USER MOD reduce.3.24.130724 H: found=0, std=0, add=1128, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1128 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 34 HIS HE2 : A 34 HIS NE2 : A 201 ZNZN :(H bumps) USER MOD NoAdj-H: A 122 HIS HD1 : A 122 HIS ND1 : A 201 ZNZN :(H bumps) USER MOD Set 1.1: A 79 HIS : no HE2:sc= -6.75! C(o=-8.6!,f=-11!) USER MOD Set 1.2: A 83 MET CE :methyl -110:sc= -0.757 (180deg=-1.58!) USER MOD Set 1.3: A 85 THR OG1 : rot 120:sc= -0.307 USER MOD Set 1.4: A 145 TYR OH : rot -39:sc= -0.834 USER MOD Set 2.1: A 131 ASN : amide:sc= -0.129 X(o=-6.6,f=-6.2) USER MOD Set 2.2: A 133 GLN : amide:sc= -6.49! K(o=-6.6!,f=-4.3) USER MOD Set 3.1: A 45 THR OG1 : rot 91:sc= 1.16 USER MOD Set 3.2: A 110 THR OG1 : rot 136:sc= 0.951 USER MOD Set 4.1: A 21 THR OG1 : rot 180:sc= 0.117 USER MOD Set 4.2: A 23 ASN : amide:sc= -0.563 X(o=-0.45,f=-0.8) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 149:sc= 0.00606 (180deg=0) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 7 HIS : no HD1:sc= -0.142 X(o=-0.14,f=0.022) USER MOD Single : A 8 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 9 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 10 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot -24:sc= 0.323 USER MOD Single : A 15 TYR OH : rot -66:sc= 0.0863 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0.00157 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 THR OG1 : rot 180:sc= -0.048 USER MOD Single : A 29 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 TYR OH : rot 180:sc= -0.28 USER MOD Single : A 52 ASN : amide:sc= -0.725! K(o=-0.72!,f=-0.22) USER MOD Single : A 54 THR OG1 : rot 180:sc= -0.047 USER MOD Single : A 56 LYS NZ :NH3+ -169:sc= -1.14 (180deg=-1.28) USER MOD Single : A 60 ASN : amide:sc= -3.49! K(o=-3.5!,f=-0.27) USER MOD Single : A 63 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 HIS : no HD1:sc= -5.37! C(o=-5.4!,f=-7!) USER MOD Single : A 67 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 70 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 73 ASN : amide:sc= -2.85! C(o=-2.8!,f=-7.4!) USER MOD Single : A 78 GLN : amide:sc= 0.0229 X(o=0.023,f=-0.15) USER MOD Single : A 84 HIS : no HD1:sc= -1.77! X(o=-1.8!,f=-1.3) USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 HIS : no HD1:sc= -1.86 K(o=-1.9,f=-1.2) USER MOD Single : A 91 SER OG : rot -29:sc= 0.0985 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0.0126 USER MOD Single : A 99 SER OG : rot -140:sc= -0.706 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0.0112 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 GLN : amide:sc= -8.27! K(o=-8.3!,f=-1.6) USER MOD Single : A 105 GLN : amide:sc= -1.01 K(o=-1,f=0) USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 THR OG1 : rot 65:sc= -0.723! USER MOD Single : A 115 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0.00711 USER MOD Single : A 120 HIS : no HD1:sc= -0.368 K(o=-0.37,f=-1.4) USER MOD Single : A 125 MET CE :methyl 154:sc= -0.326 (180deg=-0.652) USER MOD Single : A 129 ASN : amide:sc= -0.259 X(o=-0.26,f=-0.019) USER MOD Single : A 134 ASN : amide:sc= -0.035 X(o=-0.035,f=0) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 143 THR OG1 : rot 41:sc= 0.0817 USER MOD Single : A 148 ASN : amide:sc= -2.45! K(o=-2.5!,f=0.62) USER MOD Single : A 153 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 155 THR OG1 : rot 48:sc= 0.122 USER MOD Single : A 156 THR OG1 : rot 39:sc= 0.071 USER MOD Single : A 158 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -25.988 -28.494 -24.370 1.00 0.00 N ATOM 2 CA MET A 1 -24.931 -27.651 -24.989 1.00 0.00 C ATOM 3 C MET A 1 -23.546 -28.236 -24.738 1.00 0.00 C ATOM 4 O MET A 1 -23.258 -28.720 -23.640 1.00 0.00 O ATOM 5 CB MET A 1 -24.998 -26.226 -24.437 1.00 0.00 C ATOM 6 CG MET A 1 -26.082 -25.374 -25.078 1.00 0.00 C ATOM 7 SD MET A 1 -26.106 -23.688 -24.439 1.00 0.00 S ATOM 8 CE MET A 1 -27.353 -22.946 -25.488 1.00 0.00 C ATOM 0 H1 MET A 1 -26.787 -27.893 -24.082 1.00 0.00 H new ATOM 0 H2 MET A 1 -26.316 -29.200 -25.059 1.00 0.00 H new ATOM 0 H3 MET A 1 -25.601 -28.979 -23.535 1.00 0.00 H new ATOM 0 HA MET A 1 -25.107 -27.629 -26.065 1.00 0.00 H new ATOM 0 HB2 MET A 1 -25.171 -26.270 -23.362 1.00 0.00 H new ATOM 0 HB3 MET A 1 -24.033 -25.742 -24.585 1.00 0.00 H new ATOM 0 HG2 MET A 1 -25.928 -25.348 -26.157 1.00 0.00 H new ATOM 0 HG3 MET A 1 -27.053 -25.838 -24.906 1.00 0.00 H new ATOM 0 HE1 MET A 1 -27.482 -21.899 -25.214 1.00 0.00 H new ATOM 0 HE2 MET A 1 -27.039 -23.013 -26.530 1.00 0.00 H new ATOM 0 HE3 MET A 1 -28.298 -23.474 -25.359 1.00 0.00 H new ATOM 20 N ARG A 2 -22.695 -28.176 -25.769 1.00 0.00 N ATOM 21 CA ARG A 2 -21.326 -28.696 -25.690 1.00 0.00 C ATOM 22 C ARG A 2 -20.339 -27.592 -25.312 1.00 0.00 C ATOM 23 O ARG A 2 -20.281 -26.545 -25.967 1.00 0.00 O ATOM 24 CB ARG A 2 -20.919 -29.331 -27.023 1.00 0.00 C ATOM 25 CG ARG A 2 -21.561 -30.688 -27.270 1.00 0.00 C ATOM 26 CD ARG A 2 -21.212 -31.230 -28.646 1.00 0.00 C ATOM 27 NE ARG A 2 -21.957 -32.453 -28.958 1.00 0.00 N ATOM 28 CZ ARG A 2 -21.455 -33.509 -29.613 1.00 0.00 C ATOM 29 NH1 ARG A 2 -20.195 -33.520 -30.044 1.00 0.00 N ATOM 30 NH2 ARG A 2 -22.225 -34.566 -29.838 1.00 0.00 N ATOM 0 H ARG A 2 -22.933 -27.769 -26.674 1.00 0.00 H new ATOM 0 HA ARG A 2 -21.301 -29.458 -24.911 1.00 0.00 H new ATOM 0 HB2 ARG A 2 -21.190 -28.657 -27.835 1.00 0.00 H new ATOM 0 HB3 ARG A 2 -19.835 -29.441 -27.048 1.00 0.00 H new ATOM 0 HG2 ARG A 2 -21.230 -31.392 -26.506 1.00 0.00 H new ATOM 0 HG3 ARG A 2 -22.644 -30.601 -27.176 1.00 0.00 H new ATOM 0 HD2 ARG A 2 -21.427 -30.472 -29.400 1.00 0.00 H new ATOM 0 HD3 ARG A 2 -20.142 -31.434 -28.695 1.00 0.00 H new ATOM 0 HE ARG A 2 -22.929 -32.504 -28.654 1.00 0.00 H new ATOM 0 HH11 ARG A 2 -19.592 -32.714 -29.878 1.00 0.00 H new ATOM 0 HH12 ARG A 2 -19.833 -34.334 -30.541 1.00 0.00 H new ATOM 0 HH21 ARG A 2 -23.192 -34.571 -29.513 1.00 0.00 H new ATOM 0 HH22 ARG A 2 -21.850 -35.373 -30.336 1.00 0.00 H new ATOM 44 N GLY A 3 -19.571 -27.842 -24.246 1.00 0.00 N ATOM 45 CA GLY A 3 -18.585 -26.879 -23.771 1.00 0.00 C ATOM 46 C GLY A 3 -17.642 -27.484 -22.750 1.00 0.00 C ATOM 47 O GLY A 3 -17.898 -27.408 -21.544 1.00 0.00 O ATOM 0 H GLY A 3 -19.617 -28.702 -23.700 1.00 0.00 H new ATOM 0 HA2 GLY A 3 -18.010 -26.503 -24.617 1.00 0.00 H new ATOM 0 HA3 GLY A 3 -19.097 -26.025 -23.329 1.00 0.00 H new ATOM 51 N SER A 4 -16.554 -28.086 -23.241 1.00 0.00 N ATOM 52 CA SER A 4 -15.555 -28.723 -22.378 1.00 0.00 C ATOM 53 C SER A 4 -14.136 -28.261 -22.722 1.00 0.00 C ATOM 54 O SER A 4 -13.292 -28.127 -21.831 1.00 0.00 O ATOM 55 CB SER A 4 -15.651 -30.247 -22.503 1.00 0.00 C ATOM 56 OG SER A 4 -14.885 -30.897 -21.502 1.00 0.00 O ATOM 0 H SER A 4 -16.342 -28.145 -24.237 1.00 0.00 H new ATOM 0 HA SER A 4 -15.764 -28.426 -21.350 1.00 0.00 H new ATOM 0 HB2 SER A 4 -16.693 -30.555 -22.423 1.00 0.00 H new ATOM 0 HB3 SER A 4 -15.302 -30.556 -23.488 1.00 0.00 H new ATOM 0 HG SER A 4 -14.967 -31.868 -21.606 1.00 0.00 H new ATOM 62 N HIS A 5 -13.884 -28.021 -24.017 1.00 0.00 N ATOM 63 CA HIS A 5 -12.566 -27.582 -24.494 1.00 0.00 C ATOM 64 C HIS A 5 -12.433 -26.056 -24.493 1.00 0.00 C ATOM 65 O HIS A 5 -11.376 -25.523 -24.142 1.00 0.00 O ATOM 66 CB HIS A 5 -12.304 -28.118 -25.906 1.00 0.00 C ATOM 67 CG HIS A 5 -12.086 -29.599 -25.964 1.00 0.00 C ATOM 68 ND1 HIS A 5 -10.833 -30.174 -26.012 1.00 0.00 N ATOM 69 CD2 HIS A 5 -12.970 -30.625 -25.991 1.00 0.00 C ATOM 70 CE1 HIS A 5 -10.955 -31.489 -26.068 1.00 0.00 C ATOM 71 NE2 HIS A 5 -12.241 -31.787 -26.056 1.00 0.00 N ATOM 0 H HIS A 5 -14.580 -28.124 -24.755 1.00 0.00 H new ATOM 0 HA HIS A 5 -11.825 -27.985 -23.804 1.00 0.00 H new ATOM 0 HB2 HIS A 5 -13.149 -27.860 -26.544 1.00 0.00 H new ATOM 0 HB3 HIS A 5 -11.429 -27.616 -26.318 1.00 0.00 H new ATOM 0 HD2 HIS A 5 -14.047 -30.544 -25.966 1.00 0.00 H new ATOM 0 HE1 HIS A 5 -10.142 -32.198 -26.115 1.00 0.00 H new ATOM 0 HE2 HIS A 5 -12.631 -32.729 -26.090 1.00 0.00 H new ATOM 80 N HIS A 6 -13.511 -25.364 -24.885 1.00 0.00 N ATOM 81 CA HIS A 6 -13.520 -23.901 -24.947 1.00 0.00 C ATOM 82 C HIS A 6 -14.147 -23.293 -23.692 1.00 0.00 C ATOM 83 O HIS A 6 -15.199 -23.746 -23.231 1.00 0.00 O ATOM 84 CB HIS A 6 -14.286 -23.437 -26.189 1.00 0.00 C ATOM 85 CG HIS A 6 -13.735 -22.189 -26.807 1.00 0.00 C ATOM 86 ND1 HIS A 6 -14.266 -20.937 -26.580 1.00 0.00 N ATOM 87 CD2 HIS A 6 -12.693 -22.006 -27.654 1.00 0.00 C ATOM 88 CE1 HIS A 6 -13.578 -20.038 -27.263 1.00 0.00 C ATOM 89 NE2 HIS A 6 -12.619 -20.662 -27.921 1.00 0.00 N ATOM 0 H HIS A 6 -14.390 -25.799 -25.165 1.00 0.00 H new ATOM 0 HA HIS A 6 -12.486 -23.560 -25.006 1.00 0.00 H new ATOM 0 HB2 HIS A 6 -14.274 -24.235 -26.931 1.00 0.00 H new ATOM 0 HB3 HIS A 6 -15.329 -23.268 -25.920 1.00 0.00 H new ATOM 0 HD2 HIS A 6 -12.043 -22.774 -28.046 1.00 0.00 H new ATOM 0 HE1 HIS A 6 -13.768 -18.975 -27.280 1.00 0.00 H new ATOM 0 HE2 HIS A 6 -11.933 -20.217 -28.530 1.00 0.00 H new ATOM 98 N HIS A 7 -13.480 -22.266 -23.150 1.00 0.00 N ATOM 99 CA HIS A 7 -13.948 -21.566 -21.950 1.00 0.00 C ATOM 100 C HIS A 7 -13.862 -20.053 -22.141 1.00 0.00 C ATOM 101 O HIS A 7 -13.004 -19.562 -22.880 1.00 0.00 O ATOM 102 CB HIS A 7 -13.126 -21.984 -20.726 1.00 0.00 C ATOM 103 CG HIS A 7 -13.451 -23.359 -20.229 1.00 0.00 C ATOM 104 ND1 HIS A 7 -12.800 -24.493 -20.669 1.00 0.00 N ATOM 105 CD2 HIS A 7 -14.363 -23.780 -19.321 1.00 0.00 C ATOM 106 CE1 HIS A 7 -13.299 -25.551 -20.054 1.00 0.00 C ATOM 107 NE2 HIS A 7 -14.248 -25.145 -19.231 1.00 0.00 N ATOM 0 H HIS A 7 -12.607 -21.900 -23.529 1.00 0.00 H new ATOM 0 HA HIS A 7 -14.990 -21.841 -21.784 1.00 0.00 H new ATOM 0 HB2 HIS A 7 -12.066 -21.938 -20.977 1.00 0.00 H new ATOM 0 HB3 HIS A 7 -13.295 -21.267 -19.923 1.00 0.00 H new ATOM 0 HD2 HIS A 7 -15.053 -23.158 -18.770 1.00 0.00 H new ATOM 0 HE1 HIS A 7 -12.984 -26.574 -20.200 1.00 0.00 H new ATOM 0 HE2 HIS A 7 -14.806 -25.748 -18.626 1.00 0.00 H new ATOM 116 N HIS A 8 -14.756 -19.324 -21.463 1.00 0.00 N ATOM 117 CA HIS A 8 -14.798 -17.863 -21.550 1.00 0.00 C ATOM 118 C HIS A 8 -14.110 -17.206 -20.352 1.00 0.00 C ATOM 119 O HIS A 8 -13.301 -16.291 -20.527 1.00 0.00 O ATOM 120 CB HIS A 8 -16.248 -17.379 -21.657 1.00 0.00 C ATOM 121 CG HIS A 8 -16.848 -17.573 -23.014 1.00 0.00 C ATOM 122 ND1 HIS A 8 -17.499 -18.729 -23.393 1.00 0.00 N ATOM 123 CD2 HIS A 8 -16.893 -16.749 -24.088 1.00 0.00 C ATOM 124 CE1 HIS A 8 -17.918 -18.606 -24.640 1.00 0.00 C ATOM 125 NE2 HIS A 8 -17.564 -17.415 -25.082 1.00 0.00 N ATOM 0 H HIS A 8 -15.462 -19.726 -20.846 1.00 0.00 H new ATOM 0 HA HIS A 8 -14.254 -17.570 -22.448 1.00 0.00 H new ATOM 0 HB2 HIS A 8 -16.854 -17.909 -20.922 1.00 0.00 H new ATOM 0 HB3 HIS A 8 -16.288 -16.321 -21.399 1.00 0.00 H new ATOM 0 HD2 HIS A 8 -16.478 -15.754 -24.150 1.00 0.00 H new ATOM 0 HE1 HIS A 8 -18.458 -19.354 -25.202 1.00 0.00 H new ATOM 0 HE2 HIS A 8 -17.758 -17.048 -26.014 1.00 0.00 H new ATOM 134 N HIS A 9 -14.437 -17.676 -19.140 1.00 0.00 N ATOM 135 CA HIS A 9 -13.853 -17.132 -17.912 1.00 0.00 C ATOM 136 C HIS A 9 -13.332 -18.244 -17.007 1.00 0.00 C ATOM 137 O HIS A 9 -13.907 -19.335 -16.955 1.00 0.00 O ATOM 138 CB HIS A 9 -14.884 -16.286 -17.159 1.00 0.00 C ATOM 139 CG HIS A 9 -15.149 -14.959 -17.800 1.00 0.00 C ATOM 140 ND1 HIS A 9 -16.247 -14.713 -18.600 1.00 0.00 N ATOM 141 CD2 HIS A 9 -14.451 -13.800 -17.756 1.00 0.00 C ATOM 142 CE1 HIS A 9 -16.210 -13.460 -19.020 1.00 0.00 C ATOM 143 NE2 HIS A 9 -15.132 -12.886 -18.522 1.00 0.00 N ATOM 0 H HIS A 9 -15.104 -18.433 -18.987 1.00 0.00 H new ATOM 0 HA HIS A 9 -13.011 -16.500 -18.196 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -15.819 -16.842 -17.092 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -14.535 -16.125 -16.139 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -13.530 -13.626 -17.219 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -16.939 -12.987 -19.662 1.00 0.00 H new ATOM 0 HE2 HIS A 9 -14.850 -11.919 -18.680 1.00 0.00 H new ATOM 152 N HIS A 10 -12.227 -17.954 -16.307 1.00 0.00 N ATOM 153 CA HIS A 10 -11.600 -18.910 -15.386 1.00 0.00 C ATOM 154 C HIS A 10 -11.161 -18.217 -14.090 1.00 0.00 C ATOM 155 O HIS A 10 -11.344 -18.764 -12.998 1.00 0.00 O ATOM 156 CB HIS A 10 -10.396 -19.586 -16.057 1.00 0.00 C ATOM 157 CG HIS A 10 -10.179 -21.001 -15.614 1.00 0.00 C ATOM 158 ND1 HIS A 10 -10.888 -22.067 -16.128 1.00 0.00 N ATOM 159 CD2 HIS A 10 -9.332 -21.524 -14.696 1.00 0.00 C ATOM 160 CE1 HIS A 10 -10.488 -23.183 -15.545 1.00 0.00 C ATOM 161 NE2 HIS A 10 -9.544 -22.880 -14.674 1.00 0.00 N ATOM 0 H HIS A 10 -11.746 -17.056 -16.363 1.00 0.00 H new ATOM 0 HA HIS A 10 -12.339 -19.671 -15.134 1.00 0.00 H new ATOM 0 HB2 HIS A 10 -10.537 -19.570 -17.138 1.00 0.00 H new ATOM 0 HB3 HIS A 10 -9.498 -19.006 -15.844 1.00 0.00 H new ATOM 0 HD2 HIS A 10 -8.622 -20.976 -14.094 1.00 0.00 H new ATOM 0 HE1 HIS A 10 -10.868 -24.173 -15.747 1.00 0.00 H new ATOM 0 HE2 HIS A 10 -9.051 -23.547 -14.080 1.00 0.00 H new ATOM 170 N GLY A 11 -10.585 -17.013 -14.224 1.00 0.00 N ATOM 171 CA GLY A 11 -10.126 -16.254 -13.068 1.00 0.00 C ATOM 172 C GLY A 11 -8.623 -16.056 -13.067 1.00 0.00 C ATOM 173 O GLY A 11 -7.899 -16.776 -12.372 1.00 0.00 O ATOM 0 H GLY A 11 -10.430 -16.552 -15.120 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -10.618 -15.281 -13.057 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -10.422 -16.772 -12.156 1.00 0.00 H new ATOM 177 N SER A 12 -8.161 -15.073 -13.847 1.00 0.00 N ATOM 178 CA SER A 12 -6.731 -14.764 -13.958 1.00 0.00 C ATOM 179 C SER A 12 -6.307 -13.645 -13.023 1.00 0.00 C ATOM 180 O SER A 12 -7.137 -12.868 -12.542 1.00 0.00 O ATOM 181 CB SER A 12 -6.380 -14.320 -15.372 1.00 0.00 C ATOM 182 OG SER A 12 -5.894 -15.400 -16.150 1.00 0.00 O ATOM 0 H SER A 12 -8.761 -14.474 -14.414 1.00 0.00 H new ATOM 0 HA SER A 12 -6.209 -15.683 -13.692 1.00 0.00 H new ATOM 0 HB2 SER A 12 -7.262 -13.894 -15.850 1.00 0.00 H new ATOM 0 HB3 SER A 12 -5.628 -13.532 -15.331 1.00 0.00 H new ATOM 0 HG SER A 12 -5.679 -15.083 -17.052 1.00 0.00 H new ATOM 188 N ALA A 13 -4.991 -13.590 -12.767 1.00 0.00 N ATOM 189 CA ALA A 13 -4.388 -12.554 -11.955 1.00 0.00 C ATOM 190 C ALA A 13 -2.878 -12.510 -12.182 1.00 0.00 C ATOM 191 