOM 665 OD1 ASP A 40 -17.875 -5.324 20.495 1.00 0.00 O ATOM 666 OD2 ASP A 40 -17.990 -5.063 22.631 1.00 0.00 O ATOM 0 H ASP A 40 -16.548 -7.693 20.329 1.00 0.00 H new ATOM 0 HA ASP A 40 -15.570 -5.186 19.694 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -15.899 -6.763 22.301 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -15.371 -5.092 22.320 1.00 0.00 H new ATOM 671 N THR A 41 -13.077 -6.979 19.923 1.00 0.00 N ATOM 672 CA THR A 41 -11.635 -7.025 20.118 1.00 0.00 C ATOM 673 C THR A 41 -10.868 -7.180 18.817 1.00 0.00 C ATOM 674 O THR A 41 -11.448 -7.339 17.748 1.00 0.00 O ATOM 675 CB THR A 41 -11.302 -8.143 21.093 1.00 0.00 C ATOM 676 OG1 THR A 41 -10.084 -7.840 21.759 1.00 0.00 O ATOM 677 CG2 THR A 41 -11.168 -9.478 20.364 1.00 0.00 C ATOM 0 H THR A 41 -13.460 -7.698 19.309 1.00 0.00 H new ATOM 0 HA THR A 41 -11.319 -6.068 20.533 1.00 0.00 H new ATOM 0 HB THR A 41 -12.112 -8.226 21.818 1.00 0.00 H new ATOM 0 HG1 THR A 41 -9.868 -8.559 22.389 1.00 0.00 H new ATOM 0 HG21 THR A 41 -10.930 -10.262 21.082 1.00 0.00 H new ATOM 0 HG22 THR A 41 -12.107 -9.716 19.865 1.00 0.00 H new ATOM 0 HG23 THR A 41 -10.371 -9.410 19.623 1.00 0.00 H new ATOM 685 N TRP A 42 -9.552 -7.102 18.935 1.00 0.00 N ATOM 686 CA TRP A 42 -8.665 -7.192 17.778 1.00 0.00 C ATOM 687 C TRP A 42 -7.926 -8.527 17.718 1.00 0.00 C ATOM 688 O TRP A 42 -7.726 -9.188 18.737 1.00 0.00 O ATOM 689 CB TRP A 42 -7.647 -6.052 17.834 1.00 0.00 C ATOM 690 CG TRP A 42 -7.060 -5.968 19.207 1.00 0.00 C ATOM 691 CD1 TRP A 42 -6.271 -6.909 19.776 1.00 0.00 C ATOM 692 CD2 TRP A 42 -7.201 -4.902 20.193 1.00 0.00 C ATOM 693 NE1 TRP A 42 -5.919 -6.486 21.047 1.00 0.00 N ATOM 694 CE2 TRP A 42 -6.467 -5.260 21.348 1.00 0.00 C ATOM 695 CE3 TRP A 42 -7.885 -3.673 20.198 1.00 0.00 C ATOM 696 CZ2 TRP A 42 -6.411 -4.434 22.464 1.00 0.00 C ATOM 697 CZ3 TRP A 42 -7.832 -2.835 21.325 1.00 0.00 C ATOM 698 CH2 TRP A 42 -7.096 -3.215 22.456 1.00 0.00 C ATOM 0 H TRP A 42 -9.069 -6.976 19.824 1.00 0.00 H new ATOM 0 HA TRP A 42 -9.281 -7.116 16.882 1.00 0.00 H new ATOM 0 HB2 TRP A 42 -6.858 -6.219 17.100 1.00 0.00 H new ATOM 0 HB3 TRP A 42 -8.128 -5.109 17.575 1.00 0.00 H new ATOM 0 HD1 TRP A 42 -5.966 -7.837 19.315 1.00 0.00 H new ATOM 0 HE1 TRP A 42 -5.325 -7.019 21.683 1.00 0.00 H new ATOM 0 HE3 TRP A 42 -8.454 -3.372 19.331 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 -5.842 -4.732 23.332 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 -8.361 -1.893 21.320 1.00 0.00 H new ATOM 0 HH2 TRP A 42 -7.058 -2.567 23.320 1.00 0.00 H new ATOM 709 N VAL A 43 -7.514 -8.910 16.506 1.00 0.00 N ATOM 710 CA VAL A 43 -6.783 -10.160 16.299 1.00 0.00 C ATOM 711 C VAL A 43 -5.558 -9.911 15.418 1.00 0.00 C ATOM 712 O VAL A 43 -5.546 -8.985 14.607 1.00 0.00 O ATOM 713 CB VAL A 43 -7.692 -11.197 15.633 1.00 0.00 C ATOM 714 CG1 VAL A 43 -7.237 -12.607 16.018 1.00 0.00 C ATOM 715 CG2 VAL A 43 -9.133 -10.987 16.098 1.00 0.00 C ATOM 0 H VAL A 43 -7.675 -8.372 15.655 1.00 0.00 H new ATOM 0 HA VAL A 43 -6.457 -10.539 17.268 1.00 0.00 H new ATOM 0 HB VAL A 43 -7.635 -11.081 14.551 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -7.887 -13.342 15.542 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -6.210 -12.761 15.686 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -7.290 -12.723 17.100 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -9.780 -11.725 15.624 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -9.186 -11.100 17.181 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -9.462 -9.985 15.822 1.00 0.00 H new ATOM 725 N LEU A 44 -4.525 -10.739 15.584 1.00 0.00 N ATOM 726 CA LEU A 44 -3.299 -10.594 14.805 1.00 0.00 C ATOM 727 C LEU A 44 -3.044 -11.839 13.956 1.00 0.00 C ATOM 728 O LEU A 44 -2.564 -12.857 14.457 1.00 0.00 O ATOM 729 CB LEU A 44 -2.118 -10.368 15.753 1.00 0.00 C ATOM 730 CG LEU A 44 -2.338 -11.155 17.055 1.00 0.00 C ATOM 731 CD1 LEU A 44 -0.987 -11.598 17.626 1.00 0.00 C ATOM 732 CD2 LEU A 44 -3.051 -10.267 18.082 1.00 0.00 C ATOM 0 H LEU A 44 -4.515 -11.513 16.248 1.00 0.00 H new ATOM 0 HA LEU A 44 -3.409 -9.739 14.138 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -1.191 -10.687 15.277 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -2.014 -9.305 15.973 1.00 0.00 H new ATOM 0 HG LEU A 44 -2.950 -12.031 16.841 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -1.147 -12.155 18.549 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -0.477 -12.233 16.902 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -0.375 -10.721 17.834 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -3.205 -10.828 19.004 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -2.440 -9.389 18.290 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -4.015 -9.952 17.683 1.00 0.00 H new ATOM 744 N LEU A 45 -3.364 -11.747 12.669 1.00 0.00 N ATOM 745 CA LEU A 45 -3.165 -12.864 11.751 1.00 0.00 C ATOM 746 C LEU A 45 -1.706 -13.317 11.748 1.00 0.00 C ATOM 747 O LEU A 45 -0.840 -12.656 12.322 1.00 0.00 O ATOM 748 CB LEU A 45 -3.565 -12.441 10.339 1.00 0.00 C ATOM 749 CG LEU A 45 -5.047 -12.053 10.326 1.00 0.00 C ATOM 750 CD1 LEU A 45 -5.397 -11.413 8.981 1.00 0.00 C ATOM 751 CD2 LEU A 45 -5.913 -13.302 10.543 1.00 0.00 C ATOM 0 H LEU A 45 -3.762 -10.912 12.238 1.00 0.00 H new ATOM 0 HA LEU A 45 -3.786 -13.696 12.083 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -2.954 -11.599 10.013 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -3.385 -13.256 9.638 1.00 0.00 H new ATOM 0 HG LEU A 45 -5.239 -11.340 11.128 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -6.452 -11.137 8.973 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -4.788 -10.521 8.833 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -5.201 -12.124 8.178 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -6.966 -13.021 10.533 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -5.722 -14.020 9.746 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -5.667 -13.753 11.504 1.00 0.00 H new ATOM 763 N ASN A 46 -1.444 -14.449 11.099 1.00 0.00 N ATOM 764 CA ASN A 46 -0.087 -14.979 11.026 1.00 0.00 C ATOM 765 C ASN A 46 0.704 -14.289 9.920 1.00 0.00 C ATOM 766 O ASN A 46 1.682 -13.592 10.188 1.00 0.00 O ATOM 767 CB ASN A 46 -0.123 -16.487 10.761 1.00 0.00 C ATOM 768 CG ASN A 46 1.202 -17.117 11.180 1.00 0.00 C ATOM 769 OD1 ASN A 46 1.478 -17.245 12.372 1.00 0.00 O ATOM 770 ND2 ASN A 46 2.041 -17.519 10.265 1.00 0.00 N ATOM 0 H ASN A 46 -2.147 -15.012 10.620 1.00 0.00 H new ATOM 0 HA ASN A 46 0.403 -14.789 11.981 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -0.944 -16.943 11.314 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -0.307 -16.675 9.703 1.00 0.00 H new ATOM 0 HD21 ASN A 46 2.929 -17.941 10.537 1.00 0.00 H new ATOM 0 HD22 ASN A 46 1.809 -17.411 9.278 1.00 0.00 H new ATOM 777 N GLN A 47 0.274 -14.492 8.676 1.00 0.00 N ATOM 778 CA GLN A 47 0.945 -13.889 7.526 1.00 0.00 C ATOM 779 C GLN A 47 1.527 -12.528 7.894 1.00 0.00 C ATOM 780 O GLN A 47 0.935 -11.779 8.671 1.00 0.00 O ATOM 781 CB GLN A 47 -0.043 -13.729 6.370 1.00 0.00 C ATOM 782 CG GLN A 47 -0.284 -15.089 5.713 1.00 0.00 C ATOM 783 CD GLN A 47 -0.561 -16.144 6.779 1.00 0.00 C ATOM 784 OE1 GLN A 47 0.439 -16.722 7.388 1.00 0.00 O flip ATOM 785 NE2 GLN A 47 -1.719 -16.451 7.064 1.00 0.00 N flip ATOM 0 H GLN A 47 -0.534 -15.068 8.439 1.00 0.00 H new ATOM 0 HA GLN A 47 1.759 -14.546 7.220 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -0.984 -13.318 6.736 1.00 0.00 H new ATOM 0 HB3 GLN A 47 0.349 -13.024 5.637 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -1.127 -15.025 5.026 1.00 0.00 H new ATOM 0 HG3 GLN A 47 0.587 -15.376 5.123 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -2.499 -15.998 6.587 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -1.898 -17.158 7.777 1.00 0.00 H new ATOM 794 N ARG A 48 2.693 -12.217 7.337 1.00 0.00 N ATOM 795 CA ARG A 48 3.356 -10.944 7.618 1.00 0.00 C ATOM 796 C ARG A 48 3.300 -10.025 6.398 1.00 0.00 C ATOM 797 O ARG A 48 3.065 -8.824 6.526 1.00 0.00 O ATOM 798 CB ARG A 48 4.823 -11.187 8.036 1.00 0.00 C ATOM 799 CG ARG A 48 5.224 -12.638 7.742 1.00 0.00 C ATOM 800 CD ARG A 48 4.645 -13.567 8.817 1.00 0.00 C ATOM 801 NE ARG A 48 5.603 -13.741 9.903 1.00 0.00 N ATOM 802 CZ ARG A 48 5.392 -14.625 10.875 1.00 0.00 C ATOM 803 NH1 ARG A 48 4.313 -15.361 10.869 1.00 0.00 N ATOM 804 NH2 ARG A 48 6.263 -14.755 11.837 1.00 0.00 N ATOM 0 H ARG A 48 3.198 -12.824 6.691 1.00 0.00 H new ATOM 0 HA ARG A 48 2.831 -10.457 8.440 1.00 0.00 H new ATOM 0 HB2 ARG A 48 5.480 -10.504 7.497 1.00 0.00 H new ATOM 0 HB3 ARG A 48 4.946 -10.976 9.098 1.00 0.00 H new ATOM 0 HG2 ARG A 48 4.859 -12.933 6.758 1.00 0.00 H new ATOM 0 HG3 ARG A 48 6.310 -12.727 7.719 1.00 0.00 H new ATOM 0 HD2 ARG A 48 3.716 -13.150 9.206 1.00 0.00 H new ATOM 0 HD3 ARG A 48 4.402 -14.535 8.379 1.00 0.00 H new ATOM 0 HE ARG A 48 6.451 -13.174 9.918 1.00 0.00 H new ATOM 0 HH11 ARG A 48 3.630 -15.259 10.118 1.00 0.00 H new ATOM 0 HH12 ARG A 48 4.153 -16.038 11.615 1.00 0.00 H new ATOM 0 HH21 ARG A 48 7.105 -14.179 11.844 1.00 0.00 H new ATOM 0 HH22 ARG A 48 6.102 -15.432 12.583 1.00 0.00 H new ATOM 818 N ARG A 49 3.520 -10.595 5.219 1.00 0.00 N ATOM 819 CA ARG A 49 3.494 -9.812 3.988 1.00 0.00 C ATOM 820 C ARG A 49 3.051 -10.676 2.813 1.00 0.00 C ATOM 821 O ARG A 49 3.528 -11.796 2.640 1.00 0.00 O ATOM 822 CB ARG A 49 4.883 -9.239 3.709 1.00 0.00 C ATOM 823 CG ARG A 49 5.880 -10.384 3.521 1.00 0.00 C ATOM 824 CD ARG A 49 7.293 -9.886 3.819 1.00 0.00 C ATOM 825 NE ARG A 49 7.463 -9.713 5.254 1.00 0.00 N ATOM 826 CZ ARG A 49 8.665 -9.769 5.819 1.00 0.00 C ATOM 827 NH1 ARG A 49 9.719 -9.994 5.083 1.00 0.00 N ATOM 828 NH2 ARG A 49 8.790 -9.607 7.107 1.00 0.00 N ATOM 0 H ARG A 49 3.717 -11.587 5.089 1.00 0.00 H new ATOM 0 HA ARG A 49 2.782 -8.996 4.111 1.00 0.00 H new ATOM 0 HB2 ARG A 49 4.858 -8.615 2.816 1.00 0.00 H new ATOM 0 HB3 ARG A 49 5.197 -8.601 4.535 1.00 0.00 H new ATOM 0 HG2 ARG A 49 5.628 -11.212 4.184 1.00 0.00 H new ATOM 0 HG3 ARG A 49 5.825 -10.764 2.501 1.00 0.00 H new ATOM 0 HD2 ARG A 49 8.027 -10.598 3.440 1.00 0.00 H new ATOM 0 HD3 ARG A 49 7.471 -8.941 3.306 1.00 0.00 H new ATOM 0 HE ARG A 49 6.644 -9.545 5.838 1.00 0.00 H new ATOM 0 HH11 ARG A 49 9.619 -10.126 4.077 1.00 0.00 H new ATOM 0 HH12 ARG A 49 10.642 -10.037 5.514 1.00 0.00 H new ATOM 0 HH21 ARG A 49 7.965 -9.437 7.682 1.00 0.00 H new ATOM 0 HH22 ARG A 49 9.713 -9.650 7.539 1.00 0.00 H new ATOM 842 N GLY A 50 2.134 -10.148 2.006 1.00 0.00 N ATOM 843 CA GLY A 50 1.638 -10.889 0.852 1.00 0.00 C ATOM 844 C GLY A 50 0.942 -9.968 -0.147 1.00 0.00 C ATOM 845 O GLY A 50 0.308 -8.984 0.234 1.00 0.00 O ATOM 0 H GLY A 50 1.724 -9.222 2.128 1.00 0.00 H new ATOM 0 HA2 GLY A 50 2.467 -11.399 0.362 1.00 0.00 H new ATOM 0 HA3 GLY A 50 0.942 -11.659 1.184 1.00 0.00 H new ATOM 849 N PHE A 51 1.077 -10.296 -1.429 1.00 0.00 N ATOM 850 CA PHE A 51 0.463 -9.504 -2.494 1.00 0.00 C ATOM 851 C PHE A 51 0.483 -10.260 -3.819 1.00 0.00 C ATOM 852 O PHE A 51 0.805 -11.448 -3.863 1.00 0.00 O ATOM 853 CB PHE A 51 1.201 -8.187 -2.651 1.00 0.00 C ATOM 854 CG PHE A 51 2.588 -8.461 -3.164 1.00 0.00 C ATOM 855 CD1 PHE A 51 3.537 -9.042 -2.320 1.00 0.00 C ATOM 856 CD2 PHE A 51 2.923 -8.134 -4.481 1.00 0.00 C ATOM 857 CE1 PHE A 51 4.829 -9.301 -2.793 1.00 0.00 C ATOM 858 CE2 PHE A 51 4.214 -8.392 -4.958 1.00 0.00 C ATOM 859 CZ PHE A 51 5.167 -8.977 -4.113 1.00 0.00 C ATOM 0 H PHE A 51 1.606 -11.104 -1.757 1.00 0.00 H new ATOM 0 HA PHE A 51 -0.574 -9.313 -2.219 1.00 0.00 H new ATOM 0 HB2 PHE A 51 0.666 -7.536 -3.342 1.00 0.00 H new ATOM 0 HB3 PHE A 51 1.249 -7.666 -1.695 1.00 0.00 H new ATOM 0 HD1 PHE A 51 3.274 -9.291 -1.303 1.00 0.00 H new ATOM 0 HD2 PHE A 51 2.187 -7.683 -5.130 1.00 0.00 H new ATOM 0 HE1 PHE A 51 5.564 -9.750 -2.141 1.00 0.00 H new ATOM 0 HE2 PHE A 51 4.475 -8.141 -5.975 1.00 0.00 H new ATOM 0 HZ PHE A 51 6.163 -9.178 -4.480 1.00 0.00 H new ATOM 869 N LEU A 52 0.131 -9.562 -4.898 1.00 0.00 N ATOM 870 CA LEU A 52 0.105 -10.171 -6.229 1.00 0.00 C ATOM 871 C LEU A 52 1.167 -9.548 -7.134 1.00 0.00 C ATOM 872 O LEU A 52 1.353 -8.332 -7.145 1.00 0.00 O ATOM 873 CB LEU A 52 -1.282 -9.992 -6.863 1.00 0.00 C ATOM 874 CG LEU A 52 -1.710 -8.508 -6.809 1.00 0.00 C ATOM 875 CD1 LEU A 52 -1.509 -7.855 -8.180 1.00 0.00 C ATOM 876 CD2 LEU A 52 -3.191 -8.408 -6.422 1.00 0.00 C ATOM 0 H LEU A 52 -0.139 -8.579 -4.878 1.00 0.00 H new ATOM 0 HA LEU A 52 0.320 -11.234 -6.121 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -1.263 -10.334 -7.898 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -2.012 -10.607 -6.337 1.00 0.00 H new ATOM 0 HG LEU A 52 -1.099 -7.994 -6.066 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -1.813 -6.809 -8.133 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -0.458 -7.915 -8.461 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -2.113 -8.376 -8.923 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -3.488 -7.360 -6.385 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -3.797 -8.931 -7.162 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -3.343 -8.862 -5.443 1.00 0.00 H new ATOM 888 N CYS A 53 1.860 -10.394 -7.891 1.00 0.00 N ATOM 889 CA CYS A 53 2.907 -9.923 -8.796 1.00 0.00 C ATOM 890 C CYS A 53 2.373 -9.779 -10.220 1.00 0.00 C ATOM 891 O CYS A 53 1.201 -10.055 -10.481 1.00 0.00 O ATOM 892 CB CYS A 53 4.081 -10.903 -8.786 1.00 0.00 C ATOM 893 SG CYS A 53 3.451 -12.599 -8.755 1.00 0.00 S ATOM 0 H CYS A 53 1.718 -11.404 -7.897 1.00 0.00 H new ATOM 0 HA CYS A 53 3.243 -8.945 -8.451 1.00 0.00 H new ATOM 0 HB2 CYS A 53 4.703 -10.751 -9.668 1.00 0.00 H new ATOM 0 HB3 CYS A 53 4.712 -10.722 -7.916 1.00 0.00 H new ATOM 0 HG CYS A 53 2.934 -12.849 -7.589 1.00 0.00 H new ATOM 899 N ASN A 54 3.244 -9.342 -11.132 1.00 0.00 N ATOM 900 CA ASN A 54 2.863 -9.158 -12.535 1.00 0.00 C ATOM 901 C ASN A 54 1.792 -10.164 -12.939 1.00 0.00 C ATOM 902 O ASN A 54 0.852 -9.831 -13.663 1.00 0.00 O ATOM 903 CB ASN A 54 4.091 -9.333 -13.434 1.00 0.00 C ATOM 904 CG ASN A 54 3.803 -8.799 -14.836 1.00 0.00 C ATOM 905 OD1 ASN A 54 2.646 -8.715 -15.246 1.00 0.00 O ATOM 906 ND2 ASN A 54 4.798 -8.432 -15.601 1.00 0.00 N ATOM 0 H ASN A 54 4.215 -9.109 -10.926 1.00 0.00 H new ATOM 0 HA ASN A 54 2.462 -8.151 -12.653 1.00 0.00 H new ATOM 0 HB2 ASN A 54 4.943 -8.805 -13.004 1.00 0.00 H new ATOM 0 HB3 ASN A 54 4.363 -10.387 -13.488 1.00 0.00 H new ATOM 0 HD21 ASN A 54 4.616 -8.075 -16.539 1.00 0.00 H new ATOM 0 HD22 ASN A 54 5.757 -8.502 -15.260 1.00 0.00 H new ATOM 913 N GLN A 55 1.939 -11.396 -12.463 1.00 0.00 N ATOM 914 CA GLN A 55 0.978 -12.444 -12.779 1.00 0.00 C ATOM 915 C GLN A 55 -0.256 -12.327 -11.890 1.00 0.00 C ATOM 916 O GLN A 55 -0.160 -11.930 -10.729 1.00 0.00 O ATOM 917 CB GLN A 55 1.626 -13.815 -12.585 1.00 0.00 C ATOM 918 CG GLN A 55 3.059 -13.775 -13.117 1.00 0.00 C ATOM 919 CD GLN A 55 3.049 -13.423 -14.599 1.00 0.00 C ATOM 920 OE1 GLN A 55 3.648 -12.427 -15.008 1.00 0.00 O ATOM 921 NE2 GLN A 55 2.398 -14.186 -15.434 1.00 0.00 N ATOM 0 H GLN A 55 2.708 -11.691 -11.862 1.00 0.00 H new ATOM 0 HA GLN A 55 0.670 -12.331 -13.818 1.00 0.00 H new ATOM 0 HB2 GLN A 55 1.625 -14.085 -11.529 1.00 0.00 H new ATOM 0 HB3 GLN A 55 1.052 -14.579 -13.109 1.00 0.00 H new ATOM 0 HG2 GLN A 55 3.642 -13.039 -12.563 1.00 0.00 H new ATOM 0 HG3 GLN A 55 3.540 -14.742 -12.967 1.00 0.00 H new ATOM 0 HE21 GLN A 55 1.903 -15.010 -15.092 1.00 0.00 H new ATOM 0 HE22 GLN A 55 2.384 -13.958 -16.428 1.00 0.00 H new ATOM 930 N ALA A 56 -1.416 -12.670 -12.446 1.00 0.00 N ATOM 931 CA ALA A 56 -2.671 -12.597 -11.699 1.00 0.00 C ATOM 932 C ALA A 56 -3.355 -13.964 -11.665 1.00 0.00 C ATOM 933 O ALA A 56 -3.132 -14.801 -12.541 1.00 0.00 O ATOM 934 CB ALA A 56 -3.596 -11.569 -12.357 1.00 0.00 C ATOM 0 H ALA A 56 -1.514 -13.000 -13.406 1.00 0.00 H new ATOM 0 HA ALA A 56 -2.456 -12.293 -10.675 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -4.532 -11.513 -11.801 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -3.114 -10.591 -12.354 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -3.801 -11.869 -13.384 1.00 0.00 H new ATOM 940 N PRO A 57 -4.182 -14.202 -10.676 1.00 0.00 N ATOM 941 CA PRO A 57 -4.916 -15.488 -10.528 1.00 0.00 C ATOM 942 C PRO A 57 -5.374 -16.049 -11.870 1.00 0.00 C ATOM 943 O PRO A 57 -5.753 -15.300 -12.771 1.00 0.00 O ATOM 944 CB PRO A 57 -6.111 -15.109 -9.657 1.00 0.00 C ATOM 945 CG PRO A 57 -5.655 -13.949 -8.828 1.00 0.00 C ATOM 946 CD PRO A 57 -4.508 -13.268 -9.586 1.00 0.00 C ATOM 0 HA PRO A 57 -4.294 -16.273 -10.097 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -6.972 -14.839 -10.269 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -6.417 -15.944 -9.027 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -6.474 -13.250 -8.662 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -5.320 -14.286 -7.847 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -4.811 -12.295 -9.974 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -3.648 -13.099 -8.937 1.00 0.00 H new ATOM 954 N HIS A 58 -5.335 -17.373 -11.997 1.00 0.00 N ATOM 955 CA HIS A 58 -5.747 -18.032 -13.234 1.00 0.00 C ATOM 956 C HIS A 58 -7.078 -18.749 -13.045 1.00 0.00 C ATOM 957 O HIS A 58 -7.650 -19.279 -13.998 1.00 0.00 O ATOM 958 CB HIS A 58 -4.684 -19.044 -13.661 1.00 0.00 C ATOM 959 CG HIS A 58 -4.331 -19.920 -12.493 1.00 0.00 C ATOM 960 ND1 HIS A 58 -3.798 -19.408 -11.321 1.00 0.00 N ATOM 961 CD2 HIS A 58 -4.437 -21.274 -12.296 1.00 0.00 C ATOM 962 CE1 HIS A 58 -3.604 -20.440 -10.480 1.00 0.00 C ATOM 963 NE2 HIS A 58 -3.978 -21.601 -11.025 1.00 0.00 N ATOM 0 H HIS A 58 -5.024 -18.008 -11.262 1.00 0.00 H new ATOM 0 HA HIS A 58 -5.863 -17.271 -14.006 1.00 0.00 H new ATOM 0 HB2 HIS A 58 -5.055 -19.652 -14.486 1.00 0.00 H new ATOM 0 HB3 HIS A 58 -3.796 -18.525 -14.022 1.00 0.00 H new ATOM 0 HD2 HIS A 58 -4.819 -21.979 -13.019 1.00 0.00 H new ATOM 0 HE1 HIS A 58 -3.196 -20.342 -9.485 1.00 0.00 H new ATOM 0 HE2 HIS A 58 -3.936 -22.527 -10.600 1.00 0.00 H new ATOM 972 N LYS A 59 -7.567 -18.763 -11.811 1.00 0.00 N ATOM 973 CA LYS A 59 -8.834 -19.419 -11.515 1.00 0.00 C ATOM 974 C LYS A 59 -9.995 -18.454 -11.734 1.00 0.00 C ATOM 975 O LYS A 59 -11.074 -18.629 -11.169 1.00 0.00 O ATOM 976 CB LYS A 59 -8.841 -19.911 -10.067 1.00 0.00 C ATOM 977 CG LYS A 59 -7.830 -21.056 -9.913 1.00 0.00 C ATOM 978 CD LYS A 59 -7.552 -21.334 -8.422 1.00 0.00 C ATOM 979 CE LYS A 59 -8.378 -22.536 -7.949 1.00 0.00 C ATOM 980 NZ LYS A 59 -9.829 -22.210 -8.036 1.00 0.00 N ATOM 0 H LYS A 59 -7.111 -18.332 -11.007 1.00 0.00 H new ATOM 0 HA LYS A 59 -8.950 -20.270 -12.186 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -8.587 -19.094 -9.392 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -9.839 -20.253 -9.792 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -8.216 -21.956 -10.391 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -6.900 -20.799 -10.421 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -6.490 -21.530 -8.272 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -7.801 -20.455 -7.827 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -8.153 -23.409 -8.563 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -8.113 -22.791 -6.