O ALA A 13 -2.178 -13.499 -11.943 1.00 0.00 O ATOM 192 CB ALA A 13 -4.703 -12.739 -10.476 1.00 0.00 C ATOM 0 H ALA A 13 -4.323 -14.272 -13.125 1.00 0.00 H new ATOM 0 HA ALA A 13 -4.819 -11.601 -12.263 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -4.232 -11.941 -9.901 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -5.782 -12.705 -10.327 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -4.320 -13.703 -10.140 1.00 0.00 H new ATOM 198 N THR A 14 -2.390 -11.353 -12.641 1.00 0.00 N ATOM 199 CA THR A 14 -0.974 -11.150 -12.928 1.00 0.00 C ATOM 200 C THR A 14 -0.190 -10.638 -11.704 1.00 0.00 C ATOM 201 O THR A 14 1.044 -10.594 -11.730 1.00 0.00 O ATOM 202 CB THR A 14 -0.786 -10.190 -14.142 1.00 0.00 C ATOM 203 OG1 THR A 14 0.604 -10.076 -14.477 1.00 0.00 O ATOM 204 CG2 THR A 14 -1.366 -8.792 -13.892 1.00 0.00 C ATOM 0 H THR A 14 -2.969 -10.533 -12.823 1.00 0.00 H new ATOM 0 HA THR A 14 -0.562 -12.126 -13.184 1.00 0.00 H new ATOM 0 HB THR A 14 -1.338 -10.630 -14.973 1.00 0.00 H new ATOM 0 HG1 THR A 14 1.149 -10.290 -13.691 1.00 0.00 H new ATOM 0 HG21 THR A 14 -1.205 -8.169 -14.772 1.00 0.00 H new ATOM 0 HG22 THR A 14 -2.435 -8.872 -13.694 1.00 0.00 H new ATOM 0 HG23 THR A 14 -0.871 -8.341 -13.032 1.00 0.00 H new ATOM 212 N TYR A 15 -0.917 -10.260 -10.648 1.00 0.00 N ATOM 213 CA TYR A 15 -0.319 -9.742 -9.439 1.00 0.00 C ATOM 214 C TYR A 15 -0.288 -10.766 -8.339 1.00 0.00 C ATOM 215 O TYR A 15 -1.303 -11.382 -8.002 1.00 0.00 O ATOM 216 CB TYR A 15 -1.040 -8.487 -8.990 1.00 0.00 C ATOM 217 CG TYR A 15 -0.237 -7.218 -9.193 1.00 0.00 C ATOM 218 CD1 TYR A 15 0.862 -6.926 -8.391 1.00 0.00 C ATOM 219 CD2 TYR A 15 -0.577 -6.314 -10.191 1.00 0.00 C ATOM 220 CE1 TYR A 15 1.596 -5.771 -8.578 1.00 0.00 C ATOM 221 CE2 TYR A 15 0.153 -5.157 -10.384 1.00 0.00 C ATOM 222 CZ TYR A 15 1.237 -4.890 -9.576 1.00 0.00 C ATOM 223 OH TYR A 15 1.965 -3.739 -9.767 1.00 0.00 O ATOM 0 H TYR A 15 -1.935 -10.309 -10.619 1.00 0.00 H new ATOM 0 HA TYR A 15 0.717 -9.490 -9.667 1.00 0.00 H new ATOM 0 HB2 TYR A 15 -1.980 -8.403 -9.536 1.00 0.00 H new ATOM 0 HB3 TYR A 15 -1.293 -8.582 -7.934 1.00 0.00 H new ATOM 0 HD1 TYR A 15 1.146 -7.614 -7.609 1.00 0.00 H new ATOM 0 HD2 TYR A 15 -1.426 -6.519 -10.827 1.00 0.00 H new ATOM 0 HE1 TYR A 15 2.446 -5.559 -7.946 1.00 0.00 H new ATOM 0 HE2 TYR A 15 -0.125 -4.465 -11.165 1.00 0.00 H new ATOM 0 HH TYR A 15 1.856 -3.151 -8.991 1.00 0.00 H new ATOM 233 N THR A 16 0.907 -10.920 -7.783 1.00 0.00 N ATOM 234 CA THR A 16 1.151 -11.876 -6.723 1.00 0.00 C ATOM 235 C THR A 16 1.054 -11.248 -5.328 1.00 0.00 C ATOM 236 O THR A 16 1.198 -10.031 -5.174 1.00 0.00 O ATOM 237 CB THR A 16 2.533 -12.536 -6.874 1.00 0.00 C ATOM 238 OG1 THR A 16 3.538 -11.539 -7.091 1.00 0.00 O ATOM 239 CG2 THR A 16 2.544 -13.538 -8.020 1.00 0.00 C ATOM 0 H THR A 16 1.730 -10.384 -8.057 1.00 0.00 H new ATOM 0 HA THR A 16 0.368 -12.629 -6.817 1.00 0.00 H new ATOM 0 HB THR A 16 2.750 -13.071 -5.950 1.00 0.00 H new ATOM 0 HG1 THR A 16 4.413 -11.971 -7.184 1.00 0.00 H new ATOM 0 HG21 THR A 16 3.534 -13.987 -8.101 1.00 0.00 H new ATOM 0 HG22 THR A 16 1.806 -14.317 -7.829 1.00 0.00 H new ATOM 0 HG23 THR A 16 2.300 -13.028 -8.952 1.00 0.00 H new ATOM 247 N ARG A 17 0.812 -12.101 -4.320 1.00 0.00 N ATOM 248 CA ARG A 17 0.699 -11.675 -2.937 1.00 0.00 C ATOM 249 C ARG A 17 2.016 -11.884 -2.169 1.00 0.00 C ATOM 250 O ARG A 17 2.451 -13.027 -1.992 1.00 0.00 O ATOM 251 CB ARG A 17 -0.427 -12.434 -2.223 1.00 0.00 C ATOM 252 CG ARG A 17 -1.509 -11.527 -1.651 1.00 0.00 C ATOM 253 CD ARG A 17 -2.637 -11.277 -2.645 1.00 0.00 C ATOM 254 NE ARG A 17 -2.190 -10.580 -3.861 1.00 0.00 N ATOM 255 CZ ARG A 17 -2.483 -9.307 -4.161 1.00 0.00 C ATOM 256 NH1 ARG A 17 -3.222 -8.559 -3.343 1.00 0.00 N ATOM 257 NH2 ARG A 17 -2.045 -8.786 -5.298 1.00 0.00 N ATOM 0 H ARG A 17 0.691 -13.105 -4.453 1.00 0.00 H new ATOM 0 HA ARG A 17 0.469 -10.610 -2.950 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -0.884 -13.133 -2.924 1.00 0.00 H new ATOM 0 HB3 ARG A 17 0.002 -13.027 -1.415 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -1.918 -11.978 -0.747 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -1.066 -10.575 -1.360 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -3.086 -12.230 -2.924 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -3.416 -10.688 -2.161 1.00 0.00 H new ATOM 0 HE ARG A 17 -1.616 -11.103 -4.523 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -3.575 -8.953 -2.471 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -3.434 -7.592 -3.589 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -1.489 -9.353 -5.938 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -2.264 -7.818 -5.533 1.00 0.00 H new ATOM 271 N PRO A 18 2.690 -10.783 -1.717 1.00 0.00 N ATOM 272 CA PRO A 18 3.941 -10.879 -0.935 1.00 0.00 C ATOM 273 C PRO A 18 3.722 -11.393 0.496 1.00 0.00 C ATOM 274 O PRO A 18 4.661 -11.886 1.130 1.00 0.00 O ATOM 275 CB PRO A 18 4.455 -9.436 -0.880 1.00 0.00 C ATOM 276 CG PRO A 18 3.660 -8.678 -1.888 1.00 0.00 C ATOM 277 CD PRO A 18 2.336 -9.374 -1.980 1.00 0.00 C ATOM 0 HA PRO A 18 4.629 -11.587 -1.397 1.00 0.00 H new ATOM 0 HB2 PRO A 18 4.326 -9.014 0.116 1.00 0.00 H new ATOM 0 HB3 PRO A 18 5.520 -9.392 -1.109 1.00 0.00 H new ATOM 0 HG2 PRO A 18 3.534 -7.639 -1.584 1.00 0.00 H new ATOM 0 HG3 PRO A 18 4.164 -8.668 -2.855 1.00 0.00 H new ATOM 0 HD2 PRO A 18 1.626 -8.991 -1.247 1.00 0.00 H new ATOM 0 HD3 PRO A 18 1.880 -9.248 -2.962 1.00 0.00 H new ATOM 285 N LEU A 19 2.481 -11.277 0.987 1.00 0.00 N ATOM 286 CA LEU A 19 2.120 -11.717 2.320 1.00 0.00 C ATOM 287 C LEU A 19 0.829 -12.496 2.295 1.00 0.00 C ATOM 288 O LEU A 19 0.276 -12.839 1.245 1.00 0.00 O ATOM 289 CB LEU A 19 1.931 -10.523 3.275 1.00 0.00 C ATOM 290 CG LEU A 19 2.827 -10.418 4.530 1.00 0.00 C ATOM 291 CD1 LEU A 19 2.441 -11.465 5.576 1.00 0.00 C ATOM 292 CD2 LEU A 19 4.308 -10.534 4.192 1.00 0.00 C ATOM 0 H LEU A 19 1.706 -10.873 0.462 1.00 0.00 H new ATOM 0 HA LEU A 19 2.937 -12.346 2.674 1.00 0.00 H new ATOM 0 HB2 LEU A 19 2.071 -9.612 2.694 1.00 0.00 H new ATOM 0 HB3 LEU A 19 0.894 -10.531 3.611 1.00 0.00 H new ATOM 0 HG LEU A 19 2.659 -9.426 4.949 1.00 0.00 H new ATOM 0 HD11 LEU A 19 3.089 -11.366 6.447 1.00 0.00 H new ATOM 0 HD12 LEU A 19 1.404 -11.314 5.876 1.00 0.00 H new ATOM 0 HD13 LEU A 19 2.554 -12.462 5.151 1.00 0.00 H new ATOM 0 HD21 LEU A 19 4.897 -10.454 5.106 1.00 0.00 H new ATOM 0 HD22 LEU A 19 4.499 -11.498 3.720 1.00 0.00 H new ATOM 0 HD23 LEU A 19 4.589 -9.733 3.508 1.00 0.00 H new ATOM 304 N ASP A 20 0.393 -12.756 3.495 1.00 0.00 N ATOM 305 CA ASP A 20 -0.836 -13.437 3.791 1.00 0.00 C ATOM 306 C ASP A 20 -1.625 -12.606 4.781 1.00 0.00 C ATOM 307 O ASP A 20 -2.855 -12.690 4.854 1.00 0.00 O ATOM 308 CB ASP A 20 -0.563 -14.801 4.392 1.00 0.00 C ATOM 309 CG ASP A 20 -1.077 -15.936 3.531 1.00 0.00 C ATOM 310 OD1 ASP A 20 -0.322 -16.400 2.653 1.00 0.00 O ATOM 311 OD2 ASP A 20 -2.232 -16.363 3.737 1.00 0.00 O ATOM 0 H ASP A 20 0.909 -12.486 4.333 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.399 -13.571 2.868 1.00 0.00 H new ATOM 0 HB2 ASP A 20 