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -10.373 -22.896 -7.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -9.993 -21.252 -7.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -10.136 -22.253 -9.029 1.00 0.00 H new ATOM 994 N HIS A 60 -9.763 -17.430 -12.551 1.00 0.00 N ATOM 995 CA HIS A 60 -10.798 -16.442 -12.825 1.00 0.00 C ATOM 996 C HIS A 60 -10.596 -15.806 -14.198 1.00 0.00 C ATOM 997 O HIS A 60 -9.482 -15.772 -14.721 1.00 0.00 O ATOM 998 CB HIS A 60 -10.767 -15.352 -11.749 1.00 0.00 C ATOM 999 CG HIS A 60 -12.144 -14.776 -11.570 1.00 0.00 C ATOM 1000 ND1 HIS A 60 -12.871 -13.884 -12.321 1.00 0.00 N flip ATOM 1001 CD2 HIS A 60 -12.957 -15.122 -10.503 1.00 0.00 C flip ATOM 1002 CE1 HIS A 60 -14.115 -13.680 -11.731 1.00 0.00 C flip ATOM 1003 NE2 HIS A 60 -14.113 -14.449 -10.639 1.00 0.00 N flip ATOM 0 H HIS A 60 -8.877 -17.265 -13.029 1.00 0.00 H new ATOM 0 HA HIS A 60 -11.764 -16.946 -12.815 1.00 0.00 H new ATOM 0 HB2 HIS A 60 -10.411 -15.768 -10.806 1.00 0.00 H new ATOM 0 HB3 HIS A 60 -10.068 -14.566 -12.034 1.00 0.00 H new ATOM 0 HD2 HIS A 60 -12.708 -15.808 -9.707 1.00 0.00 H new ATOM 0 HE1 HIS A 60 -14.910 -13.038 -12.081 1.00 0.00 H new ATOM 0 HE2 HIS A 60 -14.894 -14.517 -9.987 1.00 0.00 H new ATOM 1012 N GLY A 61 -11.681 -15.294 -14.771 1.00 0.00 N ATOM 1013 CA GLY A 61 -11.608 -14.652 -16.076 1.00 0.00 C ATOM 1014 C GLY A 61 -10.566 -13.539 -16.067 1.00 0.00 C ATOM 1015 O GLY A 61 -9.544 -13.642 -15.389 1.00 0.00 O ATOM 0 H GLY A 61 -12.612 -15.311 -14.356 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -11.354 -15.390 -16.837 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -12.583 -14.243 -16.342 1.00 0.00 H new ATOM 1019 N PHE A 62 -10.828 -12.473 -16.819 1.00 0.00 N ATOM 1020 CA PHE A 62 -9.898 -11.350 -16.878 1.00 0.00 C ATOM 1021 C PHE A 62 -10.304 -10.260 -15.891 1.00 0.00 C ATOM 1022 O PHE A 62 -11.431 -9.765 -15.925 1.00 0.00 O ATOM 1023 CB PHE A 62 -9.865 -10.770 -18.292 1.00 0.00 C ATOM 1024 CG PHE A 62 -9.517 -11.857 -19.281 1.00 0.00 C ATOM 1025 CD1 PHE A 62 -10.484 -12.797 -19.661 1.00 0.00 C ATOM 1026 CD2 PHE A 62 -8.225 -11.924 -19.822 1.00 0.00 C ATOM 1027 CE1 PHE A 62 -10.160 -13.803 -20.580 1.00 0.00 C ATOM 1028 CE2 PHE A 62 -7.903 -12.930 -20.741 1.00 0.00 C ATOM 1029 CZ PHE A 62 -8.870 -13.869 -21.119 1.00 0.00 C ATOM 0 H PHE A 62 -11.666 -12.364 -17.390 1.00 0.00 H new ATOM 0 HA PHE A 62 -8.906 -11.715 -16.611 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -10.834 -10.336 -18.540 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -9.132 -9.966 -18.348 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -11.479 -12.746 -19.245 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -7.479 -11.200 -19.530 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -10.905 -14.528 -20.873 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -6.908 -12.982 -21.158 1.00 0.00 H new ATOM 0 HZ PHE A 62 -8.620 -14.645 -21.827 1.00 0.00 H new ATOM 1039 N LEU A 63 -9.374 -9.887 -15.015 1.00 0.00 N ATOM 1040 CA LEU A 63 -9.638 -8.848 -14.022 1.00 0.00 C ATOM 1041 C LEU A 63 -9.111 -7.503 -14.506 1.00 0.00 C ATOM 1042 O LEU A 63 -8.380 -7.433 -15.493 1.00 0.00 O ATOM 1043 CB LEU A 63 -8.962 -9.207 -12.694 1.00 0.00 C ATOM 1044 CG LEU A 63 -9.845 -10.171 -11.893 1.00 0.00 C ATOM 1045 CD1 LEU A 63 -11.132 -9.464 -11.449 1.00 0.00 C ATOM 1046 CD2 LEU A 63 -10.195 -11.381 -12.762 1.00 0.00 C ATOM 0 H LEU A 63 -8.436 -10.286 -14.972 1.00 0.00 H new ATOM 0 HA LEU A 63 -10.716 -8.778 -13.876 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -7.991 -9.665 -12.884 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -8.780 -8.302 -12.114 1.00 0.00 H new ATOM 0 HG LEU A 63 -9.302 -10.501 -11.008 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -11.751 -10.158 -10.881 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -10.880 -8.608 -10.823 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -11.681 -9.123 -12.327 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -10.823 -12.068 -12.194 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -10.732 -11.048 -13.650 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -9.279 -11.891 -13.062 1.00 0.00 H new ATOM 1058 N GLU A 64 -9.476 -6.436 -13.801 1.00 0.00 N ATOM 1059 CA GLU A 64 -9.020 -5.102 -14.172 1.00 0.00 C ATOM 1060 C GLU A 64 -7.665 -4.817 -13.536 1.00 0.00 C ATOM 1061 O GLU A 64 -7.052 -5.702 -12.940 1.00 0.00 O ATOM 1062 CB GLU A 64 -10.037 -4.051 -13.719 1.00 0.00 C ATOM 1063 CG GLU A 64 -10.794 -4.571 -12.506 1.00 0.00 C ATOM 1064 CD GLU A 64 -11.392 -3.406 -11.722 1.00 0.00 C ATOM 1065 OE1 GLU A 64 -12.415 -2.894 -12.147 1.00 0.00 O ATOM 1066 OE2 GLU A 64 -10.817 -3.042 -10.709 1.00 0.00 O ATOM 0 H GLU A 64 -10.079 -6.468 -12.979 1.00 0.00 H new ATOM 0 HA GLU A 64 -8.922 -5.055 -15.257 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -9.528 -3.119 -13.472 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -10.733 -3.829 -14.528 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -11.585 -5.249 -12.825 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -10.122 -5.143 -11.866 1.00 0.00 H new ATOM 1073 N GLY A 65 -7.207 -3.578 -13.660 1.00 0.00 N ATOM 1074 CA GLY A 65 -5.925 -3.191 -13.086 1.00 0.00 C ATOM 1075 C GLY A 65 -6.064 -2.908 -11.594 1.00 0.00 C ATOM 1076 O GLY A 65 -5.779 -1.804 -11.131 1.00 0.00 O ATOM 0 H GLY A 65 -7.699 -2.830 -14.148 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -5.196 -3.986 -13.244 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -5.546 -2.305 -13.595 1.00 0.00 H new ATOM 1080 N ARG A 66 -6.513 -3.912 -10.851 1.00 0.00 N ATOM 1081 CA ARG A 66 -6.699 -3.768 -9.411 1.00 0.00 C ATOM 1082 C ARG A 66 -5.398 -3.360 -8.727 1.00 0.00 C ATOM 1083 O ARG A 66 -4.346 -3.958 -8.952 1.00 0.00 O ATOM 1084 CB ARG A 66 -7.195 -5.090 -8.810 1.00 0.00 C ATOM 1085 CG ARG A 66 -8.726 -5.139 -8.860 1.00 0.00 C ATOM 1086 CD ARG A 66 -9.223 -6.550 -8.510 1.00 0.00 C ATOM 1087 NE ARG A 66 -10.367 -6.899 -9.344 1.00 0.00 N ATOM 1088 CZ ARG A 66 -11.611 -6.638 -8.952 1.00 0.00 C ATOM 1089 NH1 ARG A 66 -11.826 -6.048 -7.807 1.00 0.00 N ATOM 1090 NH2 ARG A 66 -12.618 -6.971 -9.713 1.00 0.00 N ATOM 0 H ARG A 66 -6.755 -4.832 -11.219 1.00 0.00 H new ATOM 0 HA ARG A 66 -7.440 -2.986 -9.245 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -6.777 -5.931 -9.363 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -6.852 -5.183 -7.780 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -9.143 -4.415 -8.161 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -9.074 -4.859 -9.854 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -8.421 -7.274 -8.658 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -9.503 -6.595 -7.458 1.00 0.00 H new ATOM 0 HE ARG A 66 -10.210 -7.352 -10.245 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -11.040 -5.787 -7.212 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -12.780 -5.848 -7.507 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -12.451 -7.431 -10.608 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -13.572 -6.771 -9.413 1.00 0.00 H new ATOM 1104 N HIS A 67 -5.488 -2.343 -7.879 1.00 0.00 N ATOM 1105 CA HIS A 67 -4.336 -1.854 -7.144 1.00 0.00 C ATOM 1106 C HIS A 67 -4.434 -2.301 -5.683 1.00 0.00 C ATOM 1107 O HIS A 67 -5.524 -2.579 -5.183 1.00 0.00 O ATOM 1108 CB HIS A 67 -4.298 -0.327 -7.242 1.00 0.00 C ATOM 1109 CG HIS A 67 -3.957 0.096 -8.645 1.00 0.00 C ATOM 1110 ND1 HIS A 67 -4.225 1.378 -9.106 1.00 0.00 N ATOM 1111 CD2 HIS A 67 -3.393 -0.573 -9.706 1.00 0.00 C ATOM 1112 CE1 HIS A 67 -3.827 1.437 -10.390 1.00 0.00 C ATOM 1113 NE2 HIS A 67 -3.314 0.276 -10.806 1.00 0.00 N ATOM 0 H HIS A 67 -6.354 -1.840 -7.685 1.00 0.00 H new ATOM 0 HA HIS A 67 -3.418 -2.261 -7.567 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -5.264 0.087 -6.954 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -3.560 0.071 -6.545 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -3.062 -1.601 -9.688 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -3.912 2.317 -11.010 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -2.944 0.058 -11.731 1.00 0.00 H new ATOM 1121 N ALA A 68 -3.296 -2.392 -5.008 1.00 0.00 N ATOM 1122 CA ALA A 68 -3.279 -2.828 -3.613 1.00 0.00 C ATOM 1123 C ALA A 68 -4.515 -2.317 -2.861 1.00 0.00 C ATOM 1124 O ALA A 68 -5.112 -3.037 -2.059 1.00 0.00 O ATOM 1125 CB ALA A 68 -2.002 -2.329 -2.938 1.00 0.00 C ATOM 0 H ALA A 68 -2.379 -2.173 -5.397 1.00 0.00 H new ATOM 0 HA ALA A 68 -3.300 -3.917 -3.587 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -1.989 -2.654 -1.898 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -1.134 -2.736 -3.456 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -1.971 -1.240 -2.978 1.00 0.00 H new ATOM 1131 N GLU A 69 -4.899 -1.076 -3.132 1.00 0.00 N ATOM 1132 CA GLU A 69 -6.074 -0.489 -2.482 1.00 0.00 C ATOM 1133 C GLU A 69 -7.289 -1.411 -2.662 1.00 0.00 C ATOM 1134 O GLU A 69 -7.872 -1.899 -1.688 1.00 0.00 O ATOM 1135 CB GLU A 69 -6.371 0.912 -3.076 1.00 0.00 C ATOM 1136 CG GLU A 69 -5.372 1.213 -4.204 1.00 0.00 C ATOM 1137 CD GLU A 69 -3.980 1.432 -3.619 1.00 0.00 C ATOM 1138 OE1 GLU A 69 -3.879 1.547 -2.409 1.00 0.00 O ATOM 1139 OE2 GLU A 69 -3.035 1.483 -4.390 1.00 0.00 O ATOM 0 H GLU A 69 -4.423 -0.458 -3.790 1.00 0.00 H new ATOM 0 HA GLU A 69 -5.870 -0.379 -1.417 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -7.391 0.947 -3.460 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -6.297 1.672 -2.298 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -5.352 0.386 -4.914 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -5.688 2.099 -4.755 1.00 0.00 H new ATOM 1146 N LEU A 70 -7.654 -1.645 -3.920 1.00 0.00 N ATOM 1147 CA LEU A 70 -8.791 -2.504 -4.233 1.00 0.00 C ATOM 1148 C LEU A 70 -8.510 -3.942 -3.809 1.00 0.00 C ATOM 1149 O LEU A 70 -9.435 -4.721 -3.575 1.00 0.00 O ATOM 1150 CB LEU A 70 -9.110 -2.459 -5.730 1.00 0.00 C ATOM 1151 CG LEU A 70 -9.119 -1.002 -6.224 1.00 0.00 C ATOM 1152 CD1 LEU A 70 -9.872 -0.115 -5.219 1.00 0.00 C ATOM 1153 CD2 LEU A 70 -7.679 -0.482 -6.398 1.00 0.00 C ATOM 0 H LEU A 70 -7.181 -1.254 -4.735 1.00 0.00 H new ATOM 0 HA LEU A 70 -9.653 -2.133 -3.679 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -8.370 -3.035 -6.285 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -10.079 -2.921 -5.917 1.00 0.00 H new ATOM 0 HG LEU A 70 -9.624 -0.965 -7.189 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -9.875 0.916 -5.574 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -10.899 -0.468 -5.120 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -9.377 -0.163 -4.249 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -7.705 0.550 -6.748 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -7.157 -0.528 -5.442 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -7.155 -1.100 -7.127 1.00 0.00 H new ATOM 1165 N CYS A 71 -7.230 -4.289 -3.721 1.00 0.00 N ATOM 1166 CA CYS A 71 -6.843 -5.646 -3.332 1.00 0.00 C ATOM 1167 C CYS A 71 -7.447 -6.035 -1.976 1.00 0.00 C ATOM 1168 O CYS A 71 -8.155 -7.045 -1.868 1.00 0.00 O ATOM 1169 CB CYS A 71 -5.315 -5.782 -3.286 1.00 0.00 C ATOM 1170 SG CYS A 71 -4.875 -7.530 -3.123 1.00 0.00 S ATOM 0 H CYS A 71 -6.450 -3.660 -3.911 1.00 0.00 H new ATOM 0 HA CYS A 71 -7.236 -6.327 -4.087 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -4.874 -5.367 -4.192 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -4.913 -5.214 -2.447 1.00 0.00 H new ATOM 0 HG CYS A 71 -3.581 -7.650 -3.086 1.00 0.00 H new ATOM 1176 N PHE A 72 -7.200 -5.245 -0.932 1.00 0.00 N ATOM 1177 CA PHE A 72 -7.782 -5.599 0.355 1.00 0.00 C ATOM 1178 C PHE A 72 -9.284 -5.430 0.268 1.00 0.00 C ATOM 1179 O PHE A 72 -10.048 -6.257 0.753 1.00 0.00 O ATOM 1180 CB PHE A 72 -7.188 -4.799 1.526 1.00 0.00 C ATOM 1181 CG PHE A 72 -7.255 -3.306 1.306 1.00 0.00 C ATOM 1182 CD1 PHE A 72 -8.488 -2.633 1.307 1.00 0.00 C ATOM 1183 CD2 PHE A 72 -6.067 -2.579 1.143 1.00 0.00 C ATOM 1184 CE1 PHE A 72 -8.523 -1.253 1.135 1.00 0.00 C ATOM 1185 CE2 PHE A 72 -6.111 -1.199 0.983 1.00 0.00 C ATOM 1186 CZ PHE A 72 -7.336 -0.540 0.977 1.00 0.00 C ATOM 0 H PHE A 72 -6.631 -4.399 -0.948 1.00 0.00 H new ATOM 0 HA PHE A 72 -7.537 -6.639 0.569 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -7.723 -5.051 2.441 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -6.149 -5.094 1.672 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -9.406 -3.185 1.441 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -5.117 -3.092 1.142 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -9.470 -0.734 1.124 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -5.195 -0.639 0.863 1.00 0.00 H new ATOM 0 HZ PHE A 72 -7.367 0.532 0.849 1.00 0.00 H new ATOM 1196 N LEU A 73 -9.712 -4.385 -0.405 1.00 0.00 N ATOM 1197 CA LEU A 73 -11.127 -4.166 -0.592 1.00 0.00 C ATOM 1198 C LEU A 73 -11.789 -5.490 -0.956 1.00 0.00 C ATOM 1199 O LEU A 73 -12.992 -5.678 -0.778 1.00 0.00 O ATOM 1200 CB LEU A 73 -11.278 -3.162 -1.718 1.00 0.00 C ATOM 1201 CG LEU A 73 -12.504 -2.276 -1.500 1.00 0.00 C ATOM 1202 CD1 LEU A 73 -12.312 -1.413 -0.239 1.00 0.00 C ATOM 1203 CD2 LEU A 73 -12.671 -1.377 -2.727 1.00 0.00 C ATOM 0 H LEU A 73 -9.107 -3.681 -0.828 1.00 0.00 H new ATOM 0 HA LEU A 73 -11.601 -3.786 0.313 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -10.383 -2.542 -1.780 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -11.369 -3.687 -2.669 1.00 0.00 H new ATOM 0 HG LEU A 73 -13.392 -2.893 -1.364 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -13.190 -0.785 -0.091 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -12.179 -2.060 0.628 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -11.431 -0.783 -0.360 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -13.542 -0.735 -2.592 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -11.781 -0.760 -2.850 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -12.809 -1.995 -3.614 1.00 0.00 H new ATOM 1215 N ASP A 74 -10.967 -6.399 -1.468 1.00 0.00 N ATOM 1216 CA ASP A 74 -11.438 -7.719 -1.867 1.00 0.00 C ATOM 1217 C ASP A 74 -11.264 -8.734 -0.739 1.00 0.00 C ATOM 1218 O ASP A 74 -11.984 -9.730 -0.693 1.00 0.00 O ATOM 1219 CB ASP A 74 -10.671 -8.193 -3.104 1.00 0.00 C ATOM 1220 CG ASP A 74 -11.398 -9.367 -3.751 1.00 0.00 C ATOM 1221 OD1 ASP A 74 -12.309 -9.121 -4.525 1.00 0.00 O ATOM 1222 OD2 ASP A 74 -11.032 -10.495 -3.466 1.00 0.00 O ATOM 0 H ASP A 74 -9.970 -6.245 -1.617 1.00 0.00 H new ATOM 0 HA ASP A 74 -12.500 -7.642 -2.098 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -10.576 -7.375 -3.818 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -9.661 -8.490 -2.824 1.00 0.00 H new ATOM 1227 N VAL A 75 -10.308 -8.503 0.166 1.00 0.00 N ATOM 1228 CA VAL A 75 -10.102 -9.451 1.253 1.00 0.00 C ATOM 1229 C VAL A 75 -11.133 -9.288 2.380 1.00 0.00 C ATOM 1230 O VAL A 75 -11.716 -10.258 2.840 1.00 0.00 O ATOM 1231 CB VAL A 75 -8.698 -9.339 1.840 1.00 0.00 C ATOM 1232 CG1 VAL A 75 -8.603 -8.163 2.811 1.00 0.00 C ATOM 1233 CG2 VAL A 75 -8.429 -10.630 2.591 1.00 0.00 C ATOM 0 H VAL A 75 -9.686 -7.695 0.167 1.00 0.00 H new ATOM 0 HA VAL A 75 -10.230 -10.439 0.810 1.00 0.00 H new ATOM 0 HB VAL A 75 -7.972 -9.174 1.044 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -7.592 -8.106 3.215 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -8.837 -7.237 2.285 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -9.312 -8.306 3.626 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -7.432 -10.595 3.030 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -9.169 -10.752 3.382 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -8.493 -11.472 1.902 1.00 0.00 H new ATOM 1243 N ILE A 76 -11.349 -8.068 2.844 1.00 0.00 N ATOM 1244 CA ILE A 76 -12.317 -7.858 3.929 1.00 0.00 C ATOM 1245 C ILE A 76 -13.532 -8.782 3.743 1.00 0.00 C ATOM 1246 O ILE A 76 -13.898 -9.504 4.671 1.00 0.00 O ATOM 1247 CB ILE A 76 -12.779 -6.387 4.028 1.00 0.00 C ATOM 1248 CG1 ILE A 76 -11.727 -5.464 3.413 1.00 0.00 C ATOM 1249 CG2 ILE A 76 -12.987 -5.999 5.492 1.00 0.00 C ATOM 1250 CD1 ILE A 76 -10.444 -5.510 4.248 1.00 0.00 C ATOM 0 H ILE A 76 -10.887 -7.225 2.504 1.00 0.00 H new ATOM 0 HA ILE A 76 -11.812 -8.103 4.863 1.00 0.00 H new ATOM 0 HB ILE A 76 -13.719 -6.283 3.486 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -11.516 -5.770 2.388 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -12.107 -4.443 3.369 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -13.312 -4.960 5.550 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -13.747 -6.643 5.935 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -12.050 -6.117 6.036 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -9.698 -4.850 3.805 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -10.660 -5.183 5.265 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -10.060 -6.530 4.269 1.00 0.00 H new ATOM 1262 N PRO A 77 -14.151 -8.807 2.575 1.00 0.00 N ATOM 1263 CA PRO A 77 -15.317 -9.705 2.317 1.00 0.00 C ATOM 