0.511 -14.920 4.539 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -1.028 -14.859 5.376 1.00 0.00 H new ATOM 316 N THR A 21 -0.877 -11.789 5.540 1.00 0.00 N ATOM 317 CA THR A 21 -1.427 -10.938 6.576 1.00 0.00 C ATOM 318 C THR A 21 -0.391 -9.907 7.091 1.00 0.00 C ATOM 319 O THR A 21 0.649 -9.681 6.484 1.00 0.00 O ATOM 320 CB THR A 21 -2.009 -11.808 7.739 1.00 0.00 C ATOM 321 OG1 THR A 21 -2.840 -11.013 8.593 1.00 0.00 O ATOM 322 CG2 THR A 21 -0.921 -12.492 8.577 1.00 0.00 C ATOM 0 H THR A 21 0.135 -11.709 5.441 1.00 0.00 H new ATOM 0 HA THR A 21 -2.243 -10.361 6.141 1.00 0.00 H new ATOM 0 HB THR A 21 -2.600 -12.593 7.268 1.00 0.00 H new ATOM 0 HG1 THR A 21 -3.197 -11.572 9.314 1.00 0.00 H new ATOM 0 HG21 THR A 21 -1.387 -13.081 9.367 1.00 0.00 H new ATOM 0 HG22 THR A 21 -0.328 -13.147 7.939 1.00 0.00 H new ATOM 0 HG23 THR A 21 -0.274 -11.735 9.021 1.00 0.00 H new ATOM 330 N GLY A 22 -0.758 -9.260 8.183 1.00 0.00 N ATOM 331 CA GLY A 22 0.083 -8.295 8.879 1.00 0.00 C ATOM 332 C GLY A 22 -0.673 -7.621 10.010 1.00 0.00 C ATOM 333 O GLY A 22 -1.569 -6.814 9.760 1.00 0.00 O ATOM 0 H GLY A 22 -1.669 -9.392 8.622 1.00 0.00 H new ATOM 0 HA2 GLY A 22 0.965 -8.798 9.277 1.00 0.00 H new ATOM 0 HA3 GLY A 22 0.436 -7.542 8.175 1.00 0.00 H new ATOM 337 N ASN A 23 -0.288 -7.932 11.261 1.00 0.00 N ATOM 338 CA ASN A 23 -0.950 -7.382 12.449 1.00 0.00 C ATOM 339 C ASN A 23 -0.033 -7.296 13.646 1.00 0.00 C ATOM 340 O ASN A 23 0.552 -8.294 14.079 1.00 0.00 O ATOM 341 CB ASN A 23 -2.212 -8.201 12.801 1.00 0.00 C ATOM 342 CG ASN A 23 -1.986 -9.706 12.725 1.00 0.00 C ATOM 343 OD1 ASN A 23 -1.809 -10.376 13.742 1.00 0.00 O ATOM 344 ND2 ASN A 23 -1.975 -10.235 11.503 1.00 0.00 N ATOM 0 H ASN A 23 0.483 -8.565 11.472 1.00 0.00 H new ATOM 0 HA ASN A 23 -1.241 -6.362 12.196 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -2.540 -7.939 13.807 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -3.018 -7.926 12.121 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -1.815 -11.235 11.382 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -2.127 -9.640 10.688 1.00 0.00 H new ATOM 351 N ILE A 24 0.054 -6.081 14.180 1.00 0.00 N ATOM 352 CA ILE A 24 0.858 -5.810 15.362 1.00 0.00 C ATOM 353 C ILE A 24 -0.062 -5.677 16.565 1.00 0.00 C ATOM 354 O ILE A 24 -0.085 -4.664 17.277 1.00 0.00 O ATOM 355 CB ILE A 24 1.721 -4.537 15.246 1.00 0.00 C ATOM 356 CG1 ILE A 24 1.877 -4.066 13.793 1.00 0.00 C ATOM 357 CG2 ILE A 24 3.081 -4.746 15.894 1.00 0.00 C ATOM 358 CD1 ILE A 24 0.678 -3.293 13.298 1.00 0.00 C ATOM 0 H ILE A 24 -0.428 -5.263 13.807 1.00 0.00 H new ATOM 0 HA ILE A 24 1.547 -6.647 15.473 1.00 0.00 H new ATOM 0 HB ILE A 24 1.195 -3.747 15.782 1.00 0.00 H new ATOM 0 HG12 ILE A 24 2.766 -3.440 13.712 1.00 0.00 H new ATOM 0 HG13 ILE A 24 2.037 -4.932 13.150 1.00 0.00 H new ATOM 0 HG21 ILE A 24 3.673 -3.835 15.800 1.00 0.00 H new ATOM 0 HG22 ILE A 24 2.948 -4.985 16.949 1.00 0.00 H new ATOM 0 HG23 ILE A 24 3.598 -5.567 15.398 1.00 0.00 H new ATOM 0 HD11 ILE A 24 0.844 -2.985 12.266 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -0.209 -3.925 13.350 1.00 0.00 H new ATOM 0 HD13 ILE A 24 0.532 -2.410 13.920 1.00 0.00 H new ATOM 370 N THR A 25 -0.786 -6.740 16.774 1.00 0.00 N ATOM 371 CA THR A 25 -1.736 -6.864 17.882 1.00 0.00 C ATOM 372 C THR A 25 -1.161 -7.740 18.997 1.00 0.00 C ATOM 373 O THR A 25 -1.490 -7.563 20.174 1.00 0.00 O ATOM 374 CB THR A 25 -3.098 -7.437 17.388 1.00 0.00 C ATOM 375 OG1 THR A 25 -4.008 -7.597 18.485 1.00 0.00 O ATOM 376 CG2 THR A 25 -2.939 -8.772 16.653 1.00 0.00 C ATOM 0 H THR A 25 -0.744 -7.567 16.179 1.00 0.00 H new ATOM 0 HA THR A 25 -1.911 -5.866 18.284 1.00 0.00 H new ATOM 0 HB THR A 25 -3.502 -6.714 16.680 1.00 0.00 H new ATOM 0 HG1 THR A 25 -4.858 -7.956 18.155 1.00 0.00 H new ATOM 0 HG21 THR A 25 -3.917 -9.128 16.330 1.00 0.00 H new ATOM 0 HG22 THR A 25 -2.297 -8.634 15.783 1.00 0.00 H new ATOM 0 HG23 THR A 25 -2.489 -9.505 17.323 1.00 0.00 H new ATOM 384 N THR A 26 -0.293 -8.668 18.599 1.00 0.00 N ATOM 385 CA THR A 26 0.350 -9.589 19.534 1.00 0.00 C ATOM 386 C THR A 26 1.853 -9.316 19.606 1.00 0.00 C ATOM 387 O THR A 26 2.369 -8.867 20.634 1.00 0.00 O ATOM 388 CB THR A 26 0.081 -11.071 19.141 1.00 0.00 C ATOM 389 OG1 THR A 26 -1.263 -11.220 18.663 1.00 0.00 O ATOM 390 CG2 THR A 26 0.293 -12.012 20.324 1.00 0.00 C ATOM 0 H THR A 26 -0.017 -8.802 17.626 1.00 0.00 H new ATOM 0 HA THR A 26 -0.082 -9.422 20.521 1.00 0.00 H new ATOM 0 HB THR A 26 0.789 -11.333 18.355 1.00 0.00 H new ATOM 0 HG1 THR A 26 -1.421 -12.155 18.417 1.00 0.00 H new ATOM 0 HG21 THR A 26 0.096 -13.038 20.013 1.00 0.00 H new ATOM 0 HG22 THR A 26 1.322 -11.930 20.674 1.00 0.00 H new ATOM 0 HG23 THR A 26 -0.388 -11.741 21.131 1.00 0.00 H new ATOM 398 N GLY A 27 2.521 -9.583 18.496 1.00 0.00 N ATOM 399 CA GLY A 27 3.959 -9.381 18.387 1.00 0.00 C ATOM 400 C GLY A 27 4.439 -9.506 16.957 1.00 0.00 C ATOM 401 O GLY A 27 4.217 -10.537 16.317 1.00 0.00 O ATOM 0 H GLY A 27 2.085 -9.944 17.648 1.00 0.00 H new ATOM 0 HA2 GLY A 27 4.217 -8.394 18.772 1.00 0.00 H new ATOM 0 HA3 GLY A 27 4.477 -10.111 19.009 1.00 0.00 H new ATOM 405 N PHE A 28 5.119 -8.461 16.462 1.00 0.00 N ATOM 406 CA PHE A 28 5.621 -8.430 15.091 1.00 0.00 C ATOM 407 C PHE A 28 6.839 -9.309 14.867 1.00 0.00 C ATOM 408 O PHE A 28 7.536 -9.689 15.810 1.00 0.00 O ATOM 409 CB PHE A 28 5.863 -6.994 14.624 1.00 0.00 C ATOM 410 CG PHE A 28 5.251 -6.719 13.271 1.00 0.00 C ATOM 411 CD1 PHE A 28 3.873 -6.790 13.063 1.00 0.00 C ATOM 412 CD2 PHE A 28 6.060 -6.419 12.197 1.00 0.00 C ATOM 413 CE1 PHE A 28 3.338 -6.566 11.811 1.00 0.00 C ATOM 414 CE2 PHE A 28 5.530 -6.188 10.945 1.00 0.00 C ATOM 415 CZ PHE A 28 4.168 -6.264 10.752 1.00 0.00 C ATOM 0 H PHE A 28 5.332 -7.622 17.001 1.00 0.00 H new ATOM 0 HA PHE A 28 4.835 -8.862 14.472 1.00 0.00 H new ATOM 0 HB2 PHE A 28 5.447 -6.302 15.356 1.00 0.00 H new ATOM 0 HB3 PHE A 28 6.936 -6.805 14.580 1.00 0.00 H new ATOM 0 HD1 PHE A 28 3.219 -7.023 13.890 1.00 0.00 H new ATOM 0 HD2 PHE A 28 7.129 -6.364 12.338 1.00 0.00 H new ATOM 0 HE1 PHE A 28 2.270 -6.627 11.661 1.00 0.00 H new ATOM 0 HE2 PHE A 28 6.181 -5.948 10.118 1.00 0.00 H new ATOM 0 HZ PHE A 28 3.751 -6.087 9.772 1.00 0.00 H new ATOM 425 N ASN A 29 7.020 -9.672 13.585 1.00 0.00 N ATOM 426 CA ASN A 29 8.079 -10.549 13.098 1.00 0.00 C ATOM 427 C ASN A 29 9.513 -10.071 13.377 1.00 0.00 C ATOM 428 O ASN A 29 10.439 -10.340 12.598 1.00 0.00 O ATOM 429 CB ASN A 29 7.874 -10.750 11.603 1.00 0.00 C ATOM 430 CG ASN A 29 6.681 -11.615 11.276 1.00 0.00 C ATOM 431 OD1 ASN A 29 6.741 -12.843 11.348 1.00 0.00 O ATOM 432 ND2 ASN A 29 5.594 -10.968 10.898 1.00 0.00 N ATOM 0 H ASN A 29 6.406 -9.346 12.839 1.00 0.00 H new ATOM 0 HA ASN A 29 7.993 -11.481 13.656 1.00 0.00 H new ATOM 0 HB2 ASN A 29 7.751 -9.778 11.126 1.00 0.00 H new ATOM 0 HB3 ASN A 29 8.770 -11.203 11.178 1.00 0.00 H new ATOM 0 HD21 ASN A 29 4.752 -11.487 10.649 1.00 0.00 H new ATOM 0 HD22 ASN A 29 5.596 -9.949 10.855 1.00 0.00 H new ATOM 439 N GLY A 30 9.684 -9.383 14.487 1.00 0.00 N ATOM 440 CA GLY A 30 10.989 -8.883 14.871 1.00 0.00 C ATOM 