1264 C PRO A 77 -14.882 -11.161 2.172 1.00 0.00 C ATOM 1265 O PRO A 77 -15.704 -12.075 2.222 1.00 0.00 O ATOM 1266 CB PRO A 77 -15.887 -9.170 1.003 1.00 0.00 C ATOM 1267 CG PRO A 77 -14.724 -8.592 0.293 1.00 0.00 C ATOM 1268 CD PRO A 77 -13.837 -7.998 1.375 1.00 0.00 C ATOM 0 HA PRO A 77 -16.040 -9.702 3.133 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -16.351 -9.966 0.420 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -16.655 -8.417 1.182 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -14.192 -9.356 -0.274 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -15.039 -7.828 -0.418 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -12.782 -8.068 1.110 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -14.055 -6.942 1.536 1.00 0.00 H new ATOM 1276 N PHE A 78 -13.580 -11.360 1.987 1.00 0.00 N ATOM 1277 CA PHE A 78 -13.025 -12.710 1.829 1.00 0.00 C ATOM 1278 C PHE A 78 -13.146 -13.516 3.122 1.00 0.00 C ATOM 1279 O PHE A 78 -13.495 -14.695 3.085 1.00 0.00 O ATOM 1280 CB PHE A 78 -11.554 -12.637 1.400 1.00 0.00 C ATOM 1281 CG PHE A 78 -10.949 -14.010 1.344 1.00 0.00 C ATOM 1282 CD1 PHE A 78 -11.427 -14.941 0.427 1.00 0.00 C ATOM 1283 CD2 PHE A 78 -9.904 -14.343 2.212 1.00 0.00 C ATOM 1284 CE1 PHE A 78 -10.864 -16.222 0.371 1.00 0.00 C ATOM 1285 CE2 PHE A 78 -9.336 -15.622 2.161 1.00 0.00 C ATOM 1286 CZ PHE A 78 -9.817 -16.563 1.240 1.00 0.00 C ATOM 0 H PHE A 78 -12.889 -10.611 1.942 1.00 0.00 H new ATOM 0 HA PHE A 78 -13.602 -13.215 1.054 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -11.478 -12.161 0.423 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -10.996 -12.016 2.101 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -12.232 -14.676 -0.242 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -9.536 -13.615 2.920 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -11.235 -16.946 -0.340 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -8.529 -15.883 2.830 1.00 0.00 H new ATOM 0 HZ PHE A 78 -9.381 -17.550 1.200 1.00 0.00 H new ATOM 1296 N TRP A 79 -12.863 -12.891 4.269 1.00 0.00 N ATOM 1297 CA TRP A 79 -12.966 -13.609 5.533 1.00 0.00 C ATOM 1298 C TRP A 79 -14.436 -13.898 5.849 1.00 0.00 C ATOM 1299 O TRP A 79 -14.757 -14.850 6.559 1.00 0.00 O ATOM 1300 CB TRP A 79 -12.374 -12.794 6.691 1.00 0.00 C ATOM 1301 CG TRP A 79 -11.203 -11.956 6.268 1.00 0.00 C ATOM 1302 CD1 TRP A 79 -10.119 -12.374 5.575 1.00 0.00 C ATOM 1303 CD2 TRP A 79 -10.984 -10.549 6.552 1.00 0.00 C ATOM 1304 NE1 TRP A 79 -9.247 -11.300 5.422 1.00 0.00 N ATOM 1305 CE2 TRP A 79 -9.744 -10.149 6.009 1.00 0.00 C ATOM 1306 CE3 TRP A 79 -11.751 -9.595 7.226 1.00 0.00 C ATOM 1307 CZ2 TRP A 79 -9.283 -8.828 6.142 1.00 0.00 C ATOM 1308 CZ3 TRP A 79 -11.298 -8.279 7.361 1.00 0.00 C ATOM 1309 CH2 TRP A 79 -10.067 -7.895 6.823 1.00 0.00 C ATOM 0 H TRP A 79 -12.569 -11.917 4.345 1.00 0.00 H new ATOM 0 HA TRP A 79 -12.406 -14.538 5.429 1.00 0.00 H new ATOM 0 HB2 TRP A 79 -13.147 -12.148 7.108 1.00 0.00 H new ATOM 0 HB3 TRP A 79 -12.063 -13.472 7.486 1.00 0.00 H new ATOM 0 HD1 TRP A 79 -9.957 -13.375 5.202 1.00 0.00 H new ATOM 0 HE1 TRP A 79 -8.351 -11.354 4.937 1.00 0.00 H new ATOM 0 HE3 TRP A 79 -12.704 -9.877 7.647 1.00 0.00 H new ATOM 0 HZ2 TRP A 79 -8.332 -8.538 5.721 1.00 0.00 H new ATOM 0 HZ3 TRP A 79 -11.904 -7.554 7.885 1.00 0.00 H new ATOM 0 HH2 TRP A 79 -9.722 -6.877 6.934 1.00 0.00 H new ATOM 1320 N LYS A 80 -15.318 -13.060 5.310 1.00 0.00 N ATOM 1321 CA LYS A 80 -16.753 -13.200 5.519 1.00 0.00 C ATOM 1322 C LYS A 80 -17.093 -13.319 7.012 1.00 0.00 C ATOM 1323 O LYS A 80 -17.657 -14.319 7.457 1.00 0.00 O ATOM 1324 CB LYS A 80 -17.306 -14.401 4.731 1.00 0.00 C ATOM 1325 CG LYS A 80 -16.258 -14.922 3.750 1.00 0.00 C ATOM 1326 CD LYS A 80 -16.942 -15.783 2.684 1.00 0.00 C ATOM 1327 CE LYS A 80 -15.944 -16.799 2.125 1.00 0.00 C ATOM 1328 NZ LYS A 80 -16.452 -17.334 0.830 1.00 0.00 N ATOM 0 H LYS A 80 -15.058 -12.270 4.720 1.00 0.00 H new ATOM 0 HA LYS A 80 -17.233 -12.296 5.143 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -17.595 -15.195 5.420 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -18.205 -14.106 4.190 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -15.737 -14.088 3.280 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -15.507 -15.508 4.280 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -17.799 -16.300 3.115 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -17.321 -15.151 1.881 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -14.972 -16.328 1.980 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -15.801 -17.613 2.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -15.774 -18.025 0.450 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -17.370 -17.798 0.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -16.567 -16.553 0.153 1.00 0.00 H new ATOM 1342 N LEU A 81 -16.749 -12.289 7.783 1.00 0.00 N ATOM 1343 CA LEU A 81 -17.029 -12.296 9.214 1.00 0.00 C ATOM 1344 C LEU A 81 -18.500 -12.088 9.497 1.00 0.00 C ATOM 1345 O LEU A 81 -19.381 -12.443 8.713 1.00 0.00 O ATOM 1346 CB LEU A 81 -16.284 -11.172 9.918 1.00 0.00 C ATOM 1347 CG LEU A 81 -14.976 -10.891 9.198 1.00 0.00 C ATOM 1348 CD1 LEU A 81 -15.220 -9.984 7.973 1.00 0.00 C ATOM 1349 CD2 LEU A 81 -14.025 -10.223 10.191 1.00 0.00 C ATOM 0 H LEU A 81 -16.281 -11.448 7.444 1.00 0.00 H new ATOM 0 HA LEU A 81 -16.707 -13.271 9.581 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -16.899 -10.272 9.938 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -16.087 -11.447 10.954 1.00 0.00 H new ATOM 0 HG LEU A 81 -14.537 -11.820 8.833 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -14.273 -9.792 7.468 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -15.905 -10.479 7.284 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -15.655 -9.040 8.300 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -13.076 -10.010 9.699 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -14.466 -9.292 10.547 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -13.854 -10.890 11.036 1.00 0.00 H new ATOM 1361 N ASP A 82 -18.718 -11.437 10.626 1.00 0.00 N ATOM 1362 CA ASP A 82 -20.038 -11.065 11.072 1.00 0.00 C ATOM 1363 C ASP A 82 -20.114 -9.547 11.055 1.00 0.00 C ATOM 1364 O ASP A 82 -19.287 -8.882 10.431 1.00 0.00 O ATOM 1365 CB ASP A 82 -20.291 -11.587 12.490 1.00 0.00 C ATOM 1366 CG ASP A 82 -20.816 -13.017 12.433 1.00 0.00 C ATOM 1367 OD1 ASP A 82 -20.071 -13.885 12.008 1.00 0.00 O ATOM 1368 OD2 ASP A 82 -21.956 -13.224 12.816 1.00 0.00 O ATOM 0 H ASP A 82 -17.973 -11.152 11.261 1.00 0.00 H new ATOM 0 HA ASP A 82 -20.795 -11.497 10.418 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -19.368 -11.552 13.069 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -21.011 -10.946 12.999 1.00 0.00 H new ATOM 1373 N LEU A 83 -21.094 -9.006 11.738 1.00 0.00 N ATOM 1374 CA LEU A 83 -21.267 -7.567 11.802 1.00 0.00 C ATOM 1375 C LEU A 83 -20.551 -6.988 13.025 1.00 0.00 C ATOM 1376 O LEU A 83 -19.802 -6.017 12.922 1.00 0.00 O ATOM 1377 CB LEU A 83 -22.762 -7.256 11.876 1.00 0.00 C ATOM 1378 CG LEU A 83 -23.065 -5.888 11.270 1.00 0.00 C ATOM 1379 CD1 LEU A 83 -22.171 -4.836 11.916 1.00 0.00 C ATOM 1380 CD2 LEU A 83 -22.817 -5.921 9.757 1.00 0.00 C ATOM 0 H LEU A 83 -21.789 -9.539 12.261 1.00 0.00 H new ATOM 0 HA LEU A 83 -20.833 -7.112 10.911 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -23.324 -8.025 11.346 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -23.091 -7.279 12.915 1.00 0.00 H new ATOM 0 HG LEU A 83 -24.110 -5.637 11.453 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -22.387 -3.859 11.483 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -22.360 -4.807 12.989 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -21.126 -5.088 11.738 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -23.035 -4.942 9.331 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -21.775 -6.176 9.565 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -23.464 -6.668 9.298 1.00 0.00 H new ATOM 1392 N ASP A 84 -20.803 -7.588 14.183 1.00 0.00 N ATOM 1393 CA ASP A 84 -20.201 -7.127 15.433 1.00 0.00 C ATOM 1394 C ASP A 84 -18.676 -7.115 15.351 1.00 0.00 C ATOM 1395 O ASP A 84 -18.003 -6.638 16.265 1.00 0.00 O ATOM 1396 CB ASP A 84 -20.640 -8.032 16.584 1.00 0.00 C ATOM 1397 CG ASP A 84 -20.285 -7.387 17.919 1.00 0.00 C ATOM 1398 OD1 ASP A 84 -19.879 -6.235 17.908 1.00 0.00 O ATOM 1399 OD2 ASP A 84 -20.424 -8.051 18.933 1.00 0.00 O ATOM 0 H ASP A 84 -21.419 -8.394 14.284 1.00 0.00 H new ATOM 0 HA ASP A 84 -20.541 -6.107 15.610 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -21.714 -8.208 16.530 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -20.153 -9.004 16.499 1.00 0.00 H new ATOM 1404 N GLN A 85 -18.137 -7.647 14.264 1.00 0.00 N ATOM 1405 CA GLN A 85 -16.689 -7.698 14.089 1.00 0.00 C ATOM 1406 C GLN A 85 -16.185 -6.428 13.388 1.00 0.00 C ATOM 1407 O GLN A 85 -16.983 -5.594 12.961 1.00 0.00 O ATOM 1408 CB GLN A 85 -16.317 -8.939 13.266 1.00 0.00 C ATOM 1409 CG GLN A 85 -17.447 -9.963 13.344 1.00 0.00 C ATOM 1410 CD GLN A 85 -17.762 -10.286 14.801 1.00 0.00 C ATOM 1411 OE1 GLN A 85 -16.861 -10.319 15.640 1.00 0.00 O ATOM 1412 NE2 GLN A 85 -18.995 -10.530 15.155 1.00 0.00 N ATOM 0 H GLN A 85 -18.673 -8.047 13.494 1.00 0.00 H new ATOM 0 HA GLN A 85 -16.216 -7.758 15.069 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -16.137 -8.659 12.228 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -15.392 -9.374 13.643 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -18.337 -9.573 12.849 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -17.161 -10.872 12.815 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -19.740 -10.502 14.459 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -19.213 -10.748 16.127 1.00 0.00 H new ATOM 1421 N ASP A 86 -14.859 -6.277 13.279 1.00 0.00 N ATOM 1422 CA ASP A 86 -14.290 -5.090 12.634 1.00 0.00 C ATOM 1423 C ASP A 86 -12.994 -5.432 11.882 1.00 0.00 C ATOM 1424 O ASP A 86 -12.508 -6.559 11.954 1.00 0.00 O ATOM 1425 CB ASP A 86 -14.010 -4.013 13.696 1.00 0.00 C ATOM 1426 CG ASP A 86 -15.184 -3.040 13.788 1.00 0.00 C ATOM 1427 OD1 ASP A 86 -15.181 -2.068 13.052 1.00 0.00 O ATOM 1428 OD2 ASP A 86 -16.067 -3.284 14.593 1.00 0.00 O ATOM 0 H ASP A 86 -14.172 -6.949 13.622 1.00 0.00 H new ATOM 0 HA ASP A 86 -15.011 -4.714 11.908 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -13.842 -4.483 14.665 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -13.099 -3.471 13.442 1.00 0.00 H new ATOM 1433 N TYR A 87 -12.438 -4.447 11.167 1.00 0.00 N ATOM 1434 CA TYR A 87 -11.196 -4.659 10.416 1.00 0.00 C ATOM 1435 C TYR A 87 -10.215 -3.505 10.625 1.00 0.00 C ATOM 1436 O TYR A 87 -10.606 -2.370 10.894 1.00 0.00 O ATOM 1437 CB TYR A 87 -11.479 -4.787 8.905 1.00 0.00 C ATOM 1438 CG TYR A 87 -12.941 -5.040 8.667 1.00 0.00 C ATOM 1439 CD1 TYR A 87 -13.553 -6.176 9.191 1.00 0.00 C ATOM 1440 CD2 TYR A 87 -13.679 -4.134 7.908 1.00 0.00 C ATOM 1441 CE1 TYR A 87 -14.912 -6.410 8.956 1.00 0.00 C ATOM 1442 CE2 TYR A 87 -15.038 -4.362 7.669 1.00 0.00 C ATOM 1443 CZ TYR A 87 -15.656 -5.504 8.193 1.00 0.00 C ATOM 1444 OH TYR A 87 -16.997 -5.733 7.959 1.00 0.00 O ATOM 0 H TYR A 87 -12.823 -3.506 11.093 1.00 0.00 H new ATOM 0 HA TYR A 87 -10.756 -5.583 10.791 1.00 0.00 H new ATOM 0 HB2 TYR A 87 -11.173 -3.875 8.392 1.00 0.00 H new ATOM 0 HB3 TYR A 87 -10.889 -5.602 8.486 1.00 0.00 H new ATOM 0 HD1 TYR A 87 -12.978 -6.876 9.779 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -13.201 -3.254 7.504 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -15.387 -7.290 9.364 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -15.610 -3.659 7.082 1.00 0.00 H new ATOM 0 HH TYR A 87 -17.516 -4.949 8.235 1.00 0.00 H new ATOM 1454 N ARG A 88 -8.941 -3.817 10.443 1.00 0.00 N ATOM 1455 CA ARG A 88 -7.876 -2.833 10.550 1.00 0.00 C ATOM 1456 C ARG A 88 -6.861 -3.141 9.460 1.00 0.00 C ATOM 1457 O ARG A 88 -5.934 -3.925 9.659 1.00 0.00 O ATOM 1458 CB ARG A 88 -7.213 -2.900 11.928 1.00 0.00 C ATOM 1459 CG ARG A 88 -8.073 -2.145 12.943 1.00 0.00 C ATOM 1460 CD ARG A 88 -7.689 -2.574 14.359 1.00 0.00 C ATOM 1461 NE ARG A 88 -6.248 -2.450 14.550 1.00 0.00 N ATOM 1462 CZ ARG A 88 -5.601 -3.225 15.415 1.00 0.00 C ATOM 1463 NH1 ARG A 88 -6.255 -4.110 16.115 1.00 0.00 N ATOM 1464 NH2 ARG A 88 -4.310 -3.098 15.565 1.00 0.00 N ATOM 0 H ARG A 88 -8.617 -4.758 10.217 1.00 0.00 H new ATOM 0 HA ARG A 88 -8.277 -1.827 10.430 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -7.094 -3.939 12.237 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -6.215 -2.464 11.885 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -7.932 -1.070 12.827 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -9.129 -2.349 12.764 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -8.214 -1.958 15.089 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -7.999 -3.605 14.531 1.00 0.00 H new ATOM 0 HE ARG A 88 -5.728 -1.757 14.011 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -7.264 -4.208 15.999 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -5.758 -4.704 16.778 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -3.799 -2.405 15.019 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -3.813 -3.692 16.228 1.00 0.00 H new ATOM 1478 N VAL A 89 -7.081 -2.560 8.288 1.00 0.00 N ATOM 1479 CA VAL A 89 -6.220 -2.823 7.142 1.00 0.00 C ATOM 1480 C VAL A 89 -4.962 -1.947 7.141 1.00 0.00 C ATOM 1481 O VAL A 89 -4.957 -0.826 7.645 1.00 0.00 O ATOM 1482 CB VAL A 89 -7.029 -2.619 5.852 1.00 0.00 C ATOM 1483 CG1 VAL A 89 -6.556 -3.596 4.771 1.00 0.00 C ATOM 1484 CG2 VAL A 89 -8.514 -2.874 6.140 1.00 0.00 C ATOM 0 H VAL A 89 -7.843 -1.907 8.106 1.00 0.00 H new ATOM 0 HA VAL A 89 -5.874 -3.855 7.205 1.00 0.00 H new ATOM 0 HB VAL A 89 -6.884 -1.597 5.501 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -7.137 -3.442 3.862 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -5.500 -3.423 4.561 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -6.694 -4.619 5.120 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -9.092 -2.730 5.227 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -8.645 -3.896 6.495 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -8.862 -2.177 6.903 1.00 0.00 H new ATOM 1494 N THR A 90 -3.889 -2.490 6.571 1.00 0.00 N ATOM 1495 CA THR A 90 -2.613 -1.784 6.488 1.00 0.00 C ATOM 1496 C THR A 90 -1.941 -2.116 5.155 1.00 0.00 C ATOM 1497 O THR A 90 -1.555 -3.258 4.918 1.00 0.00 O ATOM 1498 CB THR A 90 -1.721 -2.191 7.677 1.00 0.00 C ATOM 1499 OG1 THR A 90 -2.074 -1.408 8.809 1.00 0.00 O ATOM 1500 CG2 THR A 90 -0.240 -1.967 7.354 1.00 0.00 C ATOM 0 H THR A 90 -3.878 -3.422 6.157 1.00 0.00 H new ATOM 0 HA THR A 90 -2.774 -0.707 6.536 1.00 0.00 H new ATOM 0 HB THR A 90 -1.875 -3.251 7.882 1.00 0.00 H new ATOM 0 HG1 THR A 90 -2.965 -1.022 8.675 1.00 0.00 H new ATOM 0 HG21 THR A 90 0.368 -2.262 8.209 1.00 0.00 H new ATOM 0 HG22 THR A 90 0.038 -2.567 6.487 1.00 0.00 H new ATOM 0 HG23 THR A 90 -0.071 -0.913 7.135 1.00 0.00 H new ATOM 1508 N CYS A 91 -1.817 -1.126 4.275 1.00 0.00 N ATOM 1509 CA CYS A 91 -1.208 -1.361 2.965 1.00 0.00 C ATOM 1510 C CYS A 91 0.200 -0.779 2.888 1.00 0.00 C ATOM 1511 O CYS A 91 0.405 0.414 3.108 1.00 0.00 O ATOM 1512 CB CYS A 91 -2.075 -0.731 1.871 1.00 0.00 C ATOM 1513 SG CYS A 91 -1.303 -1.008 0.257 1.00 0.00 S ATOM 0 H CYS A 91 -2.124 -0.167 4.439 1.00 0.00 H new ATOM 0 HA CYS A 91 -1.141 -2.439 2.818 1.00 0.00 H new ATOM 0 HB2 CYS A 91 -3.074 -1.166 1.888 1.00 0.00 H new ATOM 0 HB3 CYS A 91 -2.190 0.338 2.053 1.00 0.00 H new ATOM 0 HG CYS A 91 -2.039 -0.475 -0.673 1.00 0.00 H new ATOM 1519 N PHE A 92 1.168 -1.631 2.547 1.00 0.00 N ATOM 1520 CA PHE A 92 2.553 -1.190 2.411 1.00 0.00 C ATOM 1521 C PHE A 92 2.955 -1.193 0.942 1.00 0.00 C ATOM 1522 O PHE A 92 3.287 -2.240 0.384 1.00 0.00 O ATOM 1523 CB PHE A 92 3.498 -2.125 3.171 1.00 0.00 C ATOM 1524 CG PHE A 92 3.279 -2.020 4.662 1.00 0.00 C ATOM 1525 CD1 PHE A 92 3.630 -0.851 5.348 1.00 0.00 C ATOM 1526 CD2 PHE A 92 2.746 -3.107 5.364 1.00 0.00 C ATOM 1527 CE1 PHE A 92 3.443 -0.770 6.734 1.00 0.00 C ATOM 1528 CE2 PHE A 92 2.563 -3.029 6.750 1.00 0.00 C ATOM 1529 CZ PHE A 92 2.911 -1.859 7.435 1.00 0.00 C ATOM 0 H PHE A 92 1.018 -2.623 2.362 1.00 0.00 H new ATOM 0 HA PHE A 92 2.627 -0.184 2.824 1.00 0.00 H new ATOM 0 HB2 PHE A 92 3.336 -3.153 2.847 1.00 0.00 H new ATOM 0 HB3 PHE A 92 4.532 -1.875 2.933 1.00 0.00 H new ATOM 0 HD1 PHE A 92 4.045 -0.012 4.809 1.00 0.00 H new ATOM 0 HD2 PHE A 92 2.475 -4.009 4.835 1.00 0.00 H new ATOM 0 HE1 PHE A 92 3.709 0.133 7.262 1.00 0.00 H new ATOM 0 HE2 PHE A 92 2.154 -3.870 7.290 1.00 0.00 H new ATOM 0 HZ PHE A 92 2.769 -1.796 8.504 1.00 0.00 H new ATOM 1539 N THR A 93 2.936 -0.022 0.323 1.00 0.00 N ATOM 1540 CA THR A 93 3.315 0.090 -1.080 1.00 0.00 C ATOM 1541 C THR A 93 3.882 1.468 -1.354 1.00 0.00 C ATOM 1542 O THR A 93 3.173 2.464 -1.255 1.00 0.00 O ATOM 1543 CB THR A 93 2.109 -0.138 -1.986 1.00 0.00 C ATOM 1544 OG1 THR A 93 1.361 -1.250 -1.515 1.00 0.00 O ATOM 1545 CG2 THR A 93 2.583 -0.402 -3.419 1.00 0.00 C ATOM 0 H THR A 93 2.665 0.857 0.764 1.00 0.00 H new ATOM 0 HA THR A 93 4.068 -0.670 -1.289 1.00 0.00 H new ATOM 0 HB THR A 93 1.477 0.750 -1.975 1.00 0.00 H new ATOM 0 HG1 THR A 93 0.593 -0.932 -0.997 1.00 0.00 H new ATOM 0 HG21 THR A 93 1.719 -0.565 -4.064 1.00 0.00 H new ATOM 0 HG22 THR A 93 3.148 0.457 -3.779 1.00 0.00 H new ATOM 0 HG23 THR A 93 3.219 -1.287 -3.435 1.00 0.00 H new ATOM 1553 N SER A 94 5.155 1.516 -1.710 1.00 0.00 N ATOM 1554 CA SER A 94 5.807 2.786 -2.005 1.00 0.00 C ATOM 1555 C SER A 94 4.932 3.642 -2.921 1.00 0.00 C ATOM 1556 O SER A 94 5.241 4.805 -3.179 1.00 0.00 O ATOM 1557 CB SER A 94 7.158 2.537 -2.677 1.00 0.00 C ATOM 1558 OG SER A 94 7.825 1.472 -2.012 1.00 0.00 O ATOM 0 H SER A 94 5.756 0.697 -1.802 1.00 0.00 H new ATOM 0 HA SER A 94 5.960 3.318 -1.066 1.00 0.00 H new ATOM 0 HB2 SER A 94 7.014 2.290 -3.729 1.00 0.00 H new ATOM 0 HB3 SER A 94 7.767 3.441 -2.642 1.00 0.00 H new ATOM 0 HG SER A 94 8.691 1.309 -2.442 1.00 0.00 H new ATOM 1564 N