441 C GLY A 30 11.118 -7.410 14.590 1.00 0.00 C ATOM 442 O GLY A 30 12.161 -6.811 14.859 1.00 0.00 O ATOM 0 H GLY A 30 8.934 -9.157 15.141 1.00 0.00 H new ATOM 0 HA2 GLY A 30 11.153 -9.068 15.933 1.00 0.00 H new ATOM 0 HA3 GLY A 30 11.763 -9.427 14.329 1.00 0.00 H new ATOM 446 N TYR A 31 10.051 -6.841 14.021 1.00 0.00 N ATOM 447 CA TYR A 31 10.005 -5.403 13.722 1.00 0.00 C ATOM 448 C TYR A 31 9.148 -4.697 14.800 1.00 0.00 C ATOM 449 O TYR A 31 7.941 -4.501 14.605 1.00 0.00 O ATOM 450 CB TYR A 31 9.441 -5.126 12.310 1.00 0.00 C ATOM 451 CG TYR A 31 9.960 -6.046 11.216 1.00 0.00 C ATOM 452 CD1 TYR A 31 9.345 -7.266 10.944 1.00 0.00 C ATOM 453 CD2 TYR A 31 11.056 -5.685 10.446 1.00 0.00 C ATOM 454 CE1 TYR A 31 9.811 -8.094 9.941 1.00 0.00 C ATOM 455 CE2 TYR A 31 11.529 -6.508 9.442 1.00 0.00 C ATOM 456 CZ TYR A 31 10.903 -7.711 9.193 1.00 0.00 C ATOM 457 OH TYR A 31 11.368 -8.531 8.192 1.00 0.00 O ATOM 0 H TYR A 31 9.208 -7.351 13.758 1.00 0.00 H new ATOM 0 HA TYR A 31 11.022 -5.010 13.738 1.00 0.00 H new ATOM 0 HB2 TYR A 31 8.355 -5.208 12.347 1.00 0.00 H new ATOM 0 HB3 TYR A 31 9.674 -4.096 12.038 1.00 0.00 H new ATOM 0 HD1 TYR A 31 8.489 -7.570 11.528 1.00 0.00 H new ATOM 0 HD2 TYR A 31 11.549 -4.743 10.635 1.00 0.00 H new ATOM 0 HE1 TYR A 31 9.322 -9.037 9.744 1.00 0.00 H new ATOM 0 HE2 TYR A 31 12.385 -6.210 8.855 1.00 0.00 H new ATOM 0 HH TYR A 31 12.143 -8.114 7.761 1.00 0.00 H new ATOM 467 N PRO A 32 9.753 -4.311 15.974 1.00 0.00 N ATOM 468 CA PRO A 32 9.019 -3.662 17.076 1.00 0.00 C ATOM 469 C PRO A 32 8.754 -2.174 16.842 1.00 0.00 C ATOM 470 O PRO A 32 9.616 -1.455 16.326 1.00 0.00 O ATOM 471 CB PRO A 32 9.948 -3.837 18.294 1.00 0.00 C ATOM 472 CG PRO A 32 11.112 -4.649 17.820 1.00 0.00 C ATOM 473 CD PRO A 32 11.174 -4.472 16.334 1.00 0.00 C ATOM 0 HA PRO A 32 8.032 -4.109 17.194 1.00 0.00 H new ATOM 0 HB2 PRO A 32 10.277 -2.870 18.674 1.00 0.00 H new ATOM 0 HB3 PRO A 32 9.429 -4.340 19.110 1.00 0.00 H new ATOM 0 HG2 PRO A 32 12.037 -4.314 18.290 1.00 0.00 H new ATOM 0 HG3 PRO A 32 10.985 -5.700 18.081 1.00 0.00 H new ATOM 0 HD2 PRO A 32 11.765 -3.600 16.053 1.00 0.00 H new ATOM 0 HD3 PRO A 32 11.623 -5.334 15.841 1.00 0.00 H new ATOM 481 N GLY A 33 7.551 -1.730 17.227 1.00 0.00 N ATOM 482 CA GLY A 33 7.172 -0.323 17.074 1.00 0.00 C ATOM 483 C GLY A 33 6.495 -0.026 15.743 1.00 0.00 C ATOM 484 O GLY A 33 6.171 1.127 15.448 1.00 0.00 O ATOM 0 H GLY A 33 6.830 -2.320 17.643 1.00 0.00 H new ATOM 0 HA2 GLY A 33 6.501 -0.044 17.886 1.00 0.00 H new ATOM 0 HA3 GLY A 33 8.062 0.299 17.168 1.00 0.00 H new ATOM 488 N HIS A 34 6.266 -1.086 14.958 1.00 0.00 N ATOM 489 CA HIS A 34 5.644 -1.013 13.653 1.00 0.00 C ATOM 490 C HIS A 34 4.123 -0.901 13.802 1.00 0.00 C ATOM 491 O HIS A 34 3.517 -1.636 14.585 1.00 0.00 O ATOM 492 CB HIS A 34 6.039 -2.269 12.857 1.00 0.00 C ATOM 493 CG HIS A 34 5.954 -2.138 11.364 1.00 0.00 C ATOM 494 ND1 HIS A 34 5.254 -3.010 10.569 1.00 0.00 N ATOM 495 CD2 HIS A 34 6.472 -1.204 10.518 1.00 0.00 C ATOM 496 CE1 HIS A 34 5.362 -2.589 9.305 1.00 0.00 C ATOM 497 NE2 HIS A 34 6.085 -1.497 9.225 1.00 0.00 N ATOM 0 H HIS A 34 6.518 -2.036 15.230 1.00 0.00 H new ATOM 0 HA HIS A 34 5.985 -0.128 13.116 1.00 0.00 H new ATOM 0 HB2 HIS A 34 7.060 -2.541 13.123 1.00 0.00 H new ATOM 0 HB3 HIS A 34 5.398 -3.093 13.170 1.00 0.00 H new ATOM 0 HD1 HIS A 34 4.742 -3.833 10.886 1.00 0.00 H new ATOM 0 HD2 HIS A 34 7.088 -0.367 10.812 1.00 0.00 H new ATOM 0 HE1 HIS A 34 4.912 -3.084 8.458 1.00 0.00 H new ATOM 505 N VAL A 35 3.533 0.036 13.064 1.00 0.00 N ATOM 506 CA VAL A 35 2.088 0.283 13.114 1.00 0.00 C ATOM 507 C VAL A 35 1.368 -0.309 11.899 1.00 0.00 C ATOM 508 O VAL A 35 0.138 -0.370 11.875 1.00 0.00 O ATOM 509 CB VAL A 35 1.740 1.796 13.215 1.00 0.00 C ATOM 510 CG1 VAL A 35 1.228 2.152 14.609 1.00 0.00 C ATOM 511 CG2 VAL A 35 2.923 2.692 12.844 1.00 0.00 C ATOM 0 H VAL A 35 4.036 0.644 12.417 1.00 0.00 H new ATOM 0 HA VAL A 35 1.742 -0.213 14.021 1.00 0.00 H new ATOM 0 HB VAL A 35 0.947 1.980 12.490 1.00 0.00 H new ATOM 0 HG11 VAL A 35 0.993 3.216 14.650 1.00 0.00 H new ATOM 0 HG12 VAL A 35 0.330 1.573 14.826 1.00 0.00 H new ATOM 0 HG13 VAL A 35 1.995 1.922 15.348 1.00 0.00 H new ATOM 0 HG21 VAL A 35 2.628 3.738 12.931 1.00 0.00 H new ATOM 0 HG22 VAL A 35 3.756 2.493 13.518 1.00 0.00 H new ATOM 0 HG23 VAL A 35 3.229 2.485 11.818 1.00 0.00 H new ATOM 521 N GLY A 36 2.138 -0.748 10.900 1.00 0.00 N ATOM 522 CA GLY A 36 1.568 -1.330 9.699 1.00 0.00 C ATOM 523 C GLY A 36 2.205 -2.652 9.353 1.00 0.00 C ATOM 524 O GLY A 36 2.632 -3.395 10.241 1.00 0.00 O ATOM 0 H GLY A 36 3.157 -0.708 10.906 1.00 0.00 H new ATOM 0 HA2 GLY A 36 0.496 -1.470 9.838 1.00 0.00 H new ATOM 0 HA3 GLY A 36 1.694 -0.638 8.866 1.00 0.00 H new ATOM 528 N VAL A 37 2.243 -2.948 8.060 1.00 0.00 N ATOM 529 CA VAL A 37 2.833 -4.188 7.556 1.00 0.00 C ATOM 530 C VAL A 37 3.818 -3.890 6.405 1.00 0.00 C ATOM 531 O VAL A 37 3.653 -2.907 5.677 1.00 0.00 O ATOM 532 CB VAL A 37 1.725 -5.207 7.135 1.00 0.00 C ATOM 533 CG1 VAL A 37 0.918 -4.712 5.943 1.00 0.00 C ATOM 534 CG2 VAL A 37 2.306 -6.595 6.857 1.00 0.00 C ATOM 0 H VAL A 37 1.868 -2.340 7.332 1.00 0.00 H new ATOM 0 HA VAL A 37 3.402 -4.654 8.360 1.00 0.00 H new ATOM 0 HB VAL A 37 1.045 -5.292 7.982 1.00 0.00 H new ATOM 0 HG11 VAL A 37 0.160 -5.451 5.685 1.00 0.00 H new ATOM 0 HG12 VAL A 37 0.434 -3.769 6.198 1.00 0.00 H new ATOM 0 HG13 VAL A 37 1.582 -4.561 5.092 1.00 0.00 H new ATOM 0 HG21 VAL A 37 1.504 -7.274 6.568 1.00 0.00 H new ATOM 0 HG22 VAL A 37 3.035 -6.529 6.049 1.00 0.00 H new ATOM 0 HG23 VAL A 37 2.794 -6.972 7.756 1.00 0.00 H new ATOM 544 N ASP A 38 4.822 -4.761 6.249 1.00 0.00 N ATOM 545 CA ASP A 38 5.841 -4.595 5.211 1.00 0.00 C ATOM 546 C ASP A 38 5.978 -5.848 4.363 1.00 0.00 C ATOM 547 O ASP A 38 6.093 -6.963 4.881 1.00 0.00 O ATOM 548 CB ASP A 38 7.177 -4.171 5.846 1.00 0.00 C ATOM 549 CG ASP A 38 7.087 -2.806 6.499 1.00 0.00 C ATOM 550 OD1 ASP A 38 6.252 -1.987 6.050 1.00 0.00 O ATOM 551 OD2 ASP A 38 7.777 -2.597 7.518 1.00 0.00 O ATOM 0 H ASP A 38 4.949 -5.589 6.831 1.00 0.00 H new ATOM 0 HA ASP A 38 5.526 -3.800 4.535 1.00 0.00 H new ATOM 0 HB2 ASP A 38 7.476 -4.910 6.590 1.00 0.00 H new ATOM 0 HB3 ASP A 38 7.954 -4.157 5.081 1.00 0.00 H new ATOM 556 N TYR A 39 5.979 -5.627 3.044 1.00 0.00 N ATOM 557 CA TYR A 39 6.055 -6.697 2.056 1.00 0.00 C ATOM 558 C TYR A 39 7.310 -6.571 1.202 1.00 0.00 C ATOM 559 O TYR A 39 7.448 -5.634 0.402 1.00 0.00 O ATOM 560 CB TYR A 39 4.845 -6.672 1.108 1.00 0.00 C ATOM 561 CG TYR A 39 3.484 -6.474 1.745 1.00 0.00 C ATOM 562 CD1 TYR A 39 3.090 -5.216 2.159 1.00 0.00 C ATOM 563 CD2 TYR A 39 2.581 -7.523 1.886 1.00 0.00 C ATOM 564 CE1 TYR A 39 1.846 -5.000 2.694 1.00 0.00 C ATOM 565 CE2 TYR A 39 1.326 -7.311 2.431 1.00 0.00 C ATOM 566 CZ TYR A 39 0.964 -6.049 2.829 1.00 0.00 C ATOM 567 OH TYR A 39 -0.288 -5.833 3.361 1.00 0.00 O ATOM 0 H TYR A 39 5.927 -4.694 2.635 1.00 0.00 H new ATOM 0 HA TYR A 39 6.072 -7.631 2.617 1.00 0.00 H new ATOM 0 HB2 TYR A 39 4.999 -5.875 0.381 1.00 0.00 H new ATOM 0 HB3 TYR A 39 4.828 -7.610 0.554 1.00 0.00 H new ATOM 0 HD1 TYR A 39 3.775 -4.387 2.059 1.00 0.00 H new ATOM 0 HD2 TYR A 39 2.863 -8.515 1.566 1.00 0.00 H new ATOM 0 HE1 TYR A 39 1.558 -4.008 3.009 1.00 0.00 H new ATOM 0 HE2 TYR A 39 0.636 -8.134 2.542 1.00 0.00 H new ATOM 0 HH TYR A 39 -0.784 -6.678 3.385 1.00 0.00 H new ATOM 577 N ALA A 40 8.218 -7.519 1.386 1.00 0.00 N ATOM 578 CA ALA A 40 9.465 -7.587 0.617 1.00 0.00 C ATOM 579 C ALA A 40 9.192 -7.740 -0.891 1.00 0.00 C ATOM 580 O ALA A 40 8.897 -8.838 -1.383 1.00 0.00 O ATOM 581 CB ALA A 40 10.334 -8.728 1.131 1.00 0.00 C ATOM 0 H ALA A 40 8.116 -8.267 2.072 1.00 0.00 H new ATOM 0 HA ALA A 40 10.001 -6.648 0.755 1.00 0.00 H new ATOM 0 HB1 ALA A 40 11.258 -8.770 0.554 1.00 0.00 H new ATOM 0 HB2 ALA A 40 10.570 -8.561 2.182 1.00 0.00 H new ATOM 0 HB3 ALA A 40 9.797 -9.671 1.026 1.00 0.00 H new ATOM 587 N VAL A 41 9.284 -6.614 -1.604 1.00 0.00 N ATOM 588 CA VAL A 41 9.047 -6.561 -3.039 1.00 0.00 C ATOM 589 C VAL A 41 10.038 -5.561 -3.681 1.00 0.00 C ATOM 590 O VAL A 41 10.153 -4.428 -3.205 1.00 0.00 O ATOM 591 CB VAL A 41 7.551 -6.212 -3.373 1.00 0.00 C ATOM 592 CG1 VAL A 41 7.150 -4.809 -2.911 1.00 0.00 C ATOM 593 CG2 VAL A 41 7.252 -6.401 -4.861 1.00 0.00 C ATOM 0 H VAL A 41 9.527 -5.712 -1.195 1.00 0.00 H new ATOM 0 HA VAL A 41 9.223 -7.549 -3.465 1.00 0.00 H new ATOM 0 HB VAL A 41 6.941 -6.917 -2.807 1.00 0.00 H new ATOM 0 HG11 VAL A 41 6.107 -4.625 -3.169 1.00 0.00 H new ATOM 0 HG12 VAL A 41 7.276 -4.732 -1.831 1.00 0.00 H new ATOM 0 HG13 VAL A 41 7.781 -4.069 -3.404 1.00 0.00 H new ATOM 0 HG21 VAL A 41 6.209 -6.151 -5.057 1.00 0.00 H new ATOM 0 HG22 VAL A 41 7.898 -5.748 -5.448 1.00 0.00 H new ATOM 0 HG23 VAL A 41 7.435 -7.439 -5.140 1.00 0.00 H new ATOM 603 N PRO A 42 10.772 -5.970 -4.759 1.00 0.00 N ATOM 604 CA PRO A 42 11.762 -5.108 -5.449 1.00 0.00 C ATOM 605 C PRO A 42 11.285 -3.714 -5.814 1.00 0.00 C ATOM 606 O PRO A 42 10.155 -3.489 -6.255 1.00 0.00 O ATOM 607 CB PRO A 42 12.110 -5.901 -6.706 1.00 0.00 C ATOM 608 CG PRO A 42 11.908 -7.319 -6.316 1.00 0.00 C ATOM 609 CD PRO A 42 10.740 -7.324 -5.366 1.00 0.00 C ATOM 0 HA PRO A 42 12.601 -4.905 -4.783 1.00 0.00 H new ATOM 0 HB2 PRO A 42 11.467 -5.623 -7.542 1.00 0.00 H new ATOM 0 HB3 PRO A 42 13.138 -5.718 -7.020 1.00 0.00 H new ATOM 0 HG2 PRO A 42 11.704 -7.939 -7.189 1.00 0.00 H new ATOM 0 HG3 PRO A 42 12.801 -7.724 -5.839 1.00 0.00 H new ATOM 0 HD2 PRO A 42 9.801 -7.506 -5.888 1.00 0.00 H new ATOM 0 HD3 PRO A 42 10.842 -8.103 -4.611 1.00 0.00 H new ATOM 617 N VAL A 43 12.224 -2.804 -5.607 1.00 0.00 N ATOM 618 CA VAL A 43 12.092 -1.375 -5.838 1.00 0.00 C ATOM 619 C VAL A 43 11.929 -1.011 -7.320 1.00 0.00 C ATOM 620 O VAL A 43 12.618 -1.564 -8.185 1.00 0.00 O ATOM 621 CB VAL A 43 13.335 -0.661 -5.219 1.00 0.00 C ATOM 622 CG1 VAL A 43 14.649 -1.324 -5.638 1.00 0.00 C ATOM 623 CG2 VAL A 43 13.378 0.837 -5.533 1.00 0.00 C ATOM 0 H VAL A 43 13.147 -3.056 -5.255 1.00 0.00 H new ATOM 0 HA VAL A 43 11.175 -1.036 -5.356 1.00 0.00 H new ATOM 0 HB VAL A 43 13.223 -0.769 -4.140 1.00 0.00 H new ATOM 0 HG11 VAL A 43 15.485 -0.793 -5.183 1.00 0.00 H new ATOM 0 HG12 VAL A 43 14.655 -2.362 -5.306 1.00 0.00 H new ATOM 0 HG13 VAL A 43 14.744 -1.289 -6.723 1.00 0.00 H new ATOM 0 HG21 VAL A 43 14.264 1.279 -5.077 1.00 0.00 H new ATOM 0 HG22 VAL A 43 13.416 0.981 -6.613 1.00 0.00 H new ATOM 0 HG23 VAL A 43 12.485 1.318 -5.133 1.00 0.00 H new ATOM 633 N GLY A 44 11.009 -0.079 -7.582 1.00 0.00 N ATOM 634 CA GLY A 44 10.785 0.387 -8.927 1.00 0.00 C ATOM 635 C GLY A 44 9.551 -0.200 -9.583 1.00 0.00 C ATOM 636 O GLY A 44 9.283 0.084 -10.755 1.00 0.00 O ATOM 0 H GLY A 44 10.417 0.358 -6.876 1.00 0.00 H new ATOM 0 HA2 GLY A 44 10.696 1.473 -8.915 1.00 0.00 H new ATOM 0 HA3 GLY A 44 11.657 0.146 -9.535 1.00 0.00 H new ATOM 640 N THR A 45 8.802 -1.018 -8.833 1.00 0.00 N ATOM 641 CA THR A 45 7.590 -1.633 -9.333 1.00 0.00 C ATOM 642 C THR A 45 6.389 -0.698 -9.096 1.00 0.00 C ATOM 643 O THR A 45 6.225 -0.199 -7.980 1.00 0.00 O ATOM 644 CB THR A 45 7.331 -3.007 -8.669 1.00 0.00 C ATOM 645 OG1 THR A 45 8.572 -3.692 -8.448 1.00 0.00 O ATOM 646 CG2 THR A 45 6.429 -3.883 -9.537 1.00 0.00 C ATOM 0 H THR A 45 9.027 -1.264 -7.869 1.00 0.00 H new ATOM 0 HA THR A 45 7.717 -1.799 -10.403 1.00 0.00 H new ATOM 0 HB THR A 45 6.832 -2.823 -7.718 1.00 0.00 H new ATOM 0 HG1 THR A 45 8.912 -3.473 -7.556 1.00 0.00 H new ATOM 0 HG21 THR A 45 6.267 -4.841 -9.042 1.00 0.00 H new ATOM 0 HG22 THR A 45 5.471 -3.384 -9.685 1.00 0.00 H new ATOM 0 HG23 THR A 45 6.905 -4.050 -10.503 1.00 0.00 H new ATOM 654 N PRO A 46 5.520 -0.445 -10.129 1.00 0.00 N ATOM 655 CA PRO A 46 4.356 0.451 -9.977 1.00 0.00 C ATOM 656 C PRO A 46 3.369 -0.027 -8.911 1.00 0.00 C ATOM 657 O PRO A 46 2.939 -1.185 -8.916 1.00 0.00 O ATOM 658 CB PRO A 46 3.684 0.437 -11.359 1.00 0.00 C ATOM 659 CG PRO A 46 4.728 -0.053 -12.299 1.00 0.00 C ATOM 660 CD PRO A 46 5.592 -0.993 -11.507 1.00 0.00 C ATOM 0 HA PRO A 46 4.670 1.442 -9.651 1.00 0.00 H new ATOM 0 HB2 PRO A 46 2.811 -0.216 -11.365 1.00 0.00 H new ATOM 0 HB3 PRO A 46 3.339 1.432 -11.639 1.00 0.00 H new ATOM 0 HG2 PRO A 46 4.278 -0.562 -13.151 1.00 0.00 H new ATOM 0 HG3 PRO A 46 5.315 0.775 -12.696 1.00 0.00 H new ATOM 0 HD2 PRO A 46 5.220 -2.016 -11.553 1.00 0.00 H new ATOM 0 HD3 PRO A 46 6.616 -1.009 -11.880 1.00 0.00 H new ATOM 668 N VAL A 47 3.035 0.885 -7.997 1.00 0.00 N ATOM 669 CA VAL A 47 2.108 0.624 -6.926 1.00 0.00 C ATOM 670 C VAL A 47 0.770 1.195 -7.292 1.00 0.00 C ATOM 671 O VAL A 47 0.631 2.386 -7.591 1.00 0.00 O ATOM 672 CB VAL A 47 2.578 1.195 -5.556 1.00 0.00 C ATOM 673 CG1 VAL A 47 1.751 0.632 -4.400 1.00 0.00 C ATOM 674 CG2 VAL A 47 4.054 0.910 -5.316 1.00 0.00 C ATOM 0 H VAL A 47 3.412 1.833 -7.991 1.00 0.00 H new ATOM 0 HA VAL A 47 2.046 -0.457 -6.801 1.00 0.00 H new ATOM 0 HB VAL A 47 2.430 2.274 -5.596 1.00 0.00 H new ATOM 0 HG11 VAL A 47 2.107 1.052 -3.459 1.00 0.00 H new ATOM 0 HG12 VAL A 47 0.703 0.894 -4.541 1.00 0.00 H new ATOM 0 HG13 VAL A 47 1.853 -0.453 -4.374 1.00 0.00 H new ATOM 0 HG21 VAL A 47 4.352 1.321 -4.351 1.00 0.00 H new ATOM 0 HG22 VAL A 47 4.222 -0.167 -5.319 1.00 0.00 H new ATOM 0 HG23 VAL A 47 4.647 1.372 -6.106 1.00 0.00 H new ATOM 684 N ARG A 48 -0.188 0.301 -7.277 1.00 0.00 N ATOM 685 CA ARG A 48 -1.547 0.622 -7.602 1.00 0.00 C ATOM 686 C ARG A 48 -2.400 0.758 -6.366 1.00 0.00 C ATOM 687 O ARG A 48 -2.146 0.120 -5.339 1.00 0.00 O ATOM 688 CB ARG A 48 -2.149 -0.417 -8.558 1.00 0.00 C ATOM 689 CG ARG A 48 -1.550 -0.394 -9.958 1.00 0.00 C ATOM 690 CD ARG A 48 -1.413 -1.793 -10.535 1.00 0.00 C ATOM 691 NE ARG A 48 -0.733 -1.784 -11.836 1.00 0.00 N ATOM 692 CZ ARG A 48 -0.851 -2.741 -12.769 1.00 0.00 C ATOM 693 NH1 ARG A 48 -1.624 -3.807 -12.570 1.00 0.00 N ATOM 694 NH2 ARG A 48 -0.184 -2.628 -13.909 1.00 0.00 N ATOM 0 H ARG A 48 -0.040 -0.679 -7.036 1.00 0.00 H new ATOM 0 HA ARG A 48 -1.535 1.588 -8.107 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -2.011 -1.411 -8.132 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -3.223 -0.248 -8.631 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -2.179 0.209 -10.613 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -0.571 