TRP A 95 3.849 3.050 -3.420 1.00 0.00 N ATOM 1565 CA TRP A 95 2.939 3.747 -4.321 1.00 0.00 C ATOM 1566 C TRP A 95 1.604 4.063 -3.638 1.00 0.00 C ATOM 1567 O TRP A 95 1.080 3.261 -2.865 1.00 0.00 O ATOM 1568 CB TRP A 95 2.687 2.853 -5.538 1.00 0.00 C ATOM 1569 CG TRP A 95 2.444 3.677 -6.760 1.00 0.00 C ATOM 1570 CD1 TRP A 95 3.345 4.506 -7.337 1.00 0.00 C ATOM 1571 CD2 TRP A 95 1.240 3.750 -7.573 1.00 0.00 C ATOM 1572 NE1 TRP A 95 2.771 5.071 -8.461 1.00 0.00 N ATOM 1573 CE2 TRP A 95 1.476 4.638 -8.645 1.00 0.00 C ATOM 1574 CE3 TRP A 95 -0.020 3.137 -7.488 1.00 0.00 C ATOM 1575 CZ2 TRP A 95 0.501 4.904 -9.598 1.00 0.00 C ATOM 1576 CZ3 TRP A 95 -1.008 3.406 -8.450 1.00 0.00 C ATOM 1577 CH2 TRP A 95 -0.743 4.289 -9.505 1.00 0.00 C ATOM 0 H TRP A 95 3.581 2.087 -3.214 1.00 0.00 H new ATOM 0 HA TRP A 95 3.394 4.692 -4.618 1.00 0.00 H new ATOM 0 HB2 TRP A 95 3.545 2.200 -5.699 1.00 0.00 H new ATOM 0 HB3 TRP A 95 1.827 2.210 -5.351 1.00 0.00 H new ATOM 0 HD1 TRP A 95 4.346 4.695 -6.979 1.00 0.00 H new ATOM 0 HE1 TRP A 95 3.248 5.728 -9.078 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -0.231 2.454 -6.678 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 0.708 5.586 -10.409 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -1.975 2.931 -8.376 1.00 0.00 H new ATOM 0 HH2 TRP A 95 -1.503 4.492 -10.245 1.00 0.00 H new ATOM 1588 N SER A 96 1.056 5.233 -3.954 1.00 0.00 N ATOM 1589 CA SER A 96 -0.227 5.666 -3.401 1.00 0.00 C ATOM 1590 C SER A 96 -1.364 5.195 -4.329 1.00 0.00 C ATOM 1591 O SER A 96 -1.116 4.389 -5.226 1.00 0.00 O ATOM 1592 CB SER A 96 -0.207 7.185 -3.236 1.00 0.00 C ATOM 1593 OG SER A 96 -0.899 7.542 -2.047 1.00 0.00 O ATOM 0 H SER A 96 1.482 5.903 -4.594 1.00 0.00 H new ATOM 0 HA SER A 96 -0.399 5.224 -2.419 1.00 0.00 H new ATOM 0 HB2 SER A 96 0.822 7.543 -3.192 1.00 0.00 H new ATOM 0 HB3 SER A 96 -0.674 7.661 -4.098 1.00 0.00 H new ATOM 0 HG SER A 96 -0.885 8.516 -1.940 1.00 0.00 H new ATOM 1599 N PRO A 97 -2.600 5.623 -4.136 1.00 0.00 N ATOM 1600 CA PRO A 97 -3.734 5.155 -4.982 1.00 0.00 C ATOM 1601 C PRO A 97 -3.846 5.955 -6.280 1.00 0.00 C ATOM 1602 O PRO A 97 -2.829 6.386 -6.826 1.00 0.00 O ATOM 1603 CB PRO A 97 -4.929 5.369 -4.069 1.00 0.00 C ATOM 1604 CG PRO A 97 -4.592 6.600 -3.310 1.00 0.00 C ATOM 1605 CD PRO A 97 -3.071 6.599 -3.133 1.00 0.00 C ATOM 0 HA PRO A 97 -3.630 4.124 -5.319 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -5.849 5.493 -4.640 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -5.079 4.519 -3.403 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -4.919 7.489 -3.848 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -5.095 6.610 -2.343 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -2.647 7.588 -3.308 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -2.786 6.304 -2.123 1.00 0.00 H new ATOM 1613 N CYS A 98 -5.065 6.151 -6.793 1.00 0.00 N ATOM 1614 CA CYS A 98 -5.212 6.896 -8.044 1.00 0.00 C ATOM 1615 C CYS A 98 -6.556 7.623 -8.157 1.00 0.00 C ATOM 1616 O CYS A 98 -7.510 7.315 -7.452 1.00 0.00 O ATOM 1617 CB CYS A 98 -5.052 5.940 -9.224 1.00 0.00 C ATOM 1618 SG CYS A 98 -3.651 4.845 -8.915 1.00 0.00 S ATOM 0 H CYS A 98 -5.935 5.817 -6.378 1.00 0.00 H new ATOM 0 HA CYS A 98 -4.435 7.660 -8.054 1.00 0.00 H new ATOM 0 HB2 CYS A 98 -5.962 5.356 -9.360 1.00 0.00 H new ATOM 0 HB3 CYS A 98 -4.893 6.502 -10.144 1.00 0.00 H new ATOM 1623 N PHE A 99 -6.600 8.598 -9.065 1.00 0.00 N ATOM 1624 CA PHE A 99 -7.803 9.404 -9.296 1.00 0.00 C ATOM 1625 C PHE A 99 -9.082 8.584 -9.180 1.00 0.00 C ATOM 1626 O PHE A 99 -9.997 8.952 -8.451 1.00 0.00 O ATOM 1627 CB PHE A 99 -7.746 10.044 -10.683 1.00 0.00 C ATOM 1628 CG PHE A 99 -7.914 8.993 -11.754 1.00 0.00 C ATOM 1629 CD1 PHE A 99 -6.928 8.018 -11.931 1.00 0.00 C ATOM 1630 CD2 PHE A 99 -9.046 9.001 -12.578 1.00 0.00 C ATOM 1631 CE1 PHE A 99 -7.073 7.047 -12.928 1.00 0.00 C ATOM 1632 CE2 PHE A 99 -9.192 8.031 -13.577 1.00 0.00 C ATOM 1633 CZ PHE A 99 -8.205 7.053 -13.751 1.00 0.00 C ATOM 0 H PHE A 99 -5.810 8.852 -9.658 1.00 0.00 H new ATOM 0 HA PHE A 99 -7.824 10.172 -8.523 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -8.530 10.796 -10.776 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -6.794 10.558 -10.815 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -6.053 8.014 -11.297 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -9.807 9.756 -12.443 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -6.312 6.293 -13.062 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -10.065 8.037 -14.213 1.00 0.00 H new ATOM 0 HZ PHE A 99 -8.317 6.303 -14.520 1.00 0.00 H new ATOM 1643 N SER A 100 -9.157 7.491 -9.920 1.00 0.00 N ATOM 1644 CA SER A 100 -10.356 6.656 -9.892 1.00 0.00 C ATOM 1645 C SER A 100 -10.213 5.520 -8.886 1.00 0.00 C ATOM 1646 O SER A 100 -10.931 5.462 -7.887 1.00 0.00 O ATOM 1647 CB SER A 100 -10.619 6.071 -11.279 1.00 0.00 C ATOM 1648 OG SER A 100 -11.777 5.248 -11.229 1.00 0.00 O ATOM 0 H SER A 100 -8.417 7.161 -10.540 1.00 0.00 H new ATOM 0 HA SER A 100 -11.194 7.285 -9.591 1.00 0.00 H new ATOM 0 HB2 SER A 100 -10.759 6.873 -12.004 1.00 0.00 H new ATOM 0 HB3 SER A 100 -9.759 5.489 -11.610 1.00 0.00 H new ATOM 0 HG SER A 100 -11.950 4.872 -12.117 1.00 0.00 H new ATOM 1654 N CYS A 101 -9.291 4.612 -9.163 1.00 0.00 N ATOM 1655 CA CYS A 101 -9.069 3.473 -8.281 1.00 0.00 C ATOM 1656 C CYS A 101 -9.221 3.887 -6.822 1.00 0.00 C ATOM 1657 O CYS A 101 -9.578 3.072 -5.963 1.00 0.00 O ATOM 1658 CB CYS A 101 -7.666 2.881 -8.541 1.00 0.00 C ATOM 1659 SG CYS A 101 -6.542 3.204 -7.153 1.00 0.00 S ATOM 0 H CYS A 101 -8.687 4.639 -9.985 1.00 0.00 H new ATOM 0 HA CYS A 101 -9.818 2.709 -8.491 1.00 0.00 H new ATOM 0 HB2 CYS A 101 -7.747 1.806 -8.702 1.00 0.00 H new ATOM 0 HB3 CYS A 101 -7.252 3.310 -9.454 1.00 0.00 H new ATOM 1664 N ALA A 102 -8.963 5.156 -6.542 1.00 0.00 N ATOM 1665 CA ALA A 102 -9.084 5.637 -5.180 1.00 0.00 C ATOM 1666 C ALA A 102 -10.549 5.709 -4.818 1.00 0.00 C ATOM 1667 O ALA A 102 -10.968 5.214 -3.776 1.00 0.00 O ATOM 1668 CB ALA A 102 -8.436 7.016 -5.028 1.00 0.00 C ATOM 0 H ALA A 102 -8.675 5.856 -7.226 1.00 0.00 H new ATOM 0 HA ALA A 102 -8.568 4.950 -4.510 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -8.540 7.355 -3.997 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -7.378 6.951 -5.284 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -8.928 7.725 -5.695 1.00 0.00 H new ATOM 1674 N GLN A 103 -11.328 6.303 -5.703 1.00 0.00 N ATOM 1675 CA GLN A 103 -12.752 6.401 -5.481 1.00 0.00 C ATOM 1676 C GLN A 103 -13.291 5.037 -5.123 1.00 0.00 C ATOM 1677 O GLN A 103 -13.832 4.841 -4.038 1.00 0.00 O ATOM 1678 CB GLN A 103 -13.433 6.895 -6.747 1.00 0.00 C ATOM 1679 CG GLN A 103 -13.278 8.403 -6.829 1.00 0.00 C ATOM 1680 CD GLN A 103 -14.035 8.947 -8.035 1.00 0.00 C ATOM 1681 OE1 GLN A 103 -14.075 8.306 -9.086 1.00 0.00 O ATOM 1682 NE2 GLN A 103 -14.641 10.099 -7.947 1.00 0.00 N ATOM 0 H GLN A 103 -10.999 6.720 -6.574 1.00 0.00 H new ATOM 0 HA GLN A 103 -12.948 7.101 -4.669 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -12.990 6.422 -7.623 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -14.489 6.624 -6.738 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -13.655 8.864 -5.916 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -12.222 8.663 -6.906 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -14.607 10.628 -7.076 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -15.149 10.471 -8.750 1.00 0.00 H new ATOM 1691 N GLU A 104 -13.109 4.091 -6.046 1.00 0.00 N ATOM 1692 CA GLU A 104 -13.566 2.719 -5.824 1.00 0.00 C ATOM 1693 C GLU A 104 -13.409 2.377 -4.350 1.00 0.00 C ATOM 1694 O GLU A 104 -14.392 2.172 -3.627 1.00 0.00 O ATOM 1695 CB GLU A 104 -12.741 1.748 -6.674 1.00 0.00 C ATOM 1696 CG GLU A 104 -13.258 1.767 -8.115 1.00 0.00 C ATOM 1697 CD GLU A 104 -14.636 1.119 -8.184 1.00 0.00 C ATOM 1698 OE1 GLU A 104 -14.902 0.247 -7.373 1.00 0.00 O ATOM 1699 OE2 GLU A 104 -15.408 1.504 -9.049 1.00 0.00 O ATOM 0 H GLU A 104 -12.653 4.247 -6.945 1.00 0.00 H new ATOM 0 HA GLU A 104 -14.614 2.632 -6.112 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -11.689 2.030 -6.650 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -12.810 0.740 -6.265 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -13.311 2.794 -8.477 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -12.564 1.235 -8.766 1.00 0.00 H new ATOM 1706 N MET A 105 -12.160 2.362 -3.906 1.00 0.00 N ATOM 1707 CA MET A 105 -11.866 2.096 -2.520 1.00 0.00 C ATOM 1708 C MET A 105 -12.645 3.082 -1.643 1.00 0.00 C ATOM 1709 O MET A 105 -13.551 2.670 -0.922 1.00 0.00 O ATOM 1710 CB MET A 105 -10.339 2.177 -2.342 1.00 0.00 C ATOM 1711 CG MET A 105 -9.831 1.178 -1.290 1.00 0.00 C ATOM 1712 SD MET A 105 -9.844 1.941 0.349 1.00 0.00 S ATOM 1713 CE MET A 105 -8.611 3.218 0.008 1.00 0.00 C ATOM 0 H MET A 105 -11.341 2.531 -4.490 1.00 0.00 H new ATOM 0 HA MET A 105 -12.182 1.100 -2.211 1.00 0.00 H new ATOM 0 HB2 MET A 105 -9.851 1.979 -3.296 1.00 0.00 H new ATOM 0 HB3 MET A 105 -10.061 3.189 -2.046 1.00 0.00 H new ATOM 0 HG2 MET A 105 -10.459 0.287 -1.290 1.00 0.00 H new ATOM 0 HG3 MET A 105 -8.821 0.855 -1.542 1.00 0.00 H new ATOM 0 HE1 MET A 105 -7.882 3.245 0.817 1.00 0.00 H new ATOM 0 HE2 MET A 105 -8.104 2.993 -0.930 1.00 0.00 H new ATOM 0 HE3 MET A 105 -9.103 4.188 -0.069 1.00 0.00 H new ATOM 1723 N ALA A 106 -12.330 4.374 -1.725 1.00 0.00 N ATOM 1724 CA ALA A 106 -13.050 5.376 -0.932 1.00 0.00 C ATOM 1725 C ALA A 106 -14.502 4.977 -0.698 1.00 0.00 C ATOM 1726 O ALA A 106 -14.929 4.843 0.433 1.00 0.00 O ATOM 1727 CB ALA A 106 -13.077 6.721 -1.644 1.00 0.00 C ATOM 0 H ALA A 106 -11.593 4.750 -2.322 1.00 0.00 H new ATOM 0 HA ALA A 106 -12.518 5.444 0.017 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -13.617 7.445 -1.034 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -12.056 7.069 -1.802 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -13.577 6.613 -2.607 1.00 0.00 H new ATOM 1733 N LYS A 107 -15.274 4.802 -1.771 1.00 0.00 N ATOM 1734 CA LYS A 107 -16.669 4.431 -1.605 1.00 0.00 C ATOM 1735 C LYS A 107 -16.776 3.386 -0.536 1.00 0.00 C ATOM 1736 O LYS A 107 -17.255 3.632 0.566 1.00 0.00 O ATOM 1737 CB LYS A 107 -17.195 3.820 -2.883 1.00 0.00 C ATOM 1738 CG LYS A 107 -17.426 4.916 -3.940 1.00 0.00 C ATOM 1739 CD LYS A 107 -16.741 4.520 -5.240 1.00 0.00 C ATOM 1740 CE LYS A 107 -17.463 3.321 -5.842 1.00 0.00 C ATOM 1741 NZ LYS A 107 -18.771 3.759 -6.402 1.00 0.00 N ATOM 0 H LYS A 107 -14.964 4.909 -2.737 1.00 0.00 H new ATOM 0 HA LYS A 107 -17.239 5.323 -1.345 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -16.486 3.083 -3.261 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -18.128 3.292 -2.685 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -18.494 5.056 -4.107 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -17.032 5.868 -3.584 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -16.752 5.355 -5.940 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -15.696 4.274 -5.054 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -16.853 2.871 -6.625 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -17.619 2.557 -5.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -19.114 3.048 -7.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -19.461 3.864 -5.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -18.653 4.671 -6.888 1.00 0.00 H new ATOM 1755 N PHE A 108 -16.303 2.214 -0.886 1.00 0.00 N ATOM 1756 CA PHE A 108 -16.320 1.100 0.037 1.00 0.00 C ATOM 1757 C PHE A 108 -15.997 1.592 1.447 1.00 0.00 C ATOM 1758 O PHE A 108 -16.385 0.976 2.441 1.00 0.00 O ATOM 1759 CB PHE A 108 -15.296 0.073 -0.418 1.00 0.00 C ATOM 1760 CG PHE A 108 -15.954 -0.822 -1.428 1.00 0.00 C ATOM 1761 CD1 PHE A 108 -16.485 -0.277 -2.602 1.00 0.00 C ATOM 1762 CD2 PHE A 108 -16.065 -2.183 -1.170 1.00 0.00 C ATOM 1763 CE1 PHE A 108 -17.124 -1.106 -3.524 1.00 0.00 C ATOM 1764 CE2 PHE A 108 -16.707 -3.016 -2.085 1.00 0.00 C ATOM 1765 CZ PHE A 108 -17.239 -2.480 -3.267 1.00 0.00 C ATOM 0 H PHE A 108 -15.902 2.005 -1.800 1.00 0.00 H new ATOM 0 HA PHE A 108 -17.309 0.641 0.053 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -14.428 0.568 -0.855 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -14.937 -0.509 0.431 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -16.400 0.782 -2.794 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -15.654 -2.595 -0.260 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -17.530 -0.690 -4.435 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -16.795 -4.073 -1.884 1.00 0.00 H new ATOM 0 HZ PHE A 108 -17.736 -3.124 -3.978 1.00 0.00 H new ATOM 1775 N ILE A 109 -15.264 2.701 1.512 1.00 0.00 N ATOM 1776 CA ILE A 109 -14.853 3.289 2.768 1.00 0.00 C ATOM 1777 C ILE A 109 -15.777 4.438 3.196 1.00 0.00 C ATOM 1778 O ILE A 109 -15.909 4.723 4.386 1.00 0.00 O ATOM 1779 CB ILE A 109 -13.423 3.813 2.575 1.00 0.00 C ATOM 1780 CG1 ILE A 109 -12.431 2.720 2.869 1.00 0.00 C ATOM 1781 CG2 ILE A 109 -13.147 4.994 3.479 1.00 0.00 C ATOM 1782 CD1 ILE A 109 -12.522 1.675 1.779 1.00 0.00 C ATOM 0 H ILE A 109 -14.942 3.212 0.690 1.00 0.00 H new ATOM 0 HA ILE A 109 -14.903 2.537 3.555 1.00 0.00 H new ATOM 0 HB ILE A 109 -13.322 4.136 1.539 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -11.422 3.129 2.917 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -12.640 2.272 3.840 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -12.127 5.343 3.320 1.00 0.00 H new ATOM 0 HG22 ILE A 109 -13.846 5.799 3.250 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -13.269 4.692 4.519 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -11.808 0.877 1.980 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -13.530 1.262 1.754 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -12.293 2.132 0.816 1.00 0.00 H new ATOM 1794 N SER A 110 -16.393 5.105 2.229 1.00 0.00 N ATOM 1795 CA SER A 110 -17.269 6.225 2.530 1.00 0.00 C ATOM 1796 C SER A 110 -18.701 5.733 2.685 1.00 0.00 C ATOM 1797 O SER A 110 -19.527 6.363 3.346 1.00 0.00 O ATOM 1798 CB SER A 110 -17.181 7.261 1.405 1.00 0.00 C ATOM 1799 OG SER A 110 -18.392 7.257 0.662 1.00 0.00 O ATOM 0 H SER A 110 -16.302 4.890 1.236 1.00 0.00 H new ATOM 0 HA SER A 110 -16.956 6.690 3.465 1.00 0.00 H new ATOM 0 HB2 SER A 110 -17.001 8.252 1.822 1.00 0.00 H new ATOM 0 HB3 SER A 110 -16.340 7.033 0.751 1.00 0.00 H new ATOM 0 HG SER A 110 -18.337 7.921 -0.057 1.00 0.00 H new ATOM 1805 N LYS A 111 -18.972 4.588 2.074 1.00 0.00 N ATOM 1806 CA LYS A 111 -20.285 3.974 2.133 1.00 0.00 C ATOM 1807 C LYS A 111 -20.428 3.168 3.419 1.00 0.00 C ATOM 1808 O LYS A 111 -21.503 3.114 4.017 1.00 0.00 O ATOM 1809 CB LYS A 111 -20.463 3.040 0.942 1.00 0.00 C ATOM 1810 CG LYS A 111 -20.278 3.764 -0.408 1.00 0.00 C ATOM 1811 CD LYS A 111 -20.685 5.249 -0.350 1.00 0.00 C ATOM 1812 CE LYS A 111 -22.180 5.393 -0.023 1.00 0.00 C ATOM 1813 NZ LYS A 111 -22.923 5.756 -1.262 1.00 0.00 N ATOM 0 H LYS A 111 -18.290 4.063 1.527 1.00 0.00 H new ATOM 0 HA LYS A 111 -21.042 4.757 2.110 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -19.745 2.223 1.014 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -21.457 2.595 0.979 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -19.235 3.690 -0.715 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -20.871 3.259 -1.170 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -20.092 5.764 0.405 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -20.469 5.727 -1.305 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -22.566 4.459 0.386 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -22.325 6.159 0.739 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -23.935 5.854 -1.044 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -22.560 6.657 -1.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -22.793 5.010 -1.975 1.00 0.00 H new ATOM 1827 N ASN A 112 -19.331 2.540 3.836 1.00 0.00 N ATOM 1828 CA ASN A 112 -19.329 1.730 5.053 1.00 0.00 C ATOM 1829 C ASN A 112 -18.099 2.041 5.903 1.00 0.00 C ATOM 1830 O ASN A 112 -17.085 1.347 5.824 1.00 0.00 O ATOM 1831 CB ASN A 112 -19.338 0.245 4.690 1.00 0.00 C ATOM 1832 CG ASN A 112 -20.749 -0.189 4.306 1.00 0.00 C ATOM 1833 OD1 ASN A 112 -21.434 0.512 3.562 1.00 0.00 O ATOM 1834 ND2 ASN A 112 -21.226 -1.311 4.772 1.00 0.00 N ATOM 0 H ASN A 112 -18.434 2.576 3.351 1.00 0.00 H new ATOM 0 HA ASN A 112 -20.223 1.969 5.628 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -18.654 0.060 3.862 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -18.984 -0.346 5.534 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -22.168 -1.608 4.520 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -20.656 -1.890 5.389 1.00 0.00 H new ATOM 1841 N LYS A 113 -18.199 3.091 6.709 1.00 0.00 N ATOM 1842 CA LYS A 113 -17.097 3.500 7.570 1.00 0.00 C ATOM 1843 C LYS A 113 -16.636 2.356 8.473 1.00 0.00 C ATOM 1844 O LYS A 113 -15.711 2.521 9.268 1.00 0.00 O ATOM 1845 CB LYS A 113 -17.526 4.683 8.429 1.00 0.00 C ATOM 1846 CG LYS A 113 -17.681 5.929 7.552 1.00 0.00 C ATOM 1847 CD LYS A 113 -18.883 5.760 6.620 1.00 0.00 C ATOM 1848 CE LYS A 113 -19.397 7.139 6.198 1.00 0.00 C ATOM 1849 NZ LYS A 113 -20.646 6.981 5.401 1.00 0.00 N ATOM 0 H LYS A 113 -19.032 3.675 6.784 1.00 0.00 H new ATOM 0 HA LYS A 113 -16.262 3.787 6.931 1.00 0.00 H new ATOM 0 HB2 LYS A 113 -18.468 4.459 8.929 1.00 0.00 H new ATOM 0 HB3 LYS A 113 -16.787 4.865 9.209 1.00 0.00 H new ATOM 0 HG2 LYS A 113 -17.816 6.811 8.178 1.00 0.00 H new ATOM 0 HG3 LYS A 113 -16.775 6.088 6.967 1.00 0.00 H new ATOM 0 HD2 LYS A 113 -18.597 5.182 5.741 1.00 0.00 H new ATOM 0 HD3 LYS A 113 -19.673 5.204 7.125 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -19.590 7.752 7.078 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -18.640 7.656 5.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -21.223 7.842 5.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -20.403 6.823 4.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -21.186 6.167 5.759 1.00 0.00 H new ATOM 1863 N HIS A 114 -17.282 1.200 8.351 1.00 0.00 N ATOM 1864 CA HIS A 114 -16.918 0.044 9.170 1.00 0.00 C ATOM 1865 C HIS A 114 -15.575 -0.531 8.720 1.00 0.00 C ATOM 1866 O HIS A 114 -15.331 -1.733 8.830 1.00 0.00 O ATOM 1867 CB HIS A 114 -18.004 -1.028 9.063 1.00 0.00 C ATOM 1868 CG HIS A 114 -17.685 -2.164 9.996 1.00 0.00 C ATOM 1869 ND1 HIS A 114 -17.515 -3.464 9.544 1.00 0.00 N ATOM 1870 CD2 HIS A 114 -17.501 -2.212 11.355 1.00 0.00 C ATOM 1871 CE1 HIS A 114 -17.242 -4.232 10.615 1.00 0.00 C ATOM 1872 NE2 HIS A 114 -17.222 -3.520 11.744 1.00 0.00 N ATOM 0 H HIS A 114 -18.052 1.037 7.702 1.00 0.00 H new ATOM 0 HA HIS A 114 -16.828 0.366 10.208 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -18.976 -0.602 9.312 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -18.069 -1.393 8.038 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -17.563 -1.364 12.022 1.00 0.00 H new ATOM 0 HE1 HIS A 114 -17.061 -5.296 10.567 1.00 0.00 H new ATOM 0 HE2 HIS A 114 -17.041 -3.861 12.688 1.00 0.00 H new ATOM 1881 N VAL A 115 -14.719 0.341 8.196 1.00 0.00 N ATOM 1882 CA VAL A 115 -13.409 -0.053 7.703 1.00 0.00 C ATOM 1883 C VAL A 115 -12.320 0.911 8.217 1.00 0.00 C ATOM 1884 O VAL A 115 -12.558 2.112 8.351 1.00 0.00 O ATOM 1885 CB VAL A 115 -13.472 -0.047 6.167 1.00 0.00 C ATOM 1886 CG1 VAL A 115 -12.187 0.471 5.596 1.00 0.00 C ATOM 1887 CG2 VAL A 115 -13.669 -1.446 5.626 1.00 0.00 C ATOM 0 H VAL A 115 -14.916 1.337 8.103 1.00 0.00 H new ATOM 0 HA VAL A 115 -13.148 -1.048 8.064 1.00 0.00 H new ATOM 0 HB VAL A 115 -14.310 0.589 5.883 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -12.246 0.470 4.508 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -12.016 1.488 5.949 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -11.363 -0.167 5.916 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -13.710 -1.413 4.537 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -12.837 -2.077 5.939 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -14.602 -1.857 6.012 1.00 0.00 H new ATOM 1897 N SER A 116 -11.123 0.373 8.493 1.00 0.00 N ATOM 1898 CA SER A 116 -10.008 1.200 8.979 1.00 0.00 C ATOM 1899 C SER A 116 -8.674 0.823 8.313 1.00 0.00 C ATOM 1900 O SER A 116 -8.038 -0.152 8.709 1.00 0.00 O ATOM 1901 CB SER A 116 -9.866 1.037 10.487 1.00 0.00 C ATOM 1902 OG SER A 116 -11.005 1.592 11.133 1.00 0.00 O ATOM 0 H SER A 116 -10.903 -0.618 8.390 1.00 0.00 H new ATOM 0 HA SER A 116 -10.237 2.234 8.723 1.00 0.00 H new ATOM 0 HB2 SER A 116 -9.768 -0.018 10.742 1.00 0.00 H new ATOM 0 HB3 SER A 116 -8.960 1.534 10.834 1.00 0.00 H new ATOM 0 HG SER A 116 -10.915 1.486 12.103 1.00 0.00 H new ATOM 1908 N LEU A 117 -8.255 1.590 7.301 1.00 0.00 N ATOM 1909 CA LEU A 117 -7.006 1.312 6.602 1.00 0.00 C ATOM 1910 C LEU A 117 -5.928 2.344 6.897 1.00 0.00 C ATOM 1911 O LEU A 117 -6.217 3.490 7.248 1.00 0.00 O ATOM 1912 CB LEU A 117 -7.262 1.305 5.112 1.00 0.00 C ATOM 1913 CG LEU A 117 -8.654 0.747 4.878 1.00 0.00 C ATOM 1914 CD1 LEU A 117 -9.695 1.848 4.993 1.00 0.00 C ATOM 1915 CD2 LEU A 117 -8.702 0.155 3.504 1.00 0.00 C ATOM 0 H LEU A 117 -8.763 2.403 6.952 1.00 0.00 H new ATOM 0 HA LEU A 117 -6.650 0.343 6.952 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -7.183 2.314 4.707 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -6.516 0.697 4.600 1.00 0.00 H new ATOM 0 HG LEU A 117 -8.872 -0.013 5.628 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -10.687 1.430 4.822 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -9.652 2.286 5.990 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -9.493 2.619 4.249 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -9.696 -0.252 3.318 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -8.482 0.927 2.767 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -7.963 -0.643 3.425 1.00 0.00 H new ATOM 1927 N CYS A 118 -4.681 1.928 6.710 1.00 0.00 N ATOM 1928 CA CYS A 118 -3.541 2.801 6.912 1.00 0.00 C ATOM 1929 C CYS A 118 -2.511 2.542 5.811 1.00 0.00 C ATOM 1930 O CYS A 118 -1.735 1.588 5.891 1.00 0.00 O ATOM 1931 CB CYS A 118 -2.922 2.541 8.287 1.00 0.00 C ATOM 1932 SG CYS A 118 -3.631 3.688 9.495 1.00 0.00 S ATOM 0 H CYS A 118 -4.437 0.982 6.416 1.00 0.00 H new ATOM 0 HA CYS A 118 -3.863 3.841 6.868 1.00 0.00 H new ATOM 0 HB2 CYS A 118 -3.109 1.512 8.593 1.00 0.00 H new ATOM 0 HB3 CYS A 118 -1.840 2.668 8.241 1.00 0.00 H new ATOM 0 HG CYS A 118 -3.107 3.466 10.664 1.00 0.00 H new ATOM 1938 N ILE A 119 -2.531 3.367 4.766 1.00 0.00 N ATOM 1939 CA ILE A 119 -1.622 3.190 3.658 1.00 0.00 C ATOM 1940 C ILE A 119 -0.290 3.876 3.887 1.00 0.00 C ATOM 1941 O ILE A 119 -0.231 5.071 4.172 1.00 0.00 O ATOM 1942 CB ILE A 119 -2.256 3.772 2.420 1.00 0.00 C ATOM 1943 CG1 ILE A 119 -3.715 3.303 2.367 1.00 0.00 C ATOM 1944 CG2 ILE A 119 -1.471 3.299 1.192 1.00 0.00 C ATOM 1945 CD1 ILE A 119 -4.238 3.411 0.948 1.00 0.00 C ATOM 0 H ILE A 119 -3.167 4.159 4.672 1.00 0.00 H new ATOM 0 HA ILE A 119 -1.432 2.122 3.550 1.00 0.00 H new ATOM 0 HB ILE A 119 -2.236 4.862 2.436 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -3.788 2.272 2.714 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -4.326 3.909 3.037 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -1.921 3.714 0.290 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -0.437 3.635 1.269 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -1.496 2.210 1.142 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -5.275 3.077 0.916 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -4.181 4.448 0.617 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -3.635 2.786 0.289 1.00 0.00 H new ATOM 1957 N PHE A 120 0.781 3.113 3.713 1.00 0.00 N ATOM 1958 CA PHE A 120 2.123 3.652 3.853 1.00 0.00 C ATOM 1959 C PHE A 120 2.759 3.682 2.476 1.00 0.00 C ATOM 1960 O PHE A 120 3.180 2.654 1.947 1.00 0.00 O ATOM 1961 CB PHE A 120 2.948 2.780 4.803 1.00 0.00 C ATOM 1962 CG PHE A 120 2.779 3.275 6.221 1.00 0.00 C ATOM 1963 CD1 PHE A 120 3.401 4.462 6.627 1.00 0.00 C ATOM 1964 CD2 PHE A 120 1.999 2.547 7.127 1.00 0.00 C ATOM 1965 CE1 PHE A 120 3.241 4.922 7.940 1.00 0.00 C ATOM 1966 CE2 PHE A 120 1.841 3.007 8.440 1.00 0.00 C ATOM 1967 CZ PHE A 120 2.461 4.194 8.846 1.00 0.00 C ATOM 0 H PHE A 120 0.745 2.122 3.475 1.00 0.00 H new ATOM 0 HA PHE A 120 2.085 4.658 4.272 1.00 0.00 H new ATOM 0 HB2 PHE A 120 2.628 1.741 4.729 1.00 0.00 H new ATOM 0 HB3 PHE A 120 4.000 2.810 4.519 1.00 0.00 H new ATOM 0 HD1 PHE A 120 4.004 5.023 5.928 1.00 0.00 H new ATOM 0 HD2 PHE A 120 1.520 1.631 6.814 1.00 0.00 H new ATOM 0 HE1 PHE A 120 3.719 5.838 8.253 1.00 0.00 H new ATOM 0 HE2 PHE A 120 1.240 2.445 9.140 1.00 0.00 H new ATOM 0 HZ PHE A 120 2.338 4.548 9.859 1.00 0.00 H new ATOM 1977 N THR A 121 2.789 4.868 1.887 1.00 0.00 N ATOM 1978 CA THR A 121 3.332 5.040 0.547 1.00 0.00 C ATOM 1979 C THR A 121 4.536 5.975 0.571 1.00 0.00 C ATOM 1980 O THR A 121 4.608 6.892 1.387 1.00 0.00 O ATOM 1981 CB THR A 121 2.229 5.578 -0.384 1.00 0.00 C ATOM 1982 OG1 THR A 121 2.670 6.779 -0.999 1.00 0.00 O ATOM 1983 CG2 THR A 121 0.950 5.848 0.423 1.00 0.00 C ATOM 0 H THR A 121 2.444 5.727 2.316 1.00 0.00 H new ATOM 0 HA THR A 121 3.673 4.077 0.169 1.00 0.00 H new ATOM 0 HB THR A 121 2.015 4.836 -1.153 1.00 0.00 H new ATOM 0 HG1 THR A 121 1.895 7.283 -1.326 1.00 0.00 H new ATOM 0 HG21 THR A 121 0.174 6.228 -0.241 1.00 0.00 H new ATOM 0 HG22 THR A 121 0.610 4.922 0.886 1.00 0.00 H new ATOM 0 HG23 THR A 121 1.158 6.586 1.198 1.00 0.00 H new ATOM 1991 N ALA A 122 5.496 5.710 -0.312 1.00 0.00 N ATOM 1992 CA ALA A 122 6.720 6.504 -0.366 1.00 0.00 C ATOM 1993 C ALA A 122 6.638 7.624 -1.395 1.00 0.00 C ATOM 1994 O ALA A 122 6.842 8.790 -1.060 1.00 0.00 O ATOM 1995 CB ALA A 122 7.908 5.597 -0.693 1.00 0.00 C ATOM 0 H ALA A 122 5.450 4.955 -0.997 1.00 0.00 H new ATOM 0 HA ALA A 122 6.853 6.965 0.613 1.00 0.00 H new ATOM 0 HB1 ALA A 122 8.820 6.192 -0.733 1.00 0.00 H new ATOM 0 HB2 ALA A 122 8.006 4.834 0.079 1.00 0.00 H new ATOM 0 HB3 ALA A 122 7.745 5.118 -1.658 1.00 0.00 H new ATOM 2001 N ARG A 123 6.369 7.281 -2.653 1.00 0.00 N ATOM 2002 CA ARG A 123 6.305 8.312 -3.680 1.00 0.00 C ATOM 2003 C ARG A 123 5.522 7.878 -4.911 1.00 0.00 C ATOM 2004 O ARG A 123 5.509 6.706 -5.289 1.00 0.00 O ATOM 2005 CB ARG A 123 7.721 8.706 -4.100 1.00 0.00 C ATOM 2006 CG ARG A 123 8.502 7.452 -4.498 1.00 0.00 C ATOM 2007 CD ARG A 123 9.768 7.851 -5.259 1.00 0.00 C ATOM 2008 NE ARG A 123 9.480 7.999 -6.680 1.00 0.00 N ATOM 2009 CZ ARG A 123 10.459 8.105 -7.572 1.00 0.00 C ATOM 2010 NH1 ARG A 123 11.703 8.081 -7.180 1.00 0.00 N ATOM 2011 NH2 ARG A 123 10.177 8.234 -8.840 1.00 0.00 N ATOM 0 H ARG A 123 6.197 6.329 -2.977 1.00 0.00 H new ATOM 0 HA ARG A 123 5.779 9.161 -3.243 1.00 0.00 H new ATOM 0 HB2 ARG A 123 7.683 9.404 -4.936 1.00 0.00 H new ATOM 0 HB3 ARG A 123 8.226 9.217 -3.280 1.00 0.00 H new ATOM 0 HG2 ARG A 123 8.766 6.879 -3.609 1.00 0.00 H new ATOM 0 HG3 ARG A 123 7.881 6.807 -5.120 1.00 0.00 H new ATOM 0 HD2 ARG A 123 10.159 8.787 -4.861 1.00 0.00 H new ATOM 0 HD3 ARG A 123 10.540 7.096 -5.115 1.00 0.00 H new ATOM 0 HE ARG A 123 8.510 8.022 -6.995 1.00 0.00 H new ATOM 0 HH11 ARG A 123 11.924 7.981 -6.189 1.00 0.00 H new ATOM 0 HH12 ARG A 123 12.455 8.162 -7.864 1.00 0.00 H new ATOM 0 HH21 ARG A 123 9.204 8.254 -9.147 1.00 0.00 H new ATOM 0 HH22 ARG A 123 10.929 8.315 -9.524 1.00 0.00 H new ATOM 2025 N ILE A 124 4.882 8.864 -5.530 1.00 0.00 N ATOM 2026 CA ILE A 124 4.092 8.650 -6.733 1.00 0.00 C ATOM 2027 C ILE A 124 4.444 9.711 -7.768 1.00 0.00 C ATOM 2028 O ILE A 124 4.574 10.890 -7.437 1.00 0.00 O ATOM 2029 CB ILE A 124 2.608 8.747 -6.392 1.00 0.00 C ATOM 2030 CG1 ILE A 124 2.332 10.116 -5.723 1.00 0.00 C ATOM 2031 CG2 ILE A 124 2.241 7.593 -5.457 1.00 0.00 C ATOM 2032 CD1 ILE A 124 1.213 10.004 -4.682 1.00 0.00 C ATOM 0 H ILE A 124 4.897 9.833 -5.211 1.00 0.00 H new ATOM 0 HA ILE A 124 4.309 7.661 -7.137 1.00 0.00 H new ATOM 0 HB ILE A 124 1.999 8.674 -7.293 1.00 0.00 H new ATOM 0 HG12 ILE A 124 3.242 10.482 -5.246 1.00 0.00 H new ATOM 0 HG13 ILE A 124 2.055 10.847 -6.483 1.00 0.00 H new ATOM 0 HG21 ILE A 124 1.182 7.651 -5.206 1.00 0.00 H new ATOM 0 HG22 ILE A 124 2.445 6.644 -5.953 1.00 0.00 H new ATOM 0 HG23 ILE A 124 2.835 7.661 -4.545 1.00 0.00 H new ATOM 0 HD11 ILE A 124 1.040 10.980 -4.228 1.00 0.00 H new ATOM 0 HD12 ILE A 124 0.298 9.662 -5.166 1.00 0.00 H new ATOM 0 HD13 ILE A 124 1.504 9.291 -3.911 1.00 0.00 H new ATOM 2044 N TYR A 125 4.604 9.297 -9.019 1.00 0.00 N ATOM 2045 CA TYR A 125 4.948 10.238 -10.081 1.00 0.00 C ATOM 2046 C TYR A 125 4.096 9.993 -11.320 1.00 0.00 C ATOM 2047 O TYR A 125 4.278 9.004 -12.030 1.00 0.00 O ATOM 2048 CB TYR A 125 6.431 10.101 -10.438 1.00 0.00 C ATOM 2049 CG TYR A 125 7.262 10.878 -9.442 1.00 0.00 C ATOM 2050 CD1 TYR A 125 7.405 12.265 -9.580 1.00 0.00 C ATOM 2051 CD2 TYR A 125 7.892 10.213 -8.383 1.00 0.00 C ATOM 2052 CE1 TYR A 125 8.178 12.985 -8.660 1.00 0.00 C ATOM 2053 CE2 TYR A 125 8.663 10.933 -7.463 1.00 0.00 C ATOM 2054 CZ TYR A 125 8.806 12.319 -7.602 1.00 0.00 C ATOM 2055 OH TYR A 125 9.567 13.028 -6.696 1.00 0.00 O ATOM 0 H TYR A 125 4.503 8.328 -9.322 1.00 0.00 H new ATOM 0 HA TYR A 125 4.752 11.248 -9.721 1.00 0.00 H new ATOM 0 HB2 TYR A 125 6.723 9.051 -10.430 1.00 0.00 H new ATOM 0 HB3 TYR A 125 6.609 10.474 -11.446 1.00 0.00 H new ATOM 0 HD1 TYR A 125 6.919 12.779 -10.396 1.00 0.00 H new ATOM 0 HD2 TYR A 125 7.783 9.144 -8.276 1.00 0.00 H new ATOM 0 HE1 TYR A 125 8.289 14.054 -8.767 1.00 0.00 H new ATOM 0 HE2 TYR A 125 9.148 10.419 -6.646 1.00 0.00 H new ATOM 0 HH TYR A 125 9.563 13.978 -6.938 1.00 0.00 H new ATOM 2065 N ASP A 126 3.165 10.909 -11.572 1.00 0.00 N ATOM 2066 CA ASP A 126 2.282 10.799 -12.727 1.00 0.00 C ATOM 2067 C ASP A 126 2.082 12.169 -13.368 1.00 0.00 C ATOM 2068 O ASP A 126 2.561 13.179 -12.854 1.00 0.00 O ATOM 2069 CB ASP A 126 0.926 10.232 -12.301 1.00 0.00 C ATOM 2070 CG ASP A 126 1.125 9.107 -11.291 1.00 0.00 C ATOM 2071 OD1 ASP A 126 1.559 9.396 -10.189 1.00 0.00 O ATOM 2072 OD2 ASP A 126 0.838 7.971 -11.635 1.00 0.00 O ATOM 0 H ASP A 126 3.003 11.733 -10.993 1.00 0.00 H new ATOM 0 HA ASP A 126 2.741 10.127 -13.452 1.00 0.00 H new ATOM 0 HB2 ASP A 126 0.314 11.021 -11.863 1.00 0.00 H new ATOM 0 HB3 ASP A 126 0.389 9.858 -13.173 1.00 0.00 H new ATOM 2077 N ASP A 127 1.370 12.198 -14.492 1.00 0.00 N ATOM 2078 CA ASP A 127 1.112 13.453 -15.194 1.00 0.00 C ATOM 2079 C ASP A 127 -0.384 13.749 -15.229 1.00 0.00 C ATOM 2080 O ASP A 127 -0.908 14.232 -16.233 1.00 0.00 O ATOM 2081 CB ASP A 127 1.650 13.370 -16.624 1.00 0.00 C ATOM 2082 CG ASP A 127 3.175 13.345 -16.606 1.00 0.00 C ATOM 2083 OD1 ASP A 127 3.728 12.863 -15.631 1.00 0.00 O ATOM 2084 OD2 ASP A 127 3.768 13.808 -17.567 1.00 0.00 O ATOM 0 H ASP A 127 0.964 11.373 -14.934 1.00 0.00 H new ATOM 0 HA ASP A 127 1.618 14.257 -14.660 1.00 0.00 H new ATOM 0 HB2 ASP A 127 1.269 12.474 -17.113 1.00 0.00 H new ATOM 0 HB3 ASP A 127 1.299 14.224 -17.204 1.00 0.00 H new ATOM 2089 N GLN A 128 -1.067 13.455 -14.126 1.00 0.00 N ATOM 2090 CA GLN A 128 -2.498 13.693 -14.040 1.00 0.00 C ATOM 2091 C GLN A 128 -2.780 15.109 -13.552 1.00 0.00 C ATOM 2092 O GLN A 128 -2.887 16.041 -14.348 1.00 0.00 O ATOM 2093 CB GLN A 128 -3.138 12.686 -13.082 1.00 0.00 C ATOM 2094 CG GLN A 128 -3.174 11.305 -13.739 1.00 0.00 C ATOM 2095 CD GLN A 128 -4.421 11.175 -14.609 1.00 0.00 C ATOM 2096 OE1 GLN A 128 -5.540 11.319 -14.117 1.00 0.00 O ATOM 2097 NE2 GLN A 128 -4.293 10.907 -15.879 1.00 0.00 N ATOM 0 H GLN A 128 -0.652 13.054 -13.285 1.00 0.00 H new ATOM 0 HA GLN A 128 -2.926 13.573 -15.035 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -2.571 12.643 -12.152 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -4.148 13.004 -12.825 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -2.280 11.158 -14.345 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -3.171 10.529 -12.974 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -3.364 10.788 -16.284 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -5.121 10.816 -16.467 1.00 0.00 H new ATOM 2106 N GLY A 129 -2.898 15.261 -12.235 1.00 0.00 N ATOM 2107 CA GLY A 129 -3.168 16.567 -11.641 1.00 0.00 C ATOM 2108 C GLY A 129 -4.527 16.582 -10.950 1.00 0.00 C ATOM 2109 O GLY A 129 -4.619 16.391 -9.739 1.00 0.00 O ATOM 0 H GLY A 129 -2.811 14.500 -11.562 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -2.387 16.812 -10.921 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -3.141 17.335 -12.414 1.00 0.00 H new ATOM 2113 N ARG A 130 -5.582 16.809 -11.728 1.00 0.00 N ATOM 2114 CA ARG A 130 -6.932 16.846 -11.176 1.00 0.00 C ATOM 2115 C ARG A 130 -7.270 15.520 -10.500 1.00 0.00 C ATOM 2116 O ARG A 130 -8.348 15.358 -9.932 1.00 0.00 O ATOM 2117 CB ARG A 130 -7.945 17.134 -12.285 1.00 0.00 C ATOM 2118 CG ARG A 130 -7.430 18.279 -13.160 1.00 0.00 C ATOM 2119 CD ARG A 130 -8.482 18.633 -14.212 1.00 0.00 C ATOM 2120 NE ARG A 130 -8.027 19.756 -15.024 1.00 0.00 N ATOM 2121 CZ ARG A 130 -8.108 21.006 -14.578 1.00 0.00 C ATOM 2122 NH1 ARG A 130 -8.595 21.245 -13.390 1.00 0.00 N ATOM 2123 NH2 ARG A 130 -7.698 21.994 -15.326 1.00 0.00 N ATOM 0 H ARG A 130 -5.529 16.969 -12.734 1.00 0.00 H new ATOM 0 HA ARG A 130 -6.979 17.641 -10.432 1.00 0.00 H new ATOM 0 HB2 ARG A 130 -8.101 16.241 -12.890 1.00 0.00 H new ATOM 0 HB3 ARG A 130 -8.910 17.398 -11.852 1.00 0.00 H new ATOM 0 HG2 ARG A 130 -7.210 19.151 -12.544 1.00 0.00 H new ATOM 0 HG3 ARG A 130 -6.499 17.988 -13.646 1.00 0.00 H new ATOM 0 HD2 ARG A 130 -8.675 17.769 -14.849 1.00 0.00 H new ATOM 0 HD3 ARG A 130 -9.423 18.886 -13.724 1.00 0.00 H new ATOM 0 HE ARG A 130 -7.640 19.579 -15.951 1.00 0.00 H new ATOM 0 HH11 ARG A 130 -8.913 20.473 -12.804 1.00 0.00 H new ATOM 0 HH12 ARG A 130 -8.657 22.204 -13.048 1.00 0.00 H new ATOM 0 HH21 ARG A 130 -7.315 21.807 -16.253 1.00 0.00 H new ATOM 0 HH22 ARG A 130 -7.760 22.953 -14.984 1.00 0.00 H new ATOM 2137 N CYS A 131 -6.334 14.579 -10.563 1.00 0.00 N ATOM 2138 CA CYS A 131 -6.531 13.269 -9.951 1.00 0.00 C ATOM 2139 C CYS A 131 -6.952 13.423 -8.490 1.00 0.00 C ATOM 2140 O CYS A 131 -7.284 12.446 -7.819 1.00 0.00 O ATOM 2141 CB CYS A 131 -5.224 12.471 -10.032 1.00 0.00 C ATOM 2142 SG CYS A 131 -5.236 11.138 -8.805 1.00 0.00 S ATOM 0 H CYS A 131 -5.435 14.698 -11.030 1.00 0.00 H new ATOM 0 HA CYS A 131 -7.319 12.740 -10.487 1.00 0.00 H new ATOM 0 HB2 CYS A 131 -5.104 12.055 -11.032 1.00 0.00 H new ATOM 0 HB3 CYS A 131 -4.374 13.130 -9.857 1.00 0.00 H new ATOM 0 HG CYS A 131 -6.188 11.348 -7.945 1.00 0.00 H new ATOM 2148 N GLN A 132 -6.921 14.658 -8.006 1.00 0.00 N ATOM 2149 CA GLN A 132 -7.283 14.947 -6.623 1.00 0.00 C ATOM 2150 C GLN A 132 -8.708 14.499 -6.295 1.00 0.00 C ATOM 2151 O GLN A 132 -9.097 14.479 -5.128 1.00 0.00 O ATOM 2152 CB GLN A 132 -7.144 16.449 -6.357 1.00 0.00 C ATOM 2153 CG GLN A 132 -8.344 17.195 -6.947 1.00 0.00 C ATOM 2154 CD GLN A 132 -9.512 17.163 -5.968 1.00 0.00 C ATOM 2155 OE1 GLN A 132 -9.306 17.088 -4.756 1.00 0.00 O ATOM 2156 NE2 GLN A 132 -10.734 17.214 -6.422 1.00 0.00 N ATOM 0 H GLN A 132 -6.649 15.477 -8.550 1.00 0.00 H new ATOM 0 HA GLN A 132 -6.604 14.386 -5.981 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -7.082 16.633 -5.284 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -6.220 16.822 -6.799 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -8.070 18.227 -7.165 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -8.638 16.738 -7.892 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -10.903 17.276 -7.426 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -11.521 17.192 -5.773 1.00 0.00 H new ATOM 2165 N GLU A 133 -9.492 14.158 -7.314 1.00 0.00 N ATOM 2166 CA GLU A 133 -10.871 13.742 -7.070 1.00 0.00 C ATOM 2167 C GLU A 133 -10.924 12.573 -6.087 1.00 0.00 C ATOM 2168 O GLU A 133 -11.342 12.735 -4.939 1.00 0.00 O ATOM 2169 CB GLU A 133 -11.559 13.356 -8.389 1.00 0.00 C ATOM 2170 CG GLU A 133 -10.522 12.886 -9.399 1.00 0.00 C ATOM 2171 CD GLU A 133 -11.213 12.225 -10.587 1.00 0.00 C ATOM 2172 OE1 GLU A 133 -11.938 11.269 -10.369 1.00 0.00 O ATOM 2173 OE2 GLU A 133 -11.009 12.687 -11.698 1.00 0.00 O ATOM 0 H GLU A 133 -9.207 14.160 -8.293 1.00 