0.084 -9.927 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -0.856 -2.420 -9.839 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -2.402 -2.239 -10.645 1.00 0.00 H new ATOM 0 HE ARG A 48 -0.126 -0.992 -12.046 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -2.140 -3.907 -11.696 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -1.700 -4.524 -13.292 1.00 0.00 H new ATOM 0 HH21 ARG A 48 0.414 -1.818 -14.072 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -0.268 -3.351 -14.623 1.00 0.00 H new ATOM 708 N ALA A 49 -3.441 1.583 -6.498 1.00 0.00 N ATOM 709 CA ALA A 49 -4.359 1.856 -5.414 1.00 0.00 C ATOM 710 C ALA A 49 -5.268 0.663 -5.152 1.00 0.00 C ATOM 711 O ALA A 49 -5.930 0.161 -6.059 1.00 0.00 O ATOM 712 CB ALA A 49 -5.180 3.102 -5.707 1.00 0.00 C ATOM 0 H ALA A 49 -3.663 2.076 -7.363 1.00 0.00 H new ATOM 0 HA ALA A 49 -3.772 2.035 -4.513 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -5.864 3.290 -4.880 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -4.514 3.956 -5.828 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -5.751 2.954 -6.624 1.00 0.00 H new ATOM 718 N VAL A 50 -5.248 0.186 -3.912 1.00 0.00 N ATOM 719 CA VAL A 50 -6.067 -0.965 -3.504 1.00 0.00 C ATOM 720 C VAL A 50 -7.582 -0.650 -3.503 1.00 0.00 C ATOM 721 O VAL A 50 -8.409 -1.566 -3.493 1.00 0.00 O ATOM 722 CB VAL A 50 -5.619 -1.524 -2.128 1.00 0.00 C ATOM 723 CG1 VAL A 50 -6.331 -2.829 -1.775 1.00 0.00 C ATOM 724 CG2 VAL A 50 -4.111 -1.740 -2.082 1.00 0.00 C ATOM 0 H VAL A 50 -4.673 0.576 -3.165 1.00 0.00 H new ATOM 0 HA VAL A 50 -5.903 -1.737 -4.256 1.00 0.00 H new ATOM 0 HB VAL A 50 -5.896 -0.773 -1.388 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -5.984 -3.181 -0.803 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -7.407 -2.658 -1.736 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -6.110 -3.580 -2.533 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -3.829 -2.132 -1.105 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -3.822 -2.451 -2.856 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -3.602 -0.791 -2.253 1.00 0.00 H new ATOM 734 N ALA A 51 -7.930 0.645 -3.535 1.00 0.00 N ATOM 735 CA ALA A 51 -9.315 1.103 -3.556 1.00 0.00 C ATOM 736 C ALA A 51 -9.376 2.599 -3.797 1.00 0.00 C ATOM 737 O ALA A 51 -8.518 3.353 -3.331 1.00 0.00 O ATOM 738 CB ALA A 51 -10.039 0.758 -2.264 1.00 0.00 C ATOM 0 H ALA A 51 -7.249 1.404 -3.547 1.00 0.00 H new ATOM 0 HA ALA A 51 -9.817 0.586 -4.374 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -11.068 1.115 -2.317 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -10.037 -0.323 -2.123 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -9.532 1.234 -1.425 1.00 0.00 H new ATOM 744 N ASN A 52 -10.390 3.007 -4.561 1.00 0.00 N ATOM 745 CA ASN A 52 -10.635 4.398 -4.896 1.00 0.00 C ATOM 746 C ASN A 52 -10.911 5.255 -3.656 1.00 0.00 C ATOM 747 O ASN A 52 -11.357 4.741 -2.626 1.00 0.00 O ATOM 748 CB ASN A 52 -11.810 4.496 -5.884 1.00 0.00 C ATOM 749 CG ASN A 52 -13.001 3.597 -5.578 1.00 0.00 C ATOM 750 OD1 ASN A 52 -13.598 3.010 -6.480 1.00 0.00 O ATOM 751 ND2 ASN A 52 -13.352 3.504 -4.315 1.00 0.00 N ATOM 0 H ASN A 52 -11.071 2.365 -4.967 1.00 0.00 H new ATOM 0 HA ASN A 52 -9.730 4.789 -5.360 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -12.155 5.530 -5.910 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -11.443 4.257 -6.882 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -14.150 2.927 -4.049 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -12.827 4.009 -3.601 1.00 0.00 H new ATOM 758 N GLY A 53 -10.647 6.554 -3.781 1.00 0.00 N ATOM 759 CA GLY A 53 -10.859 7.475 -2.674 1.00 0.00 C ATOM 760 C GLY A 53 -10.262 8.848 -2.909 1.00 0.00 C ATOM 761 O GLY A 53 -10.537 9.485 -3.931 1.00 0.00 O ATOM 0 H GLY A 53 -10.289 6.987 -4.632 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -11.930 7.578 -2.497 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -10.426 7.049 -1.769 1.00 0.00 H new ATOM 765 N THR A 54 -9.433 9.293 -1.955 1.00 0.00 N ATOM 766 CA THR A 54 -8.804 10.584 -1.988 1.00 0.00 C ATOM 767 C THR A 54 -7.428 10.500 -1.335 1.00 0.00 C ATOM 768 O THR A 54 -7.256 9.817 -0.326 1.00 0.00 O ATOM 769 CB THR A 54 -9.664 11.609 -1.238 1.00 0.00 C ATOM 770 OG1 THR A 54 -11.041 11.479 -1.620 1.00 0.00 O ATOM 771 CG2 THR A 54 -9.210 13.048 -1.481 1.00 0.00 C ATOM 0 H THR A 54 -9.188 8.743 -1.132 1.00 0.00 H new ATOM 0 HA THR A 54 -8.697 10.899 -3.026 1.00 0.00 H new ATOM 0 HB THR A 54 -9.546 11.397 -0.175 1.00 0.00 H new ATOM 0 HG1 THR A 54 -11.579 12.138 -1.133 1.00 0.00 H new ATOM 0 HG21 THR A 54 -9.853 13.731 -0.926 1.00 0.00 H new ATOM 0 HG22 THR A 54 -8.180 13.166 -1.145 1.00 0.00 H new ATOM 0 HG23 THR A 54 -9.272 13.274 -2.545 1.00 0.00 H new ATOM 779 N VAL A 55 -6.471 11.218 -1.917 1.00 0.00 N ATOM 780 CA VAL A 55 -5.104 11.276 -1.439 1.00 0.00 C ATOM 781 C VAL A 55 -5.008 12.347 -0.348 1.00 0.00 C ATOM 782 O VAL A 55 -5.203 13.536 -0.602 1.00 0.00 O ATOM 783 CB VAL A 55 -4.107 11.617 -2.585 1.00 0.00 C ATOM 784 CG1 VAL A 55 -2.656 11.406 -2.165 1.00 0.00 C ATOM 785 CG2 VAL A 55 -4.397 10.820 -3.855 1.00 0.00 C ATOM 0 H VAL A 55 -6.633 11.784 -2.750 1.00 0.00 H new ATOM 0 HA VAL A 55 -4.836 10.296 -1.044 1.00 0.00 H new ATOM 0 HB VAL A 55 -4.253 12.675 -2.802 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -1.997 11.656 -2.996 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -2.427 12.047 -1.314 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -2.506 10.363 -1.884 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -3.677 11.091 -4.627 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -4.317 9.754 -3.642 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -5.405 11.046 -4.204 1.00 0.00 H new ATOM 795 N LYS A 56 -4.749 11.888 0.853 1.00 0.00 N ATOM 796 CA LYS A 56 -4.611 12.749 2.033 1.00 0.00 C ATOM 797 C LYS A 56 -3.147 13.081 2.288 1.00 0.00 C ATOM 798 O LYS A 56 -2.826 13.988 3.063 1.00 0.00 O ATOM 799 CB LYS A 56 -5.220 12.109 3.307 1.00 0.00 C ATOM 800 CG LYS A 56 -6.300 11.038 3.083 1.00 0.00 C ATOM 801 CD LYS A 56 -7.410 11.491 2.134 1.00 0.00 C ATOM 802 CE LYS A 56 -8.521 12.248 2.853 1.00 0.00 C ATOM 803 NZ LYS A 56 -9.664 12.543 1.946 1.00 0.00 N ATOM 0 H LYS A 56 -4.624 10.896 1.055 1.00 0.00 H new ATOM 0 HA LYS A 56 -5.165 13.662 1.817 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -4.411 11.663 3.886 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -5.648 12.904 3.918 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -5.833 10.138 2.682 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -6.740 10.768 4.043 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -6.983 12.128 1.359 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -7.833 10.620 1.633 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -8.872 11.660 3.701 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -8.125 13.181 3.254 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -10.311 13.213 2.409 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -9.308 12.961 1.