0.00 H new ATOM 0 HA GLU A 133 -11.403 14.585 -6.630 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -12.289 12.566 -8.210 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -12.105 14.211 -8.787 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -9.925 13.732 -9.740 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -9.837 12.181 -8.928 1.00 0.00 H new ATOM 2180 N GLY A 134 -10.488 11.403 -6.535 1.00 0.00 N ATOM 2181 CA GLY A 134 -10.492 10.226 -5.682 1.00 0.00 C ATOM 2182 C GLY A 134 -9.493 10.378 -4.547 1.00 0.00 C ATOM 2183 O GLY A 134 -9.833 10.211 -3.378 1.00 0.00 O ATOM 0 H GLY A 134 -10.130 11.246 -7.477 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -11.491 10.070 -5.275 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -10.247 9.343 -6.272 1.00 0.00 H new ATOM 2187 N LEU A 135 -8.261 10.701 -4.909 1.00 0.00 N ATOM 2188 CA LEU A 135 -7.202 10.881 -3.924 1.00 0.00 C ATOM 2189 C LEU A 135 -7.762 11.515 -2.654 1.00 0.00 C ATOM 2190 O LEU A 135 -7.749 10.914 -1.582 1.00 0.00 O ATOM 2191 CB LEU A 135 -6.110 11.787 -4.523 1.00 0.00 C ATOM 2192 CG LEU A 135 -4.726 11.151 -4.347 1.00 0.00 C ATOM 2193 CD1 LEU A 135 -3.683 12.003 -5.078 1.00 0.00 C ATOM 2194 CD2 LEU A 135 -4.376 11.080 -2.853 1.00 0.00 C ATOM 0 H LEU A 135 -7.969 10.844 -5.876 1.00 0.00 H new ATOM 0 HA LEU A 135 -6.778 9.910 -3.668 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -6.308 11.953 -5.582 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -6.132 12.763 -4.038 1.00 0.00 H new ATOM 0 HG LEU A 135 -4.732 10.143 -4.762 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -2.697 11.555 -4.956 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -3.931 12.051 -6.138 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -3.678 13.010 -4.660 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -3.392 10.628 -2.731 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -4.368 12.086 -2.433 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -5.120 10.476 -2.333 1.00 0.00 H new ATOM 2206 N ARG A 136 -8.236 12.742 -2.792 1.00 0.00 N ATOM 2207 CA ARG A 136 -8.787 13.475 -1.674 1.00 0.00 C ATOM 2208 C ARG A 136 -9.998 12.761 -1.069 1.00 0.00 C ATOM 2209 O ARG A 136 -10.277 12.900 0.122 1.00 0.00 O ATOM 2210 CB ARG A 136 -9.195 14.873 -2.149 1.00 0.00 C ATOM 2211 CG ARG A 136 -9.757 15.675 -0.971 1.00 0.00 C ATOM 2212 CD ARG A 136 -11.289 15.651 -1.003 1.00 0.00 C ATOM 2213 NE ARG A 136 -11.829 15.880 0.332 1.00 0.00 N ATOM 2214 CZ ARG A 136 -13.137 15.835 0.558 1.00 0.00 C ATOM 2215 NH1 ARG A 136 -13.960 15.583 -0.423 1.00 0.00 N ATOM 2216 NH2 ARG A 136 -13.600 16.043 1.760 1.00 0.00 N ATOM 0 H ARG A 136 -8.248 13.251 -3.676 1.00 0.00 H new ATOM 0 HA ARG A 136 -8.024 13.544 -0.898 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -8.334 15.389 -2.575 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -9.943 14.796 -2.938 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -9.398 15.256 -0.031 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -9.400 16.704 -1.018 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -11.657 16.416 -1.687 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -11.636 14.690 -1.383 1.00 0.00 H new ATOM 0 HE ARG A 136 -11.192 16.078 1.104 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -13.599 15.421 -1.363 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -14.965 15.548 -0.250 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -12.957 16.240 2.527 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -14.605 16.008 1.933 1.00 0.00 H new ATOM 2230 N THR A 137 -10.728 12.020 -1.896 1.00 0.00 N ATOM 2231 CA THR A 137 -11.921 11.323 -1.426 1.00 0.00 C ATOM 2232 C THR A 137 -11.578 10.062 -0.618 1.00 0.00 C ATOM 2233 O THR A 137 -12.043 9.930 0.497 1.00 0.00 O ATOM 2234 CB THR A 137 -12.836 11.052 -2.636 1.00 0.00 C ATOM 2235 OG1 THR A 137 -13.943 11.939 -2.588 1.00 0.00 O ATOM 2236 CG2 THR A 137 -13.350 9.622 -2.656 1.00 0.00 C ATOM 0 H THR A 137 -10.518 11.887 -2.885 1.00 0.00 H new ATOM 0 HA THR A 137 -12.463 11.953 -0.721 1.00 0.00 H new ATOM 0 HB THR A 137 -12.248 11.209 -3.540 1.00 0.00 H new ATOM 0 HG1 THR A 137 -14.529 11.773 -3.356 1.00 0.00 H new ATOM 0 HG21 THR A 137 -13.990 9.478 -3.526 1.00 0.00 H new ATOM 0 HG22 THR A 137 -12.507 8.933 -2.708 1.00 0.00 H new ATOM 0 HG23 THR A 137 -13.922 9.428 -1.749 1.00 0.00 H new ATOM 2244 N LEU A 138 -10.771 9.145 -1.141 1.00 0.00 N ATOM 2245 CA LEU A 138 -10.436 7.939 -0.363 1.00 0.00 C ATOM 2246 C LEU A 138 -9.524 8.273 0.820 1.00 0.00 C ATOM 2247 O LEU A 138 -9.465 7.519 1.791 1.00 0.00 O ATOM 2248 CB LEU A 138 -9.833 6.846 -1.285 1.00 0.00 C ATOM 2249 CG LEU A 138 -8.370 6.603 -0.966 1.00 0.00 C ATOM 2250 CD1 LEU A 138 -7.791 5.523 -1.904 1.00 0.00 C ATOM 2251 CD2 LEU A 138 -7.583 7.919 -1.124 1.00 0.00 C ATOM 0 H LEU A 138 -10.345 9.200 -2.066 1.00 0.00 H new ATOM 0 HA LEU A 138 -11.356 7.536 0.061 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -10.392 5.918 -1.167 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -9.935 7.149 -2.327 1.00 0.00 H new ATOM 0 HG LEU A 138 -8.282 6.252 0.062 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -6.740 5.358 -1.664 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -8.343 4.593 -1.772 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -7.880 5.854 -2.939 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -6.532 7.744 -0.895 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -7.676 8.278 -2.149 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -7.984 8.667 -0.440 1.00 0.00 H new ATOM 2263 N ALA A 139 -8.819 9.392 0.743 1.00 0.00 N ATOM 2264 CA ALA A 139 -7.930 9.777 1.827 1.00 0.00 C ATOM 2265 C ALA A 139 -8.738 10.390 2.964 1.00 0.00 C ATOM 2266 O ALA A 139 -8.432 10.187 4.139 1.00 0.00 O ATOM 2267 CB ALA A 139 -6.889 10.777 1.325 1.00 0.00 C ATOM 0 H ALA A 139 -8.844 10.039 -0.045 1.00 0.00 H new ATOM 0 HA ALA A 139 -7.414 8.890 2.194 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -6.229 11.058 2.146 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -6.302 10.322 0.527 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -7.392 11.666 0.944 1.00 0.00 H new ATOM 2273 N GLU A 140 -9.772 11.139 2.601 1.00 0.00 N ATOM 2274 CA GLU A 140 -10.627 11.781 3.584 1.00 0.00 C ATOM 2275 C GLU A 140 -11.822 10.924 3.918 1.00 0.00 C ATOM 2276 O GLU A 140 -12.281 10.885 5.059 1.00 0.00 O ATOM 2277 CB GLU A 140 -11.131 13.092 3.017 1.00 0.00 C ATOM 2278 CG GLU A 140 -9.969 14.066 2.899 1.00 0.00 C ATOM 2279 CD GLU A 140 -9.709 14.737 4.244 1.00 0.00 C ATOM 2280 OE1 GLU A 140 -10.558 15.500 4.677 1.00 0.00 O ATOM 2281 OE2 GLU A 140 -8.666 14.480 4.820 1.00 0.00 O ATOM 0 H GLU A 140 -10.037 11.315 1.632 1.00 0.00 H new ATOM 0 HA GLU A 140 -10.041 11.939 4.490 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -11.585 12.929 2.039 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -11.905 13.507 3.662 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -9.074 13.539 2.568 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -10.192 14.820 2.144 1.00 0.00 H new ATOM 2288 N ALA A 141 -12.338 10.265 2.907 1.00 0.00 N ATOM 2289 CA ALA A 141 -13.504 9.435 3.090 1.00 0.00 C ATOM 2290 C ALA A 141 -13.276 8.436 4.209 1.00 0.00 C ATOM 2291 O ALA A 141 -14.228 8.015 4.866 1.00 0.00 O ATOM 2292 CB ALA A 141 -13.874 8.728 1.792 1.00 0.00 C ATOM 0 H ALA A 141 -11.971 10.287 1.955 1.00 0.00 H new ATOM 0 HA ALA A 141 -14.340 10.075 3.372 1.00 0.00 H new ATOM 0 HB1 ALA A 141 -14.756 8.108 1.954 1.00 0.00 H new ATOM 0 HB2 ALA A 141 -14.088 9.469 1.022 1.00 0.00 H new ATOM 0 HB3 ALA A 141 -13.043 8.100 1.470 1.00 0.00 H new ATOM 2298 N GLY A 142 -12.018 8.076 4.465 1.00 0.00 N ATOM 2299 CA GLY A 142 -11.762 7.153 5.565 1.00 0.00 C ATOM 2300 C GLY A 142 -10.444 6.396 5.452 1.00 0.00 C ATOM 2301 O GLY A 142 -10.054 5.714 6.401 1.00 0.00 O ATOM 0 H GLY A 142 -11.196 8.393 3.951 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -11.768 7.711 6.501 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -12.578 6.433 5.617 1.00 0.00 H new ATOM 2305 N ALA A 143 -9.739 6.497 4.328 1.00 0.00 N ATOM 2306 CA ALA A 143 -8.468 5.777 4.224 1.00 0.00 C ATOM 2307 C ALA A 143 -7.321 6.660 4.700 1.00 0.00 C ATOM 2308 O ALA A 143 -7.059 7.718 4.129 1.00 0.00 O ATOM 2309 CB ALA A 143 -8.218 5.301 2.792 1.00 0.00 C ATOM 0 H ALA A 143 -10.007 7.043 3.509 1.00 0.00 H new ATOM 0 HA ALA A 143 -8.524 4.897 4.864 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -7.267 4.770 2.746 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -9.022 4.632 2.485 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -8.186 6.161 2.123 1.00 0.00 H new ATOM 2315 N LYS A 144 -6.654 6.222 5.769 1.00 0.00 N ATOM 2316 CA LYS A 144 -5.550 6.976 6.332 1.00 0.00 C ATOM 2317 C LYS A 144 -4.275 6.777 5.528 1.00 0.00 C ATOM 2318 O LYS A 144 -3.663 5.710 5.564 1.00 0.00 O ATOM 2319 CB LYS A 144 -5.317 6.534 7.756 1.00 0.00 C ATOM 2320 CG LYS A 144 -6.541 6.923 8.582 1.00 0.00 C ATOM 2321 CD LYS A 144 -6.522 6.174 9.896 1.00 0.00 C ATOM 2322 CE LYS A 144 -7.911 6.217 10.538 1.00 0.00 C ATOM 2323 NZ LYS A 144 -8.821 5.282 9.818 1.00 0.00 N ATOM 0 H LYS A 144 -6.864 5.351 6.256 1.00 0.00 H new ATOM 0 HA LYS A 144 -5.810 8.034 6.302 1.00 0.00 H new ATOM 0 HB2 LYS A 144 -5.156 5.457 7.798 1.00 0.00 H new ATOM 0 HB3 LYS A 144 -4.421 7.006 8.159 1.00 0.00 H new ATOM 0 HG2 LYS A 144 -6.544 7.998 8.764 1.00 0.00 H new ATOM 0 HG3 LYS A 144 -7.453 6.691 8.032 1.00 0.00 H new ATOM 0 HD2 LYS A 144 -6.219 5.140 9.731 1.00 0.00 H new ATOM 0 HD3 LYS A 144 -5.787 6.618 10.568 1.00 0.00 H new ATOM 0 HE2 LYS A 144 -7.846 5.940 11.590 1.00 0.00 H new ATOM 0 HE3 LYS A 144 -8.310 7.231 10.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 -9.632 5.049 10.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 -9.161 5.733 8.945 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 -8.306 4.411 9.580 1.00 0.00 H new ATOM 2337 N ILE A 145 -3.885 7.813 4.802 1.00 0.00 N ATOM 2338 CA ILE A 145 -2.686 7.755 3.983 1.00 0.00 C ATOM 2339 C ILE A 145 -1.504 8.363 4.734 1.00 0.00 C ATOM 2340 O ILE A 145 -1.673 9.288 5.528 1.00 0.00 O ATOM 2341 CB ILE A 145 -2.911 8.535 2.684 1.00 0.00 C ATOM 2342 CG1 ILE A 145 -4.391 8.517 2.299 1.00 0.00 C ATOM 2343 CG2 ILE A 145 -2.096 7.917 1.553 1.00 0.00 C ATOM 2344 CD1 ILE A 145 -4.910 7.075 2.244 1.00 0.00 C ATOM 0 H ILE A 145 -4.381 8.703 4.764 1.00 0.00 H new ATOM 0 HA ILE A 145 -2.468 6.712 3.755 1.00 0.00 H new ATOM 0 HB ILE A 145 -2.593 9.565 2.846 1.00 0.00 H new ATOM 0 HG12 ILE A 145 -4.969 9.091 3.023 1.00 0.00 H new ATOM 0 HG13 ILE A 145 -4.527 8.997 1.330 1.00 0.00 H new ATOM 0 HG21 ILE A 145 -2.264 8.479 0.634 1.00 0.00 H new ATOM 0 HG22 ILE A 145 -1.037 7.947 1.809 1.00 0.00 H new ATOM 0 HG23 ILE A 145 -2.404 6.882 1.406 1.00 0.00 H new ATOM 0 HD11 ILE A 145 -5.965 7.078 1.969 1.00 0.00 H new ATOM 0 HD12 ILE A 145 -4.343 6.512 1.502 1.00 0.00 H new ATOM 0 HD13 ILE A 145 -4.792 6.608 3.222 1.00 0.00 H new ATOM 2356 N SER A 146 -0.308 7.846 4.474 1.00 0.00 N ATOM 2357 CA SER A 146 0.887 8.356 5.123 1.00 0.00 C ATOM 2358 C SER A 146 2.053 8.399 4.141 1.00 0.00 C ATOM 2359 O SER A 146 2.300 7.446 3.403 1.00 0.00 O ATOM 2360 CB SER A 146 1.240 7.471 6.320 1.00 0.00 C ATOM 2361 OG SER A 146 0.518 6.251 6.229 1.00 0.00 O ATOM 0 H SER A 146 -0.144 7.079 3.822 1.00 0.00 H new ATOM 0 HA SER A 146 0.693 9.371 5.470 1.00 0.00 H new ATOM 0 HB2 SER A 146 2.312 7.273 6.337 1.00 0.00 H new ATOM 0 HB3 SER A 146 0.996 7.983 7.251 1.00 0.00 H new ATOM 0 HG SER A 146 0.710 5.820 5.370 1.00 0.00 H new ATOM 2367 N ILE A 147 2.768 9.513 4.156 1.00 0.00 N ATOM 2368 CA ILE A 147 3.915 9.685 3.285 1.00 0.00 C ATOM 2369 C ILE A 147 5.144 9.103 3.974 1.00 0.00 C ATOM 2370 O ILE A 147 5.688 9.690 4.909 1.00 0.00 O ATOM 2371 CB ILE A 147 4.140 11.179 2.976 1.00 0.00 C ATOM 2372 CG1 ILE A 147 2.928 11.842 2.236 1.00 0.00 C ATOM 2373 CG2 ILE A 147 5.402 11.334 2.111 1.00 0.00 C ATOM 2374 CD1 ILE A 147 1.732 10.898 2.041 1.00 0.00 C ATOM 0 H ILE A 147 2.573 10.310 4.762 1.00 0.00 H new ATOM 0 HA ILE A 147 3.737 9.167 2.343 1.00 0.00 H new ATOM 0 HB ILE A 147 4.253 11.689 3.933 1.00 0.00 H new ATOM 0 HG12 ILE A 147 2.602 12.715 2.801 1.00 0.00 H new ATOM 0 HG13 ILE A 147 3.260 12.199 1.261 1.00 0.00 H new ATOM 0 HG21 ILE A 147 5.565 12.389 1.890 1.00 0.00 H new ATOM 0 HG22 ILE A 147 6.263 10.939 2.650 1.00 0.00 H new ATOM 0 HG23 ILE A 147 5.274 10.784 1.179 1.00 0.00 H new ATOM 0 HD11 ILE A 147 0.932 11.426 1.522 1.00 0.00 H new ATOM 0 HD12 ILE A 147 2.041 10.036 1.449 1.00 0.00 H new ATOM 0 HD13 ILE A 147 1.373 10.560 3.013 1.00 0.00 H new ATOM 2386 N MET A 148 5.552 7.926 3.514 1.00 0.00 N ATOM 2387 CA MET A 148 6.694 7.231 4.094 1.00 0.00 C ATOM 2388 C MET A 148 7.996 7.994 3.867 1.00 0.00 C ATOM 2389 O MET A 148 8.672 7.802 2.856 1.00 0.00 O ATOM 2390 CB MET A 148 6.804 5.831 3.484 1.00 0.00 C ATOM 2391 CG MET A 148 7.536 4.891 4.445 1.00 0.00 C ATOM 2392 SD MET A 148 8.490 3.697 3.474 1.00 0.00 S ATOM 2393 CE MET A 148 7.083 2.830 2.736 1.00 0.00 C ATOM 0 H MET A 148 5.108 7.433 2.740 1.00 0.00 H new ATOM 0 HA MET A 148 6.533 7.160 5.170 1.00 0.00 H new ATOM 0 HB2 MET A 148 5.809 5.441 3.270 1.00 0.00 H new ATOM 0 HB3 MET A 148 7.338 5.881 2.535 1.00 0.00 H new ATOM 0 HG2 MET A 148 8.196 5.459 5.100 1.00 0.00 H new ATOM 0 HG3 MET A 148 6.821 4.373 5.085 1.00 0.00 H new ATOM 0 HE1 MET A 148 7.418 1.878 2.323 1.00 0.00 H new ATOM 0 HE2 MET A 148 6.327 2.648 3.499 1.00 0.00 H new ATOM 0 HE3 MET A 148 6.656 3.441 1.940 1.00 0.00 H new ATOM 2403 N THR A 149 8.352 8.843 4.828 1.00 0.00 N ATOM 2404 CA THR A 149 9.590 9.612 4.737 1.00 0.00 C ATOM 2405 C THR A 149 10.698 8.873 5.482 1.00 0.00 C ATOM 2406 O THR A 149 10.447 7.837 6.082 1.00 0.00 O ATOM 2407 CB THR A 149 9.390 11.008 5.343 1.00 0.00 C ATOM 2408 OG1 THR A 149 8.426 10.934 6.384 1.00 0.00 O ATOM 2409 CG2 THR A 149 8.903 11.984 4.265 1.00 0.00 C ATOM 0 H THR A 149 7.806 9.015 5.672 1.00 0.00 H new ATOM 0 HA THR A 149 9.869 9.724 3.689 1.00 0.00 H new ATOM 0 HB THR A 149 10.339 11.364 5.743 1.00 0.00 H new ATOM 0 HG1 THR A 149 7.526 10.943 5.997 1.00 0.00 H new ATOM 0 HG21 THR A 149 8.764 12.972 4.704 1.00 0.00 H new ATOM 0 HG22 THR A 149 9.643 12.043 3.467 1.00 0.00 H new ATOM 0 HG23 THR A 149 7.956 11.632 3.857 1.00 0.00 H new ATOM 2417 N TYR A 150 11.917 9.405 5.433 1.00 0.00 N ATOM 2418 CA TYR A 150 13.052 8.772 6.101 1.00 0.00 C ATOM 2419 C TYR A 150 12.622 8.030 7.366 1.00 0.00 C ATOM 2420 O TYR A 150 12.861 6.830 7.499 1.00 0.00 O ATOM 2421 CB TYR A 150 14.093 9.834 6.459 1.00 0.00 C ATOM 2422 CG TYR A 150 13.413 10.997 7.135 1.00 0.00 C ATOM 2423 CD1 TYR A 150 12.892 12.044 6.366 1.00 0.00 C ATOM 2424 CD2 TYR A 150 13.305 11.030 8.529 1.00 0.00 C ATOM 2425 CE1 TYR A 150 12.261 13.126 6.993 1.00 0.00 C ATOM 2426 CE2 TYR A 150 12.675 12.110 9.157 1.00 0.00 C ATOM 2427 CZ TYR A 150 12.152 13.158 8.389 1.00 0.00 C ATOM 2428 OH TYR A 150 11.529 14.224 9.008 1.00 0.00 O ATOM 0 H TYR A 150 12.144 10.269 4.940 1.00 0.00 H new ATOM 0 HA TYR A 150 13.481 8.043 5.414 1.00 0.00 H new ATOM 0 HB2 TYR A 150 14.850 9.409 7.118 1.00 0.00 H new ATOM 0 HB3 TYR A 150 14.607 10.172 5.559 1.00 0.00 H new ATOM 0 HD1 TYR A 150 12.976 12.018 5.290 1.00 0.00 H new ATOM 0 HD2 TYR A 150 13.708 10.222 9.121 1.00 0.00 H new ATOM 0 HE1 TYR A 150 11.859 13.935 6.401 1.00 0.00 H new ATOM 0 HE2 TYR A 150 12.592 12.136 10.234 1.00 0.00 H new ATOM 0 HH TYR A 150 11.538 14.089 9.979 1.00 0.00 H new ATOM 2438 N SER A 151 11.997 8.743 8.296 1.00 0.00 N ATOM 2439 CA SER A 151 11.553 8.129 9.541 1.00 0.00 C ATOM 2440 C SER A 151 10.732 6.873 9.263 1.00 0.00 C ATOM 2441 O SER A 151 11.163 5.751 9.546 1.00 0.00 O ATOM 2442 CB SER A 151 10.712 9.127 10.335 1.00 0.00 C ATOM 2443 OG SER A 151 11.572 10.053 10.985 1.00 0.00 O ATOM 0 H SER A 151 11.788 9.738 8.213 1.00 0.00 H new ATOM 0 HA SER A 151 12.432 7.847 10.120 1.00 0.00 H new ATOM 0 HB2 SER A 151 10.028 9.654 9.670 1.00 0.00 H new ATOM 0 HB3 SER A 151 10.102 8.602 11.070 1.00 0.00 H new ATOM 0 HG SER A 151 12.236 10.387 10.346 1.00 0.00 H new ATOM 2449 N GLU A 152 9.548 7.071 8.700 1.00 0.00 N ATOM 2450 CA GLU A 152 8.668 5.956 8.381 1.00 0.00 C ATOM 2451 C GLU A 152 9.395 4.938 7.515 1.00 0.00 C ATOM 2452 O GLU A 152 9.092 3.748 7.561 1.00 0.00 O ATOM 2453 CB GLU A 152 7.425 6.471 7.651 1.00 0.00 C ATOM 2454 CG GLU A 152 6.358 6.875 8.672 1.00 0.00 C ATOM 2455 CD GLU A 152 6.984 7.725 9.772 1.00 0.00 C ATOM 2456 OE1 GLU A 152 7.719 8.641 9.439 1.00 0.00 O ATOM 2457 OE2 GLU A 152 6.720 7.449 10.930 1.00 0.00 O ATOM 0 H GLU A 152 9.176 7.989 8.456 1.00 0.00 H new ATOM 0 HA GLU A 152 8.365 5.470 9.308 1.00 0.00 H new ATOM 0 HB2 GLU A 152 7.686 7.325 7.026 1.00 0.00 H new ATOM 0 HB3 GLU A 152 7.034 5.699 6.988 1.00 0.00 H new ATOM 0 HG2 GLU A 152 5.563 7.433 8.178 1.00 0.00 H new ATOM 0 HG3 GLU A 152 5.901 5.985 9.104 1.00 0.00 H new ATOM 2464 N PHE A 153 10.361 5.413 6.736 1.00 0.00 N ATOM 2465 CA PHE A 153 11.129 4.536 5.867 1.00 0.00 C ATOM 2466 C PHE A 153 11.777 3.431 6.691 1.00 0.00 C ATOM 2467 O PHE A 153 11.436 2.255 6.560 1.00 0.00 O ATOM 2468 CB PHE A 153 12.207 5.345 5.118 1.00 0.00 C ATOM 2469 CG PHE A 153 12.270 4.891 3.678 1.00 0.00 C ATOM 2470 CD1 PHE A 153 12.988 3.740 3.341 1.00 0.00 C ATOM 2471 CD2 PHE A 153 11.601 5.616 2.688 1.00 0.00 C ATOM 2472 CE1 PHE A 153 13.037 3.311 2.010 1.00 0.00 C ATOM 2473 CE2 PHE A 153 11.650 5.190 1.355 1.00 0.00 C ATOM 2474 CZ PHE A 153 12.368 4.035 1.017 1.00 0.00 C ATOM 0 H PHE A 153 10.628 6.396 6.690 1.00 0.00 H new ATOM 0 HA PHE A 153 10.460 4.085 5.134 1.00 0.00 H new ATOM 0 HB2 PHE A 153 11.976 6.409 5.165 1.00 0.00 H new ATOM 0 HB3 PHE A 153 13.177 5.208 5.596 1.00 0.00 H new ATOM 0 HD1 PHE A 153 13.505 3.182 4.108 1.00 0.00 H new ATOM 0 HD2 PHE A 153 11.046 6.505 2.951 1.00 0.00 H new ATOM 0 HE1 PHE A 153 13.591 2.421 1.749 1.00 0.00 H new ATOM 0 HE2 PHE A 153 11.135 5.751 0.589 1.00 0.00 H new ATOM 0 HZ PHE A 153 12.405 3.704 -0.010 1.00 0.00 H new ATOM 2484 N LYS A 154 12.710 3.822 7.543 1.00 0.00 N ATOM 2485 CA LYS A 154 13.400 2.863 8.393 1.00 0.00 C ATOM 2486 C LYS A 154 12.398 1.925 9.045 1.00 0.00 C ATOM 2487 O LYS A 154 12.666 0.736 9.228 1.00 0.00 O ATOM 2488 CB LYS A 154 14.194 3.595 9.479 1.00 0.00 C ATOM 2489 CG LYS A 154 15.062 4.703 8.848 1.00 0.00 C ATOM 2490 CD LYS A 154 15.002 5.978 9.696 1.00 0.00 C ATOM 2491 CE LYS A 154 15.792 5.769 10.989 1.00 0.00 C ATOM 2492 NZ LYS A 154 15.557 6.919 11.907 1.00 0.00 N ATOM 0 H LYS A 154 13.007 4.790 7.665 1.00 0.00 H new ATOM 0 HA LYS A 154 14.086 2.284 7.775 1.00 0.00 H new ATOM 0 HB2 LYS A 154 13.511 4.029 10.209 1.00 0.00 H new ATOM 0 HB3 LYS A 154 14.827 2.888 10.016 1.00 0.00 H new ATOM 0 HG2 LYS A 154 16.094 4.362 8.765 1.00 0.00 H new ATOM 0 HG3 LYS A 154 14.714 4.915 7.837 1.00 0.00 H new ATOM 0 HD2 LYS A 154 15.414 6.819 9.138 1.00 0.00 H new ATOM 0 HD3 LYS A 154 13.966 6.226 9.926 1.00 0.00 H new ATOM 0 HE2 LYS A 154 15.486 4.839 11.468 1.00 0.00 H new ATOM 0 HE3 LYS A 154 16.855 5.678 10.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 16.094 6.777 12.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 15.870 7.799 11.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 14.543 6.985 12.128 1.00 0.00 H new ATOM 2506 N HIS A 155 11.241 2.469 9.384 1.00 0.00 N ATOM 2507 CA HIS A 155 10.194 1.679 10.008 1.00 0.00 C ATOM 2508 C HIS A 155 9.513 0.815 8.959 1.00 0.00 C ATOM 2509 O HIS A 155 8.879 -0.193 9.268 1.00 0.00 O ATOM 2510 CB HIS A 155 9.174 2.624 10.642 1.00 0.00 C ATOM 2511 CG HIS A 155 8.555 1.979 11.854 1.00 0.00 C ATOM 2512 ND1 HIS A 155 8.954 2.296 13.143 1.00 0.00 N ATOM 2513 CD2 HIS A 155 7.567 1.034 11.987 1.00 0.00 C ATOM 2514 CE1 HIS A 155 8.216 1.553 13.989 1.00 0.00 C ATOM 2515 NE2 HIS A 155 7.355 0.767 13.336 1.00 0.00 N ATOM 0 H HIS A 155 11.004 3.450 9.238 1.00 0.00 H new ATOM 0 HA HIS A 155 10.623 1.033 10.774 1.00 0.00 H new ATOM 0 HB2 HIS A 155 9.659 3.558 10.925 1.00 0.00 H new ATOM 0 HB3 HIS A 155 8.399 2.874 9.918 1.00 0.00 H new ATOM 0 HD2 HIS A 155 7.036 0.569 11.169 1.00 0.00 H new ATOM 0 HE1 HIS A 155 8.309 1.588 15.064 1.00 0.00 H new ATOM 0 HE2 HIS A 155 6.686 0.112 13.740 1.00 0.00 H new ATOM 2524 N CYS A 156 9.643 1.250 7.716 1.00 0.00 N ATOM 2525 CA CYS A 156 9.031 0.554 6.591 1.00 0.00 C ATOM 2526 C CYS A 156 9.743 -0.759 6.263 1.00 0.00 C ATOM 2527 O CYS A 156 9.082 -1.754 5.964 1.00 0.00 O ATOM 2528 CB CYS A 156 9.021 1.474 5.371 1.00 0.00 C ATOM 2529 SG CYS A 156 10.494 1.196 4.350 1.00 0.00 S ATOM 0 H CYS A 156 10.169 2.085 7.458 1.00 0.00 H new ATOM 0 HA CYS A 156 8.009 0.297 6.871 1.00 0.00 H new ATOM 0 HB2 CYS A 156 8.123 1.294 4.780 1.00 0.00 H new ATOM 0 HB3 CYS A 156 8.987 2.515 5.694 1.00 0.00 H new ATOM 0 HG CYS A 156 11.553 1.573 5.004 1.00 0.00 H new ATOM 2535 N TRP A 157 11.080 -0.787 6.321 1.00 0.00 N ATOM 2536 CA TRP A 157 11.778 -2.028 6.023 1.00 0.00 C ATOM 2537 C TRP A 157 11.791 -2.885 7.266 1.00 0.00 C ATOM 2538 O TRP A 157 11.603 -4.099 7.209 1.00 0.00 O ATOM 2539 CB TRP A 157 13.205 -1.790 5.481 1.00 0.00 C ATOM 2540 CG TRP A 157 14.126 -1.171 6.491 1.00 0.00 C ATOM 2541 CD1 TRP A 157 14.528 -1.750 7.647 1.00 0.00 C ATOM 2542 CD2 TRP A 157 14.820 0.113 6.420 1.00 0.00 C ATOM 2543 NE1 TRP A 157 15.414 -0.899 8.286 1.00 0.00 N ATOM 2544 CE2 TRP A 157 15.620 0.258 7.576 1.00 0.00 C ATOM 2545 CE3 TRP A 157 14.827 1.159 5.479 1.00 0.00 C ATOM 2546 CZ2 TRP A 157 16.402 1.391 7.796 1.00 0.00 C ATOM 2547 CZ3 TRP A 157 15.614 2.306 5.695 1.00 0.00 C ATOM 2548 CH2 TRP A 157 16.401 2.422 6.851 1.00 0.00 C ATOM 0 H TRP A 157 11.675 0.006 6.562 1.00 0.00 H new ATOM 0 HA TRP A 157 11.245 -2.546 5.225 1.00 0.00 H new ATOM 0 HB2 TRP A 157 13.624 -2.740 5.151 1.00 0.00 H new ATOM 0 HB3 TRP A 157 13.151 -1.144 4.605 1.00 0.00 H new ATOM 0 HD1 TRP A 157 14.210 -2.716 8.011 1.00 0.00 H new ATOM 0 HE1 TRP A 157 15.861 -1.107 9.179 1.00 0.00 H new ATOM 0 HE3 TRP A 157 14.225 1.081 4.586 1.00 0.00 H new ATOM 0 HZ2 TRP A 157 17.004 1.472 8.689 1.00 0.00 H new ATOM 0 HZ3 TRP A 157 15.612 3.103 4.966 1.00 0.00 H new ATOM 0 HH2 TRP A 157 17.004 3.304 7.010 1.00 0.00 H new ATOM 2559 N ASP A 158 11.961 -2.231 8.394 1.00 0.00 N ATOM 2560 CA ASP A 158 11.944 -2.918 9.666 1.00 0.00 C ATOM 2561 C ASP A 158 10.650 -3.720 9.786 1.00 0.00 C ATOM 2562 O ASP A 158 10.579 -4.719 10.502 1.00 0.00 O ATOM 2563 CB ASP A 158 12.018 -1.870 10.773 1.00 0.00 C ATOM 2564 CG ASP A 158 11.823 -2.513 12.144 1.00 0.00 C ATOM 2565 OD1 ASP A 158 10.902 -3.301 12.284 1.00 0.00 O ATOM 2566 OD2 ASP A 158 12.595 -2.203 13.036 1.00 0.00 O ATOM 0 H ASP A 158 12.113 -1.224 8.456 1.00 0.00 H new ATOM 0 HA ASP A 158 12.789 -3.602 9.747 1.00 0.00 H new ATOM 0 HB2 ASP A 158 12.983 -1.365 10.737 1.00 0.00 H new ATOM 0 HB3 ASP A 158 11.254 -1.109 10.611 1.00 0.00 H new ATOM 2571 N THR A 159 9.625 -3.253 9.076 1.00 0.00 N ATOM 2572 CA THR A 159 8.313 -3.897 9.089 1.00 0.00 C ATOM 2573 C THR A 159 8.146 -4.870 7.919 1.00 0.00 C ATOM 2574 O THR A 159 7.620 -5.971 8.087 1.00 0.00 O ATOM 2575 CB THR A 159 7.221 -2.814 9.034 1.00 0.00 C ATOM 2576 OG1 THR A 159 7.043 -2.265 10.332 1.00 0.00 O ATOM 2577 CG2 THR A 159 5.891 -3.405 8.549 1.00 0.00 C ATOM 0 H THR A 159 9.679 -2.426 8.481 1.00 0.00 H new ATOM 0 HA THR A 159 8.223 -4.475 10.009 1.00 0.00 H new ATOM 0 HB THR A 159 7.533 -2.038 8.335 1.00 0.00 H new ATOM 0 HG1 THR A 159 7.565 -1.439 10.412 1.00 0.00 H new ATOM 0 HG21 THR A 159 5.134 -2.621 8.518 1.00 0.00 H new ATOM 0 HG22 THR A 159 6.021 -3.823 7.551 1.00 0.00 H new ATOM 0 HG23 THR A 159 5.571 -4.191 9.233 1.00 0.00 H new ATOM 2585 N PHE A 160 8.563 -4.442 6.731 1.00 0.00 N ATOM 2586 CA PHE A 160 8.420 -5.262 5.533 1.00 0.00 C ATOM 2587 C PHE A 160 9.556 -6.277 5.393 1.00 0.00 C ATOM 2588 O PHE A 160 9.323 -7.427 5.022 1.00 0.00 O ATOM 2589 CB PHE A 160 8.381 -4.339 4.306 1.00 0.00 C ATOM 2590 CG PHE A 160 8.708 -5.114 3.051 1.00 0.00 C ATOM 2591 CD1 PHE A 160 7.822 -6.086 2.577 1.00 0.00 C ATOM 2592 CD2 PHE A 160 9.897 -4.851 2.361 1.00 0.00 C ATOM 2593 CE1 PHE A 160 8.126 -6.800 1.411 1.00 0.00 C ATOM 2594 CE2 PHE A 160 10.201 -5.564 1.195 1.00 0.00 C ATOM 2595 CZ PHE A 160 9.315 -6.538 0.719 1.00 0.00 C ATOM 0 H PHE A 160 9.001 -3.535 6.573 1.00 0.00 H new ATOM 0 HA PHE A 160 7.493 -5.830 5.612 1.00 0.00 H new ATOM 0 HB2 PHE A 160 7.393 -3.887 4.215 1.00 0.00 H new ATOM 0 HB3 PHE A 160 9.094 -3.524 4.434 1.00 0.00 H new ATOM 0 HD1 PHE A 160 6.904 -6.286 3.109 1.00 0.00 H new ATOM 0 HD2 PHE A 160 10.579 -4.099 2.728 1.00 0.00 H new ATOM 0 HE1 PHE A 160 7.443 -7.553 1.045 1.00 0.00 H new ATOM 0 HE2 PHE A 160 11.119 -5.363 0.663 1.00 0.00 H new ATOM 0 HZ PHE A 160 9.548 -7.087 -0.181 1.00 0.00 H new ATOM 2605 N VAL A 161 10.779 -5.846 5.665 1.00 0.00 N ATOM 2606 CA VAL A 161 11.926 -6.721 5.536 1.00 0.00 C ATOM 2607 C VAL A 161 12.050 -7.653 6.740 1.00 0.00 C ATOM 2608 O VAL A 161 11.712 -7.282 7.864 1.00 0.00 O ATOM 2609 CB VAL A 161 13.168 -5.856 5.377 1.00 0.00 C ATOM 2610 CG1 VAL A 161 14.394 -6.732 5.232 1.00 0.00 C ATOM 2611 CG2 VAL A 161 13.000 -4.998 4.123 1.00 0.00 C ATOM 0 H VAL A 161 10.998 -4.899 5.975 1.00 0.00 H new ATOM 0 HA VAL A 161 11.807 -7.359 4.660 1.00 0.00 H new ATOM 0 HB VAL A 161 13.294 -5.222 6.255 1.00 0.00 H new ATOM 0 HG11 VAL A 161 15.278 -6.105 5.119 1.00 0.00 H new ATOM 0 HG12 VAL A 161 14.503 -7.355 6.119 1.00 0.00 H new ATOM 0 HG13 VAL A 161 14.285 -7.368 4.353 1.00 0.00 H new ATOM 0 HG21 VAL A 161 13.881 -4.370 3.991 1.00 0.00 H new ATOM 0 HG22 VAL A 161 12.882 -5.644 3.253 1.00 0.00 H new ATOM 0 HG23 VAL A 161 12.117 -4.367 4.229 1.00 0.00 H new ATOM 2621 N ASP A 162 12.519 -8.876 6.486 1.00 0.00 N ATOM 2622 CA ASP A 162 12.664 -9.872 7.546 1.00 0.00 C ATOM 2623 C ASP A 162 13.766 -9.494 8.525 1.00 0.00 C ATOM 2624 O ASP A 162 14.405 -10.358 9.126 1.00 0.00 O ATOM 2625 CB ASP A 162 12.969 -11.241 6.939 1.00 0.00 C ATOM 2626 CG ASP A 162 12.509 -12.347 7.883 1.00 0.00 C ATOM 2627 OD1 ASP A 162 12.821 -12.262 9.059 1.00 0.00 O ATOM 2628 OD2 ASP A 162 11.852 -13.262 7.416 1.00 0.00 O ATOM 0 H ASP A 162 12.803 -9.198 5.561 1.00 0.00 H new ATOM 0 HA ASP A 162 11.722 -9.911 8.093 1.00 0.00 H new ATOM 0 HB2 ASP A 162 12.466 -11.341 5.977 1.00 0.00 H new ATOM 0 HB3 ASP A 162 14.039 -11.334 6.751 1.00 0.00 H new ATOM 2633 N HIS A 163 13.961 -8.202 8.694 1.00 0.00 N ATOM 2634 CA HIS A 163 14.964 -7.698 9.621 1.00 0.00 C ATOM 2635 C HIS A 163 14.542 -6.333 10.138 1.00 0.00 C ATOM 2636 O HIS A 163 14.421 -5.375 9.373 1.00 0.00 O ATOM 2637 CB HIS A 163 16.331 -7.587 8.943 1.00 0.00 C ATOM 2638 CG HIS A 163 16.515 -8.721 7.970 1.00 0.00 C ATOM 2639 ND1 HIS A 163 16.488 -8.530 6.597 1.00 0.00 N ATOM 2640 CD2 HIS A 163 16.741 -10.062 8.157 1.00 0.00 C ATOM 2641 CE1 HIS A 163 16.692 -9.727 6.017 1.00 0.00 C ATOM 2642 NE2 HIS A 163 16.852 -10.695 6.923 1.00 0.00 N ATOM 0 H HIS A 163 13.439 -7.477 8.202 1.00 0.00 H new ATOM 0 HA HIS A 163 15.046 -8.399 10.451 1.00 0.00 H new ATOM 0 HB2 HIS A 163 16.412 -6.633 8.422 1.00 0.00 H new ATOM 0 HB3 HIS A 163 17.121 -7.608 9.693 1.00 0.00 H new ATOM 0 HD2 HIS A 163 16.821 -10.551 9.116 1.00 0.00 H new ATOM 0 HE1 HIS A 163 16.723 -9.886 4.949 1.00 0.00 H new ATOM 0 HE2 HIS A 163 17.020 -11.686 6.748 1.00 0.00 H new ATOM 2651 N GLN A 164 14.307 -6.256 11.436 1.00 0.00 N ATOM 2652 CA GLN A 164 13.883 -5.012 12.054 1.00 0.00 C ATOM 2653 C GLN A 164 14.852 -3.880 11.725 1.00 0.00 C ATOM 2654 O GLN A 164 14.635 -2.735 12.120 1.00 0.00 O ATOM 2655 CB GLN A 164 13.797 -5.189 13.572 1.00 0.00 C ATOM 2656 CG GLN A 164 12.507 -5.931 13.936 1.00 0.00 C ATOM 2657 CD GLN A 164 12.293 -5.890 15.445 1.00 0.00 C ATOM 2658 OE1 GLN A 164 12.264 -4.813 16.041 1.00 0.00 O ATOM 2659 NE2 GLN A 164 12.140 -7.007 16.104 1.00 0.00 N ATOM 0 H GLN A 164 14.402 -7.039 12.082 1.00 0.00 H new ATOM 0 HA GLN A 164 12.901 -4.752 11.659 1.00 0.00 H new ATOM 0 HB2 GLN A 164 14.662 -5.746 13.932 1.00 0.00 H new ATOM 0 HB3 GLN A 164 13.818 -4.216 14.063 1.00 0.00 H new ATOM 0 HG2 GLN A 164 11.658 -5.474 13.427 1.00 0.00 H new ATOM 0 HG3 GLN A 164 12.564 -6.965 13.596 1.00 0.00 H new ATOM 0 HE21 GLN A 164 12.164 -7.899 15.609 1.00 0.00 H new ATOM 0 HE22 GLN A 164 11.996 -6.988 17.114 1.00 0.00 H new ATOM 2668 N GLY A 165 15.921 -4.201 11.003 1.00 0.00 N ATOM 2669 CA GLY A 165 16.902 -3.187 10.641 1.00 0.00 C ATOM 2670 C GLY A 165 17.876 -3.700 9.587 1.00 0.00 C ATOM 2671 O GLY A 165 19.090 -3.672 9.788 1.00 0.00 O ATOM 0 H GLY A 165 16.127 -5.140 10.662 1.00 0.00 H new ATOM 0 HA2 GLY A 165 16.389 -2.302 10.264 1.00 0.00 H new ATOM 0 HA3 GLY A 165 17.454 -2.881 11.529 1.00 0.00 H new ATOM 2675 N CYS A 166 17.343 -4.156 8.459 1.00 0.00 N ATOM 2676 CA CYS A 166 18.193 -4.656 7.384 1.00 0.00 C ATOM 2677 C CYS A 166 19.195 -3.571 6.980 1.00 0.00 C ATOM 2678 O CYS A 166 18.833 -2.398 6.934 1.00 0.00 O ATOM 2679 CB CYS A 166 17.336 -5.039 6.171 1.00 0.00 C ATOM 2680 SG CYS A 166 18.360 -5.053 4.676 1.00 0.00 S ATOM 0 H CYS A 166 16.342 -4.190 8.266 1.00 0.00 H new ATOM 0 HA CYS A 166 18.729 -5.538 7.734 1.00 0.00 H new ATOM 0 HB2 CYS A 166 16.889 -6.021 6.326 1.00 0.00 H new ATOM 0 HB3 CYS A 166 16.516 -4.330 6.055 1.00 0.00 H new ATOM 0 HG CYS A 166 17.629 -5.380 3.652 1.00 0.00 H new ATOM 2686 N PRO A 167 20.430 -3.924 6.687 1.00 0.00 N ATOM 2687 CA PRO A 167 21.471 -2.932 6.276 1.00 0.00 C ATOM 2688 C PRO A 167 20.925 -1.894 5.294 1.00 0.00 C ATOM 2689 O PRO A 167 21.174 -1.971 4.090 1.00 0.00 O ATOM 2690 CB PRO A 167 22.546 -3.795 5.614 1.00 0.00 C ATOM 2691 CG PRO A 167 22.426 -5.142 6.247 1.00 0.00 C ATOM 2692 CD PRO A 167 20.975 -5.295 6.716 1.00 0.00 C ATOM 0 HA PRO A 167 21.841 -2.352 7.121 1.00 0.00 H new ATOM 0 HB2 PRO A 167 22.393 -3.853 4.536 1.00 0.00 H new ATOM 0 HB3 PRO A 167 23.539 -3.374 5.773 1.00 0.00 H new ATOM 0 HG2 PRO A 167 22.685 -5.926 5.535 1.00 0.00 H new ATOM 0 HG3 PRO A 167 23.114 -5.235 7.088 1.00 0.00 H new ATOM 0 HD2 PRO A 167 20.414 -5.959 6.059 1.00 0.00 H new ATOM 0 HD3 PRO A 167 20.925 -5.721 7.718 1.00 0.00 H new ATOM 2700 N PHE A 168 20.172 -0.930 5.814 1.00 0.00 N ATOM 2701 CA PHE A 168 19.583 0.112 4.981 1.00 0.00 C ATOM 2702 C PHE A 168 19.941 1.496 5.518 1.00 0.00 C ATOM 2703 O PHE A 168 20.200 1.663 6.709 1.00 0.00 O ATOM 2704 CB PHE A 168 18.059 -0.055 4.958 1.00 0.00 C ATOM 2705 CG PHE A 168 17.504 0.417 3.633 1.00 0.00 C ATOM 2706 CD1 PHE A 168 17.365 1.786 3.380 1.00 0.00 C ATOM 2707 CD2 PHE A 168 17.128 -0.516 2.660 1.00 0.00 C ATOM 2708 CE1 PHE A 168 16.850 2.223 2.154 1.00 0.00 C ATOM 2709 CE2 PHE A 168 16.614 -0.080 1.433 1.00 0.00 C ATOM 2710 CZ PHE A 168 16.474 1.290 1.180 1.00 0.00 C ATOM 0 H PHE A 168 19.956 -0.849 6.807 1.00 0.00 H new ATOM 0 HA PHE A 168 19.979 0.020 3.970 1.00 0.00 H new ATOM 0 HB2 PHE A 168 17.798 -1.101 5.119 1.00 0.00 H new ATOM 0 HB3 PHE A 168 17.611 0.514 5.772 1.00 0.00 H new ATOM 0 HD1 PHE A 168 17.655 2.506 4.131 1.00 0.00 H new ATOM 0 HD2 PHE A 168 17.234 -1.573 2.856 1.00 0.00 H new ATOM 0 HE1 PHE A 168 16.743 3.280 1.959 1.00 0.00 H new ATOM 0 HE2 PHE A 168 16.326 -0.800 0.682 1.00 0.00 H new ATOM 0 HZ PHE A 168 16.076 1.627 0.234 1.00 0.00 H new ATOM 2720 N GLN A 169 19.947 2.484 4.630 1.00 0.00 N ATOM 2721 CA GLN A 169 20.267 3.850 5.023 1.00 0.00 C ATOM 2722 C GLN A 169 19.490 4.865 4.179 1.00 0.00 C ATOM 2723 O GLN A 169 19.033 4.551 3.079 1.00 0.00 O ATOM 2724 CB GLN A 169 21.774 4.092 4.885 1.00 0.00 C ATOM 2725 CG GLN A 169 22.430 4.005 6.261 1.00 0.00 C ATOM 2726 CD GLN A 169 23.926 4.269 6.149 1.00 0.00 C ATOM 2727 OE1 GLN A 169 24.428 4.551 5.061 1.00 0.00 O ATOM 2728 NE2 GLN A 169 24.672 4.193 7.215 1.00 0.00 N ATOM 0 H GLN A 169 19.735 2.365 3.639 1.00 0.00 H new ATOM 0 HA GLN A 169 19.974 3.984 6.064 1.00 0.00 H new ATOM 0 HB2 GLN A 169 22.212 3.353 4.214 1.00 0.00 H new ATOM 0 HB3 GLN A 169 21.957 5.072 4.444 1.00 0.00 H new ATOM 0 HG2 GLN A 169 21.975 4.731 6.935 1.00 0.00 H new ATOM 0 HG3 GLN A 169 22.259 3.018 6.692 1.00 0.00 H new ATOM 0 HE21 GLN A 169 24.253 3.959 8.115 1.00 0.00 H new ATOM 0 HE22 GLN A 169 25.675 4.367 7.149 1.00 0.00 H new ATOM 2737 N PRO A 170 19.338 6.070 4.675 1.00 0.00 N ATOM 2738 CA PRO A 170 18.609 7.158 3.966 1.00 0.00 C ATOM 2739 C PRO A 170 19.514 7.916 2.995 1.00 0.00 C ATOM 2740 O PRO A 170 20.637 8.280 3.343 1.00 0.00 O ATOM 2741 CB PRO A 170 18.187 8.056 5.120 1.00 0.00 C ATOM 2742 CG PRO A 170 19.320 7.975 6.079 1.00 0.00 C ATOM 2743 CD PRO A 170 19.845 6.545 5.978 1.00 0.00 C ATOM 0 HA PRO A 170 17.785 6.794 3.352 1.00 0.00 H new ATOM 0 HB2 PRO A 170 18.020 9.080 4.787 1.00 0.00 H new ATOM 0 HB3 PRO A 170 17.257 7.712 5.573 1.00 0.00 H new ATOM 0 HG2 PRO A 170 20.098 8.696 5.828 1.00 0.00 H new ATOM 0 HG3 PRO A 170 18.991 8.201 7.093 1.00 0.00 H new ATOM 0 HD2 PRO A 170 20.934 6.516 6.017 1.00 0.00 H new ATOM 0 HD3 PRO A 170 19.480 5.927 6.798 1.00 0.00 H new ATOM 2751 N TRP A 171 19.026 8.153 1.779 1.00 0.00 N ATOM 2752 CA TRP A 171 19.811 8.870 0.780 1.00 0.00 C ATOM 2753 C TRP A 171 19.296 10.303 0.616 1.00 0.00 C ATOM 2754 O TRP A 171 18.127 10.589 0.877 1.00 0.00 O ATOM 2755 CB TRP A 171 19.739 8.129 -0.552 1.00 0.00 C ATOM 2756 CG TRP A 171 18.351 8.192 -1.081 1.00 0.00 C ATOM 2757 CD1 TRP A 171 17.946 8.958 -2.115 1.00 0.00 C ATOM 2758 CD2 TRP A 171 17.185 7.468 -0.621 1.00 0.00 C ATOM 2759 NE1 TRP A 171 16.586 8.761 -2.306 1.00 0.00 N ATOM 2760 CE2 TRP A 171 16.077 7.842 -1.413 1.00 0.00 C ATOM 2761 CE3 TRP A 171 16.985 6.534 0.401 1.00 0.00 C ATOM 2762 CZ2 TRP A 171 14.815 7.302 -1.192 1.00 0.00 C ATOM 2763 CZ3 TRP A 171 15.722 5.989 0.626 1.00 0.00 C ATOM 2764 CH2 TRP A 171 14.639 6.369 -0.168 1.00 0.00 C ATOM 0 H TRP A 171 18.100 7.862 1.465 1.00 0.00 H new ATOM 0 HA TRP A 171 20.848 8.917 1.112 1.00 0.00 H new ATOM 0 HB2 TRP A 171 20.432 8.574 -1.266 1.00 0.00 H new ATOM 0 HB3 TRP A 171 20.042 7.090 -0.419 1.00 0.00 H new ATOM 0 HD1 TRP A 171 18.575 9.615 -2.697 1.00 0.00 H new ATOM 0 HE1 TRP A 171 16.032 9.237 -3.018 1.00 0.00 H new ATOM 0 HE3 TRP A 171 17.816 6.233 1.021 1.00 0.00 H new ATOM 0 HZ2 TRP A 171 13.979 7.601 -1.806 1.00 0.00 H new ATOM 0 HZ3 TRP A 171 15.581 5.269 1.419 1.00 0.00 H new ATOM 0 HH2 TRP A 171 13.664 5.941 0.010 1.00 0.00 H new ATOM 2775 N ASP A 172 20.189 11.199 0.198 1.00 0.00 N ATOM 2776 CA ASP A 172 19.841 12.609 0.020 1.00 0.00 C ATOM 2777 C ASP A 172 18.865 12.814 -1.129 1.00 0.00 C ATOM 2778 O ASP A 172 18.945 13.803 -1.859 1.00 0.00 O ATOM 2779 CB ASP A 172 21.104 13.419 -0.243 1.00 0.00 C ATOM 2780 CG ASP A 172 20.899 14.868 0.187 1.00 0.00 C ATOM 2781 OD1 ASP A 172 20.052 15.524 -0.395 1.00 0.00 O ATOM 2782 OD2 ASP A 172 21.593 15.301 1.093 1.00 0.00 O ATOM 0 H ASP A 172 21.159 10.974 -0.024 1.00 0.00 H new ATOM 0 HA ASP A 172 19.357 12.947 0.937 1.00 0.00 H new ATOM 0 HB2 ASP A 172 21.943 12.986 0.302 1.00 0.00 H new ATOM 0 HB3 ASP A 172 21.357 13.379 -1.303 1.00 0.00 H new ATOM 2787 N GLY A 173 17.936 11.890 -1.270 1.00 0.00 N ATOM 2788 CA GLY A 173 16.923 11.980 -2.321 1.00 0.00 C ATOM 2789 C GLY A 173 15.531 11.932 -1.713 1.00 0.00 C ATOM 2790 O GLY A 173 14.601 12.564 -2.215 1.00 0.00 O ATOM 0 H GLY A 173 17.855 11.066 -0.674 1.00 0.00 H new ATOM 0 HA2 GLY A 173 17.051 12.906 -2.882 1.00 0.00 H new ATOM 0 HA3 GLY A 173 17.048 11.160 -3.028 1.00 0.00 H new ATOM 2794 N LEU A 174 15.394 11.185 -0.620 1.00 0.00 N ATOM 2795 CA LEU A 174 14.121 11.071 0.053 1.00 0.00 C ATOM 2796 C LEU A 174 13.395 12.406 0.030 1.00 0.00 C ATOM 2797 O LEU A 174 12.167 12.470 0.075 1.00 0.00 O ATOM 2798 CB LEU A 174 14.360 10.658 1.492 1.00 0.00 C ATOM 2799 CG LEU A 174 14.624 9.156 1.542 1.00 0.00 C ATOM 2800 CD1 LEU A 174 15.258 8.812 2.875 1.00 0.00 C ATOM 2801 CD2 LEU A 174 13.313 8.380 1.391 1.00 0.00 C ATOM 0 H LEU A 174 16.152 10.655 -0.190 1.00 0.00 H new ATOM 0 HA LEU A 174 13.510 10.326 -0.456 1.00 0.00 H new ATOM 0 HB2 LEU A 174 15.209 11.203 1.904 1.00 0.00 H new ATOM 0 HB3 LEU A 174 13.494 10.908 2.104 1.00 0.00 H new ATOM 0 HG LEU A 174 15.291 8.882 0.725 1.00 0.00 H new ATOM 0 HD11 LEU A 174 15.451 7.740 2.920 1.00 0.00 H new ATOM 0 HD12 LEU A 174 16.197 9.354 2.982 1.00 0.00 H new ATOM 0 HD13 LEU A 174 14.582 9.094 3.683 1.00 0.00 H new ATOM 0 HD21 LEU A 174 13.517 7.310 1.429 1.00 0.00 H new ATOM 0 HD22 LEU A 174 12.636 8.649 2.202 1.00 0.00 H new ATOM 0 HD23 LEU A 174 12.851 8.628 0.435 1.00 0.00 H new ATOM 2813 N ASP A 175 14.184 13.465 -0.039 1.00 0.00 N ATOM 2814 CA ASP A 175 13.655 14.817 -0.067 1.00 0.00 C ATOM 2815 C ASP A 175 12.787 15.016 -1.295 1.00 0.00 C ATOM 2816 O ASP A 175 11.574 15.194 -1.199 1.00 0.00 O ATOM 2817 CB ASP A 175 14.815 15.808 -0.112 1.00 0.00 C ATOM 2818 CG ASP A 175 15.874 15.324 -1.097 1.00 0.00 C ATOM 2819 OD1 ASP A 175 16.746 14.580 -0.681 1.00 0.00 O ATOM 2820 OD2 ASP A 175 15.796 15.705 -2.254 1.00 0.00 O ATOM 0 H ASP A 175 15.202 13.412 -0.077 1.00 0.00 H new ATOM 0 HA ASP A 175 13.053 14.981 0.827 1.00 0.00 H new ATOM 0 HB2 ASP A 175 14.453 16.792 -0.409 1.00 0.00 H new ATOM 0 HB3 ASP A 175 15.252 15.915 0.881 1.00 0.00 H new ATOM 2825 N GLU A 176 13.430 14.977 -2.448 1.00 0.00 N ATOM 2826 CA GLU A 176 12.733 15.147 -3.711 1.00 0.00 C ATOM 2827 C GLU A 176 11.507 14.252 -3.756 1.00 0.00 C ATOM 2828 O GLU A 176 10.412 14.683 -4.119 1.00 0.00 O ATOM 2829 CB GLU A 176 13.663 14.793 -4.861 1.00 0.00 C ATOM 2830 CG GLU A 176 13.098 15.342 -6.172 1.00 0.00 C ATOM 2831 CD GLU A 176 13.810 14.698 -7.358 1.00 0.00 C ATOM 2832 OE1 GLU A 176 13.671 13.498 -7.524 1.00 0.00 O ATOM 2833 OE2 GLU A 176 14.482 15.414 -8.080 1.00 0.00 O ATOM 0 H GLU A 176 14.435 14.829 -2.536 1.00 0.00 H new ATOM 0 HA GLU A 176 12.419 16.187 -3.804 1.00 0.00 H new ATOM 0 HB2 GLU A 176 14.655 15.208 -4.680 1.00 0.00 H new ATOM 0 HB3 GLU A 176 13.777 13.711 -4.928 1.00 0.00 H new ATOM 0 HG2 GLU A 176 12.028 15.143 -6.228 1.00 0.00 H new ATOM 0 HG3 GLU A 176 13.223 16.424 -6.206 1.00 0.00 H new ATOM 2840 N HIS A 177 11.707 13.000 -3.376 1.00 0.00 N ATOM 2841 CA HIS A 177 10.620 12.028 -3.363 1.00 0.00 C ATOM 2842 C HIS A 177 9.520 12.471 -2.405 1.00 0.00 C ATOM 2843 O HIS A 177 8.441 12.884 -2.830 1.00 0.00 O ATOM 2844 CB HIS A 177 11.154 10.658 -2.940 1.00 0.00 C ATOM 2845 CG HIS A 177 12.187 10.199 -3.931 1.00 0.00 C ATOM 2846 ND1 HIS A 177 13.396 9.647 -3.536 1.00 0.00 N ATOM 2847 CD2 HIS A 177 12.208 10.205 -5.304 1.00 0.00 C ATOM 2848 CE1 HIS A 177 14.088 9.348 -4.650 1.00 0.00 C ATOM 2849 NE2 HIS A 177 13.410 9.668 -5.755 1.00 0.00 N ATOM 0 H HIS A 177 12.609 12.632 -3.073 1.00 0.00 H new ATOM 0 HA HIS A 177 10.202 11.959 -4.367 1.00 0.00 H new ATOM 0 HB2 HIS A 177 11.591 10.717 -1.943 1.00 0.00 H new ATOM 0 HB3 HIS A 177 10.338 9.937 -2.888 1.00 0.00 H new ATOM 0 HD2 HIS A 177 11.413 10.571 -5.937 1.00 0.00 H new ATOM 0 HE1 HIS A 177 15.072 8.903 -4.651 1.00 0.00 H new ATOM 0 HE2 HIS A 177 13.709 9.545 -6.722 1.00 0.00 H new ATOM 2858 N SER A 178 9.804 12.388 -1.109 1.00 0.00 N ATOM 2859 CA SER A 178 8.835 12.787 -0.094 1.00 0.00 C ATOM 2860 C SER A 178 8.150 14.091 -0.490 1.00 0.00 C ATOM 2861 O SER A 178 6.931 14.142 -0.648 1.00 0.00 O ATOM 2862 CB SER A 178 9.540 12.968 1.247 1.00 0.00 C ATOM 2863 OG SER A 178 8.660 13.615 2.156 1.00 0.00 O ATOM 0 H SER A 178 10.692 12.050 -0.738 1.00 0.00 H new ATOM 0 HA SER A 178 8.080 12.006 -0.009 1.00 0.00 H new ATOM 0 HB2 SER A 178 9.845 12.000 1.644 1.00 0.00 H new ATOM 0 HB3 SER A 178 10.447 13.559 1.118 1.00 0.00 H new ATOM 0 HG SER A 178 9.161 14.267 2.688 1.00 0.00 H new ATOM 2869 N GLN A 179 8.946 15.142 -0.650 1.00 0.00 N ATOM 2870 CA GLN A 179 8.415 16.445 -1.030 1.00 0.00 C ATOM 2871 C GLN A 179 7.273 16.292 -2.021 1.00 0.00 C ATOM 2872 O GLN A 179 6.179 16.823 -1.823 1.00 0.00 O ATOM 2873 CB GLN A 179 9.517 17.277 -1.684 1.00 0.00 C ATOM 2874 CG GLN A 179 9.099 18.748 -1.716 1.00 0.00 C ATOM 2875 CD GLN A 179 10.255 19.609 -2.214 1.00 0.00 C ATOM 2876 OE1 GLN A 179 11.479 19.173 -2.100 1.00 0.00 O flip ATOM 2877 NE2 GLN A 179 10.036 20.710 -2.721 1.00 0.00 N flip ATOM 0 H GLN A 179 9.958 15.117 -0.523 1.00 0.00 H new ATOM 0 HA GLN A 179 8.048 16.939 -0.130 1.00 0.00 H new ATOM 0 HB2 GLN A 179 10.449 17.165 -1.129 1.00 0.00 H new ATOM 0 HB3 GLN A 179 9.704 16.920 -2.697 1.00 0.00 H new ATOM 0 HG2 GLN A 179 8.234 18.875 -2.367 1.00 0.00 H new ATOM 0 HG3 GLN A 179 8.798 19.071 -0.719 1.00 0.00 H new ATOM 0 HE21 GLN A 179 9.078 21.049 -2.809 1.00 0.00 H new ATOM 0 HE22 GLN A 179 10.812 21.282 -3.053 1.00 0.00 H new ATOM 2886 N ASP A 180 7.552 15.577 -3.099 1.00 0.00 N ATOM 2887 CA ASP A 180 6.576 15.358 -4.147 1.00 0.00 C ATOM 2888 C ASP A 180 5.288 14.747 -3.597 1.00 0.00 C ATOM 2889 O ASP A 180 4.215 15.346 -3.707 1.00 0.00 O ATOM 2890 CB ASP A 180 7.197 14.445 -5.199 1.00 0.00 C ATOM 2891 CG ASP A 180 6.534 14.675 -6.553 1.00 0.00 C ATOM 2892 OD1 ASP A 180 6.580 15.796 -7.030 1.00 0.00 O ATOM 2893 OD2 ASP A 180 5.988 13.726 -7.093 1.00 0.00 O ATOM 0 H ASP A 180 8.456 15.136 -3.269 1.00 0.00 H new ATOM 0 HA ASP A 180 6.307 16.316 -4.592 1.00 0.00 H new ATOM 0 HB2 ASP A 180 8.267 14.638 -5.272 1.00 0.00 H new ATOM 0 HB3 ASP A 180 7.081 13.403 -4.901 1.00 0.00 H new ATOM 2898 N LEU A 181 5.387 13.560 -3.007 1.00 0.00 N ATOM 2899 CA LEU A 181 4.214 12.903 -2.460 1.00 0.00 C ATOM 2900 C LEU A 181 3.534 13.806 -1.439 1.00 0.00 C ATOM 2901 O LEU A 181 2.355 14.122 -1.557 1.00 0.00 O ATOM 2902 CB LEU A 181 4.639 11.603 -1.777 1.00 0.00 C ATOM 2903 CG LEU A 181 3.499 10.560 -1.733 1.00 0.00 C ATOM 2904 CD1 LEU A 181 3.722 9.636 -0.537 1.00 0.00 C ATOM 2905 CD2 LEU A 181 2.112 11.205 -1.567 1.00 0.00 C ATOM 0 H LEU A 181 6.259 13.041 -2.898 1.00 0.00 H new ATOM 0 HA LEU A 181 3.515 12.690 -3.269 1.00 0.00 H new ATOM 0 HB2 LEU A 181 5.494 11.181 -2.305 1.00 0.00 H new ATOM 0 HB3 LEU A 181 4.968 11.820 -0.761 1.00 0.00 H new ATOM 0 HG LEU A 181 3.519 10.022 -2.681 1.00 0.00 H new ATOM 0 HD11 LEU A 181 2.923 8.895 -0.496 1.00 0.00 H new ATOM 0 HD12 LEU A 181 4.681 9.130 -0.642 1.00 0.00 H new ATOM 0 HD13 LEU A 181 3.721 10.223 0.381 1.00 0.00 H new ATOM 0 HD21 LEU A 181 1.349 10.427 -1.542 1.00 0.00 H new ATOM 0 HD22 LEU A 181 2.083 11.771 -0.636 1.00 0.00 H new ATOM 0 HD23 LEU A 181 1.920 11.875 -2.405 1.00 0.00 H new ATOM 2917 N SER A 182 4.282 14.194 -0.419 1.00 0.00 N ATOM 2918 CA SER A 182 3.732 15.035 0.627 1.00 0.00 C ATOM 2919 C SER A 182 3.036 16.257 0.030 1.00 0.00 C ATOM 2920 O SER A 182 1.820 16.381 0.085 1.00 0.00 O ATOM 2921 CB SER A 182 4.845 15.493 1.569 1.00 0.00 C ATOM 2922 OG SER A 182 5.669 16.439 0.899 1.00 0.00 O ATOM 0 H SER A 182 5.263 13.942 -0.295 1.00 0.00 H new ATOM 0 HA SER A 182 2.999 14.451 1.184 1.00 0.00 H new ATOM 0 HB2 SER A 182 4.417 15.938 2.467 1.00 0.00 H new ATOM 0 HB3 SER A 182 5.440 14.638 1.890 1.00 0.00 H new ATOM 0 HG SER A 182 6.383 16.736 1.501 1.00 0.00 H new ATOM 2928 N GLY A 183 3.808 17.156 -0.551 1.00 0.00 N ATOM 2929 CA GLY A 183 3.228 18.353 -1.139 1.00 0.00 C ATOM 2930 C GLY A 183 1.911 18.029 -1.820 1.00 0.00 C ATOM 2931 O GLY A 183 0.988 18.841 -1.824 1.00 0.00 O ATOM 0 H GLY A 183 4.823 17.085 -0.629 1.00 0.00 H new ATOM 0 HA2 GLY A 183 3.068 19.104 -0.365 1.00 0.00 H new ATOM 0 HA3 GLY A 183 3.922 18.782 -1.862 1.00 0.00 H new ATOM 2935 N ARG A 184 1.826 16.833 -2.389 1.00 0.00 N ATOM 2936 CA ARG A 184 0.605 16.425 -3.059 1.00 0.00 C ATOM 2937 C ARG A 184 -0.454 15.982 -2.061 1.00 0.00 C ATOM 2938 O ARG A 184 -1.463 16.659 -1.884 1.00 0.00 O ATOM 2939 CB ARG A 184 0.860 15.288 -4.035 1.00 0.00 C ATOM 2940 CG ARG A 184 1.630 15.813 -5.253 1.00 0.00 C ATOM 2941 CD ARG A 184 0.655 16.221 -6.356 1.00 0.00 C ATOM 2942 NE ARG A 184 -0.131 17.378 -5.941 1.00 0.00 N ATOM 2943 CZ ARG A 184 -1.281 17.674 -6.536 1.00 0.00 C ATOM 2944 NH1 ARG A 184 -1.721 16.931 -7.514 1.00 0.00 N ATOM 2945 NH2 ARG A 184 -1.970 18.711 -6.143 1.00 0.00 N ATOM 0 H ARG A 184 2.576 16.141 -2.399 1.00 0.00 H new ATOM 0 HA ARG A 184 0.245 17.297 -3.606 1.00 0.00 H new ATOM 0 HB2 ARG A 184 1.429 14.498 -3.546 1.00 0.00 H new ATOM 0 HB3 ARG A 184 -0.086 14.850 -4.352 1.00 0.00 H new ATOM 0 HG2 ARG A 184 2.243 16.667 -4.965 1.00 0.00 H new ATOM 0 HG3 ARG A 184 2.308 15.044 -5.623 1.00 0.00 H new ATOM 0 HD2 ARG A 184 1.205 16.456 -7.267 1.00 0.00 H new ATOM 0 HD3 ARG A 184 -0.008 15.388 -6.590 1.00 0.00 H new ATOM 0 HE ARG A 184 0.208 17.969 -5.182 1.00 0.00 H new ATOM 0 HH11 ARG A 184 -1.182 16.122 -7.822 1.00 0.00 H new ATOM 0 HH12 ARG A 184 -2.604 17.159 -7.970 1.00 0.00 H new ATOM 0 HH21 ARG A 184 -1.625 19.293 -5.380 1.00 0.00 H new ATOM 0 HH22 ARG A 184 -2.853 18.939 -6.599 1.00 0.00 H new ATOM 2959 N LEU A 185 -0.223 14.837 -1.412 1.00 0.00 N ATOM 2960 CA LEU A 185 -1.186 14.319 -0.443 1.00 0.00 C ATOM 2961 C LEU A 185 -1.772 15.468 0.347 1.00 0.00 C ATOM 2962 O LEU A 185 -2.975 15.541 0.581 1.00 0.00 O ATOM 2963 CB LEU A 185 -0.533 13.320 0.489 1.00 0.00 C ATOM 2964 CG LEU A 185 -1.632 12.606 1.307 1.00 0.00 C ATOM 2965 CD1 LEU A 185 -1.761 11.149 0.854 1.00 0.00 C ATOM 2966 CD2 LEU A 185 -1.287 12.656 2.802 1.00 0.00 C ATOM 0 H LEU A 185 0.609 14.261 -1.538 1.00 0.00 H new ATOM 0 HA LEU A 185 -1.982 13.804 -0.981 1.00 0.00 H new ATOM 0 HB2 LEU A 185 0.044 12.593 -0.082 1.00 0.00 H new ATOM 0 HB3 LEU A 185 0.164 13.827 1.156 1.00 0.00 H new ATOM 0 HG LEU A 185 -2.581 13.115 1.141 1.00 0.00 H new ATOM 0 HD11 LEU A 185 -2.538 10.654 1.437 1.00 0.00 H new ATOM 0 HD12 LEU A 185 -2.025 11.119 -0.203 1.00 0.00 H new ATOM 0 HD13 LEU A 185 -0.812 10.635 1.006 1.00 0.00 H new ATOM 0 HD21 LEU A 185 -2.066 12.151 3.372 1.00 0.00 H new ATOM 0 HD22 LEU A 185 -0.332 12.158 2.972 1.00 0.00 H new ATOM 0 HD23 LEU A 185 -1.217 13.695 3.125 1.00 0.00 H new ATOM 2978 N ARG A 186 -0.905 16.388 0.704 1.00 0.00 N ATOM 2979 CA ARG A 186 -1.306 17.581 1.399 1.00 0.00 C ATOM 2980 C ARG A 186 -2.272 18.321 0.537 1.00 0.00 C ATOM 2981 O ARG A 186 -3.442 18.476 0.844 1.00 0.00 O ATOM 2982 CB ARG A 186 -0.061 18.420 1.553 1.00 0.00 C ATOM 2983 CG ARG A 186 0.962 17.740 2.481 1.00 0.00 C ATOM 2984 CD ARG A 186 0.721 16.229 2.714 1.00 0.00 C ATOM 2985 NE ARG A 186 1.552 15.764 3.819 1.00 0.00 N ATOM 2986 CZ ARG A 186 1.267 16.084 5.076 1.00 0.00 C ATOM 2987 NH1 ARG A 186 0.222 16.820 5.343 1.00 0.00 N ATOM 2988 NH2 ARG A 186 2.031 15.662 6.046 1.00 0.00 N ATOM 0 H ARG A 186 0.096 16.327 0.519 1.00 0.00 H new ATOM 0 HA ARG A 186 -1.764 17.358 2.363 1.00 0.00 H new ATOM 0 HB2 ARG A 186 0.389 18.589 0.575 1.00 0.00 H new ATOM 0 HB3 ARG A 186 -0.326 19.398 1.955 1.00 0.00 H new ATOM 0 HG2 ARG A 186 1.959 17.874 2.061 1.00 0.00 H new ATOM 0 HG3 ARG A 186 0.952 18.248 3.445 1.00 0.00 H new ATOM 0 HD2 ARG A 186 -0.331 16.049 2.936 1.00 0.00 H new ATOM 0 HD3 ARG A 186 0.956 15.669 1.809 1.00 0.00 H new ATOM 0 HE ARG A 186 2.367 15.183 3.623 1.00 0.00 H new ATOM 0 HH11 ARG A 186 -0.376 17.150 4.586 1.00 0.00 H new ATOM 0 HH12 ARG A 186 0.004 17.065 6.309 1.00 0.00 H new ATOM 0 HH21 ARG A 186 2.847 15.086 5.839 1.00 0.00 H new ATOM 0 HH22 ARG A 186 1.812 15.908 7.011 1.00 0.00 H new ATOM 3002 N ALA A 187 -1.730 18.758 -0.557 1.00 0.00 N ATOM 3003 CA ALA A 187 -2.486 19.513 -1.545 1.00 0.00 C ATOM 3004 C ALA A 187 -3.860 18.913 -1.810 1.00 0.00 C ATOM 3005 O ALA A 187 -4.880 19.572 -1.606 1.00 0.00 O ATOM 3006 CB ALA A 187 -1.730 19.538 -2.860 1.00 0.00 C ATOM 0 H ALA A 187 -0.752 18.609 -0.803 1.00 0.00 H new ATOM 0 HA ALA A 187 -2.615 20.517 -1.140 1.00 0.00 H new ATOM 0 HB1 ALA A 187 -2.300 20.104 -3.597 1.00 0.00 H new ATOM 0 HB2 ALA A 187 -0.758 20.009 -2.712 1.00 0.00 H new ATOM 0 HB3 ALA A 187 -1.588 18.518 -3.217 1.00 0.00 H new ATOM 3012 N ILE A 188 -3.887 17.680 -2.308 1.00 0.00 N ATOM 3013 CA ILE A 188 -5.151 17.053 -2.637 1.00 0.00 C ATOM 3014 C ILE A 188 -6.132 17.145 -1.463 1.00 0.00 C ATOM 3015 O ILE A 188 -7.322 17.383 -1.664 1.00 0.00 O ATOM 3016 CB ILE A 188 -4.961 15.582 -3.072 1.00 0.00 C ATOM 3017 CG1 ILE A 188 -3.995 14.857 -2.117 1.00 0.00 C ATOM 3018 CG2 ILE A 188 -4.388 15.519 -4.498 1.00 0.00 C ATOM 3019 CD1 ILE A 188 -4.787 14.018 -1.111 1.00 0.00 C ATOM 0 H ILE A 188 -3.061 17.109 -2.488 1.00 0.00 H new ATOM 0 HA ILE A 188 -5.573 17.598 -3.482 1.00 0.00 H new ATOM 0 HB ILE A 188 -5.935 15.093 -3.044 1.00 0.00 H new ATOM 0 HG12 ILE A 188 -3.320 14.217 -2.685 1.00 0.00 H new ATOM 0 HG13 ILE A 188 -3.377 15.584 -1.590 1.00 0.00 H new ATOM 0 HG21 ILE A 188 -4.259 14.478 -4.793 1.00 0.00 H new ATOM 0 HG22 ILE A 188 -5.075 16.009 -5.188 1.00 0.00 H new ATOM 0 HG23 ILE A 188 -3.423 16.026 -4.525 1.00 0.00 H new ATOM 0 HD11 ILE A 188 -4.097 13.508 -0.439 1.00 0.00 H new ATOM 0 HD12 ILE A 188 -5.443 14.668 -0.532 1.00 0.00 H new ATOM 0 HD13 ILE A 188 -5.386 13.280 -1.644 1.00 0.00 H new ATOM 3031 N LEU A 189 -5.631 16.970 -0.238 1.00 0.00 N ATOM 3032 CA LEU A 189 -6.485 17.054 0.947 1.00 0.00 C ATOM 3033 C LEU A 189 -6.796 18.520 1.252 1.00 0.00 C ATOM 3034 O LEU A 189 -7.954 18.934 1.307 1.00 0.00 O ATOM 3035 CB LEU A 189 -5.754 16.416 2.142 1.00 0.00 C ATOM 3036 CG LEU A 189 -6.588 15.290 2.762 1.00 0.00 C ATOM 3037 CD1 LEU A 189 -6.481 14.034 1.908 1.00 0.00 C ATOM 3038 CD2 LEU A 189 -6.049 14.977 4.154 1.00 0.00 C ATOM 0 H LEU A 189 -4.650 16.772 -0.042 1.00 0.00 H new ATOM 0 HA LEU A 189 -7.419 16.522 0.766 1.00 0.00 H new ATOM 0 HB2 LEU A 189 -4.792 16.022 1.815 1.00 0.00 H new ATOM 0 HB3 LEU A 189 -5.548 17.177 2.895 1.00 0.00 H new ATOM 0 HG LEU A 189 -7.629 15.608 2.819 1.00 0.00 H new ATOM 0 HD11 LEU A 189 -7.077 13.238 2.355 1.00 0.00 H new ATOM 0 HD12 LEU A 189 -6.851 14.244 0.904 1.00 0.00 H new ATOM 0 HD13 LEU A 189 -5.439 13.720 1.852 1.00 0.00 H new ATOM 0 HD21 LEU A 189 -6.638 14.176 4.601 1.00 0.00 H new ATOM 0 HD22 LEU A 189 -5.008 14.663 4.079 1.00 0.00 H new ATOM 0 HD23 LEU A 189 -6.115 15.868 4.779 1.00 0.00 H new ATOM 3050 N GLN A 190 -5.732 19.287 1.446 1.00 0.00 N ATOM 3051 CA GLN A 190 -5.820 20.702 1.745 1.00 0.00 C ATOM 3052 C GLN A 190 -6.431 21.480 0.591 1.00 0.00 C ATOM 3053 O GLN A 190 -6.318 22.703 0.528 1.00 0.00 O ATOM 3054 CB GLN A 190 -4.415 21.225 2.075 1.00 0.00 C ATOM 3055 CG GLN A 190 -4.237 21.327 3.589 1.00 0.00 C ATOM 3056 CD GLN A 190 -2.920 22.020 3.916 1.00 0.00 C ATOM 3057 OE1 GLN A 190 -1.932 21.847 3.202 1.00 0.00 O ATOM 3058 NE2 GLN A 190 -2.846 22.801 4.960 1.00 0.00 N ATOM 0 H GLN A 190 -4.775 18.937 1.399 1.00 0.00 H new ATOM 0 HA GLN A 190 -6.477 20.844 2.603 1.00 0.00 H new ATOM 0 HB2 GLN A 190 -3.662 20.557 1.656 1.00 0.00 H new ATOM 0 HB3 GLN A 190 -4.265 22.202 1.616 1.00 0.00 H new ATOM 0 HG2 GLN A 190 -5.067 21.883 4.024 1.00 0.00 H new ATOM 0 HG3 GLN A 190 -4.253 20.332 4.033 1.00 0.00 H new ATOM 0 HE21 GLN A 190 -3.666 22.943 5.550 1.00 0.00 H new ATOM 0 HE22 GLN A 190 -1.968 23.269 5.185 1.00 0.00 H new ATOM 3067 N ASN A 191 -7.086 20.757 -0.297 1.00 0.00 N ATOM 3068 CA ASN A 191 -7.744 21.352 -1.445 1.00 0.00 C ATOM 3069 C ASN A 191 -7.057 22.645 -1.883 1.00 0.00 C ATOM 3070 O ASN A 191 -7.705 23.670 -2.089 1.00 0.00 O ATOM 3071 CB ASN A 191 -9.209 21.606 -1.091 1.00 0.00 C ATOM 3072 CG ASN A 191 -9.378 22.917 -0.339 1.00 0.00 C ATOM 3073 OD1 ASN A 191 -8.402 23.523 0.098 1.00 0.00 O ATOM 3074 ND2 ASN A 191 -10.575 23.388 -0.156 1.00 0.00 N ATOM 0 H ASN A 191 -7.177 19.742 -0.243 1.00 0.00 H new ATOM 0 HA ASN A 191 -7.681 20.663 -2.287 1.00 0.00 H new ATOM 0 HB2 ASN A 191 -9.807 21.628 -2.002 1.00 0.00 H new ATOM 0 HB3 ASN A 191 -9.586 20.784 -0.482 1.00 0.00 H new ATOM 0 HD21 ASN A 191 -10.707 24.263 0.351 1.00 0.00 H new ATOM 0 HD22 ASN A 191 -11.383 22.883 -0.520 1.00 0.00 H new ATOM 3081 N GLN A 192 -5.738 22.582 -2.032 1.00 0.00 N ATOM 3082 CA GLN A 192 -4.966 23.735 -2.448 1.00 0.00 C ATOM 3083 C GLN A 192 -5.651 24.457 -3.604 1.00 0.00 C ATOM 3084 O GLN A 192 -5.510 24.067 -4.763 1.00 0.00 O ATOM 3085 CB GLN A 192 -3.582 23.264 -2.875 1.00 0.00 C ATOM 3086 CG GLN A 192 -2.576 24.397 -2.709 1.00 0.00 C ATOM 3087 CD GLN A 192 -2.952 25.567 -3.612 1.00 0.00 C ATOM 3088 OE1 GLN A 192 -3.703 26.453 -3.201 1.00 0.00 O ATOM 3089 NE2 GLN A 192 -2.473 25.624 -4.824 1.00 0.00 N ATOM 0 H GLN A 192 -5.185 21.740 -1.869 1.00 0.00 H new ATOM 0 HA GLN A 192 -4.885 24.435 -1.616 1.00 0.00 H new ATOM 0 HB2 GLN A 192 -3.279 22.406 -2.275 1.00 0.00 H new ATOM 0 HB3 GLN A 192 -3.604 22.935 -3.914 1.00 0.00 H new ATOM 0 HG2 GLN A 192 -2.552 24.723 -1.669 1.00 0.00 H new ATOM 0 HG3 GLN A 192 -1.575 24.044 -2.956 1.00 0.00 H new ATOM 0 HE21 GLN A 192 -1.851 24.889 -5.162 1.00 0.00 H new ATOM 0 HE22 GLN A 192 -2.720 26.403 -5.434 1.00 0.00 H new ATOM 3098 N GLU A 193 -6.394 25.511 -3.280 1.00 0.00 N ATOM 3099 CA GLU A 193 -7.099 26.282 -4.297 1.00 0.00 C ATOM 3100 C GLU A 193 -6.170 26.618 -5.459 1.00 0.00 C ATOM 3101 O GLU A 193 -5.010 26.206 -5.480 1.00 0.00 O ATOM 3102 CB GLU A 193 -7.642 27.576 -3.688 1.00 0.00 C ATOM 3103 CG GLU A 193 -8.940 27.280 -2.935 1.00 0.00 C ATOM 3104 CD GLU A 193 -9.577 28.583 -2.461 1.00 0.00 C ATOM 3105 OE1 GLU A 193 -9.223 29.035 -1.385 1.00 0.00 O ATOM 3106 OE2 GLU A 193 -10.407 29.109 -3.183 1.00 0.00 O ATOM 0 H GLU A 193 -6.523 25.849 -2.326 1.00 0.00 H new ATOM 0 HA GLU A 193 -7.926 25.679 -4.671 1.00 0.00 H new ATOM 0 HB2 GLU A 193 -6.906 28.008 -3.010 1.00 0.00 H new ATOM 0 HB3 GLU A 193 -7.823 28.311 -4.472 1.00 0.00 H new ATOM 0 HG2 GLU A 193 -9.632 26.742 -3.583 1.00 0.00 H new ATOM 0 HG3 GLU A 193 -8.736 26.634 -2.081 1.00 0.00 H new ATOM 3113 N ASN A 194 -6.690 27.371 -6.423 1.00 0.00 N ATOM 3114 CA ASN A 194 -5.903 27.761 -7.583 1.00 0.00 C ATOM 3115 C ASN A 194 -4.492 28.161 -7.164 1.00 0.00 C ATOM 3116 O ASN A 194 -3.634 27.293 -7.140 1.00 0.00 O ATOM 3117 CB ASN A 194 -6.579 28.933 -8.293 1.00 0.00 C ATOM 3118 CG ASN A 194 -7.123 29.920 -7.265 1.00 0.00 C ATOM 3119 OD1 ASN A 194 -8.404 30.165 -7.225 1.00 0.00 O flip ATOM 3120 ND2 ASN A 194 -6.360 30.481 -6.479 1.00 0.00 N flip ATOM 3121 OXT ASN A 194 -4.289 29.328 -6.874 1.00 0.00 O ATOM 0 H ASN A 194 -7.648 27.721 -6.423 1.00 0.00 H new ATOM 0 HA ASN A 194 -5.838 26.910 -8.262 1.00 0.00 H new ATOM 0 HB2 ASN A 194 -5.865 29.433 -8.948 1.00 0.00 H new ATOM 0 HB3 ASN A 194 -7.389 28.568 -8.924 1.00 0.00 H new ATOM 0 HD21 ASN A 194 -5.359 30.287 -6.513 1.00 0.00 H new ATOM 0 HD22 ASN A 194 -6.728 31.140 -5.793 1.00 0.00 H new TER 3128 ASN A 194 HETATM 3129 ZN ZN A 250 -4.362 2.935 -7.848 1.00 0.00 ZN