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -10.173 11.662 1.731 1.00 0.00 H new ATOM 817 N PHE A 57 -2.272 12.316 1.633 1.00 0.00 N ATOM 818 CA PHE A 57 -0.831 12.480 1.730 1.00 0.00 C ATOM 819 C PHE A 57 -0.153 11.910 0.493 1.00 0.00 C ATOM 820 O PHE A 57 -0.539 10.858 -0.026 1.00 0.00 O ATOM 821 CB PHE A 57 -0.248 11.816 2.990 1.00 0.00 C ATOM 822 CG PHE A 57 1.054 12.423 3.444 1.00 0.00 C ATOM 823 CD1 PHE A 57 1.075 13.406 4.421 1.00 0.00 C ATOM 824 CD2 PHE A 57 2.256 12.024 2.874 1.00 0.00 C ATOM 825 CE1 PHE A 57 2.270 13.977 4.823 1.00 0.00 C ATOM 826 CE2 PHE A 57 3.450 12.589 3.274 1.00 0.00 C ATOM 827 CZ PHE A 57 3.458 13.568 4.248 1.00 0.00 C ATOM 0 H PHE A 57 -2.554 11.556 1.013 1.00 0.00 H new ATOM 0 HA PHE A 57 -0.637 13.550 1.801 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -0.975 11.890 3.799 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -0.096 10.755 2.794 1.00 0.00 H new ATOM 0 HD1 PHE A 57 0.149 13.730 4.873 1.00 0.00 H new ATOM 0 HD2 PHE A 57 2.256 11.262 2.108 1.00 0.00 H new ATOM 0 HE1 PHE A 57 2.274 14.742 5.586 1.00 0.00 H new ATOM 0 HE2 PHE A 57 4.378 12.266 2.825 1.00 0.00 H new ATOM 0 HZ PHE A 57 4.391 14.013 4.560 1.00 0.00 H new ATOM 837 N ALA A 58 0.862 12.634 0.050 1.00 0.00 N ATOM 838 CA ALA A 58 1.663 12.293 -1.108 1.00 0.00 C ATOM 839 C ALA A 58 3.083 12.809 -0.897 1.00 0.00 C ATOM 840 O ALA A 58 3.409 13.964 -1.202 1.00 0.00 O ATOM 841 CB ALA A 58 1.049 12.860 -2.390 1.00 0.00 C ATOM 0 H ALA A 58 1.158 13.500 0.501 1.00 0.00 H new ATOM 0 HA ALA A 58 1.690 11.209 -1.223 1.00 0.00 H new ATOM 0 HB1 ALA A 58 1.671 12.588 -3.243 1.00 0.00 H new ATOM 0 HB2 ALA A 58 0.048 12.450 -2.526 1.00 0.00 H new ATOM 0 HB3 ALA A 58 0.989 13.946 -2.316 1.00 0.00 H new ATOM 847 N GLY A 59 3.909 11.929 -0.342 1.00 0.00 N ATOM 848 CA GLY A 59 5.302 12.235 -0.067 1.00 0.00 C ATOM 849 C GLY A 59 6.215 11.803 -1.192 1.00 0.00 C ATOM 850 O GLY A 59 6.698 10.663 -1.206 1.00 0.00 O ATOM 0 H GLY A 59 3.629 10.986 -0.072 1.00 0.00 H new ATOM 0 HA2 GLY A 59 5.411 13.307 0.096 1.00 0.00 H new ATOM 0 HA3 GLY A 59 5.606 11.740 0.855 1.00 0.00 H new ATOM 854 N ASN A 60 6.443 12.738 -2.126 1.00 0.00 N ATOM 855 CA ASN A 60 7.280 12.523 -3.308 1.00 0.00 C ATOM 856 C ASN A 60 8.757 12.407 -2.972 1.00 0.00 C ATOM 857 O ASN A 60 9.365 13.302 -2.379 1.00 0.00 O ATOM 858 CB ASN A 60 7.059 13.649 -4.323 1.00 0.00 C ATOM 859 CG ASN A 60 5.693 13.589 -4.968 1.00 0.00 C ATOM 860 OD1 ASN A 60 5.553 13.772 -6.177 1.00 0.00 O ATOM 861 ND2 ASN A 60 4.675 13.349 -4.158 1.00 0.00 N ATOM 0 H ASN A 60 6.045 13.676 -2.078 1.00 0.00 H new ATOM 0 HA ASN A 60 6.977 11.570 -3.741 1.00 0.00 H new ATOM 0 HB2 ASN A 60 7.180 14.611 -3.825 1.00 0.00 H new ATOM 0 HB3 ASN A 60 7.825 13.592 -5.096 1.00 0.00 H new ATOM 0 HD21 ASN A 60 3.726 13.310 -4.530 1.00 0.00 H new ATOM 0 HD22 ASN A 60 4.839 13.203 -3.162 1.00 0.00 H new ATOM 868 N GLY A 61 9.296 11.268 -3.377 1.00 0.00 N ATOM 869 CA GLY A 61 10.700 10.929 -3.167 1.00 0.00 C ATOM 870 C GLY A 61 11.637 11.564 -4.182 1.00 0.00 C ATOM 871 O GLY A 61 12.853 11.370 -4.117 1.00 0.00 O ATOM 0 H GLY A 61 8.769 10.544 -3.866 1.00 0.00 H new ATOM 0 HA2 GLY A 61 10.995 11.243 -2.166 1.00 0.00 H new ATOM 0 HA3 GLY A 61 10.814 9.846 -3.208 1.00 0.00 H new ATOM 875 N ALA A 62 11.064 12.319 -5.125 1.00 0.00 N ATOM 876 CA ALA A 62 11.829 12.979 -6.174 1.00 0.00 C ATOM 877 C ALA A 62 12.597 14.195 -5.668 1.00 0.00 C ATOM 878 O ALA A 62 13.690 14.496 -6.157 1.00 0.00 O ATOM 879 CB ALA A 62 10.903 13.384 -7.307 1.00 0.00 C ATOM 0 H ALA A 62 10.059 12.486 -5.178 1.00 0.00 H new ATOM 0 HA ALA A 62 12.569 12.263 -6.532 1.00 0.00 H new ATOM 0 HB1 ALA A 62 11.480 13.877 -8.089 1.00 0.00 H new ATOM 0 HB2 ALA A 62 10.420 12.497 -7.717 1.00 0.00 H new ATOM 0 HB3 ALA A 62 10.144 14.069 -6.929 1.00 0.00 H new ATOM 885 N ASN A 63 12.014 14.876 -4.685 1.00 0.00 N ATOM 886 CA ASN A 63 12.605 16.077 -4.118 1.00 0.00 C ATOM 887 C ASN A 63 12.462 16.120 -2.594 1.00 0.00 C ATOM 888 O ASN A 63 12.433 17.205 -1.995 1.00 0.00 O ATOM 889 CB ASN A 63 11.964 17.311 -4.735 1.00 0.00 C ATOM 890 CG ASN A 63 12.974 18.327 -5.202 1.00 0.00 C ATOM 891 OD1 ASN A 63 13.538 19.081 -4.409 1.00 0.00 O ATOM 892 ND2 ASN A 63 13.188 18.356 -6.505 1.00 0.00 N ATOM 0 H ASN A 63 11.124 14.610 -4.264 1.00 0.00 H new ATOM 0 HA ASN A 63 13.670 16.062 -4.349 1.00 0.00 H new ATOM 0 HB2 ASN A 63 11.344 17.008 -5.579 1.00 0.00 H new ATOM 0 HB3 ASN A 63 11.302 17.774 -4.003 1.00 0.00 H new ATOM 0 HD21 ASN A 63 13.848 19.027 -6.899 1.00 0.00 H new ATOM 0 HD22 ASN A 63 12.693 17.708 -7.118 1.00 0.00 H new ATOM 899 N HIS A 64 12.367 14.947 -1.962 1.00 0.00 N ATOM 900 CA HIS A 64 12.189 14.870 -0.540 1.00 0.00 C ATOM 901 C HIS A 64 13.505 14.999 0.268 1.00 0.00 C ATOM 902 O HIS A 64 14.380 14.132 0.172 1.00 0.00 O ATOM 903 CB HIS A 64 11.434 13.586 -0.166 1.00 0.00 C ATOM 904 CG HIS A 64 12.129 12.281 -0.473 1.00 0.00 C ATOM 905 ND1 HIS A 64 13.230 12.166 -1.301 1.00 0.00 N ATOM 906 CD2 HIS A 64 11.867 11.027 -0.030 1.00 0.00 C ATOM 907 CE1 HIS A 64 13.612 10.901 -1.350 1.00 0.00 C ATOM 908 NE2 HIS A 64 12.801 10.192 -0.589 1.00 0.00 N ATOM 0 H HIS A 64 12.413 14.042 -2.431 1.00 0.00 H new ATOM 0 HA HIS A 64 11.591 15.737 -0.260 1.00 0.00 H new ATOM 0 HB2 HIS A 64 11.220 13.615 0.902 1.00 0.00 H new ATOM 0 HB3 HIS A 64 10.475 13.591 -0.684 1.00 0.00 H new ATOM 0 HD2 HIS A 64 11.070 10.738 0.639 1.00 0.00 H new ATOM 0 HE1 HIS A 64 14.446 10.514 -1.917 1.00 0.00 H new ATOM 0 HE2 HIS A 64 12.859 9.185 -0.440 1.00 0.00 H new ATOM 917 N PRO A 65 13.670 16.100 1.071 1.00 0.00 N ATOM 918 CA PRO A 65 14.839 16.321 1.930 1.00 0.00 C ATOM 919 C PRO A 65 14.907 15.333 3.066 1.00 0.00 C ATOM 920 O PRO A 65 13.948 14.643 3.354 1.00 0.00 O ATOM 921 CB PRO A 65 14.602 17.726 2.514 1.00 0.00 C ATOM 922 CG PRO A 65 13.669 18.357 1.576 1.00 0.00 C ATOM 923 CD PRO A 65 12.757 17.250 1.190 1.00 0.00 C ATOM 0 HA PRO A 65 15.767 16.212 1.369 1.00 0.00 H new ATOM 0 HB2 PRO A 65 14.181 17.673 3.518 1.00 0.00 H new ATOM 0 HB3 PRO A 65 15.533 18.288 2.587 1.00 0.00 H new ATOM 0 HG2 PRO A 65 13.126 19.179 2.043 1.00 0.00 H new ATOM 0 HG3 PRO A 65 14.188 18.769 0.710 1.00 0.00 H new ATOM 0 HD2 PRO A 65 11.987 17.079 1.943 1.00 0.00 H new ATOM 0 HD3 PRO A 65 12.244 17.458 0.251 1.00 0.00 H new ATOM 931 N TRP A 66 16.071 15.221 3.655 1.00 0.00 N ATOM 932 CA TRP A 66 16.246 14.365 4.812 1.00 0.00 C ATOM 933 C TRP A 66 16.113 15.217 6.063 1.00 0.00 C ATOM 934 O TRP A 66 16.413 14.779 7.181 1.00 0.00 O ATOM 935 CB TRP A 66 17.583 13.642 4.805 1.00 0.00 C ATOM 936 CG TRP A 66 17.768 12.721 3.632 1.00 0.00 C ATOM 937 CD1 TRP A 66 18.036 13.085 2.342 1.00 0.00 C ATOM 938 CD2 TRP A 66 17.679 11.287 3.633 1.00 0.00 C ATOM 939 NE1 TRP A 66 18.114 11.972 1.543 1.00 0.00 N ATOM 940 CE2 TRP A 66 17.902 10.857 2.311 1.00 0.00 C ATOM 941 CE3 TRP A 66 17.433 10.323 4.621 1.00 0.00 C ATOM 942 CZ2 TRP A 66 17.885 9.512 1.951 1.00 0.00 C ATOM 943 CZ3 TRP A 66 17.418 8.988 4.260 1.00 0.00 C ATOM 944 CH2 TRP A 66 17.642 8.595 2.936 1.00 0.00 C ATOM 0 H TRP A 66 16.915 15.710 3.356 1.00 0.00 H new ATOM 0 HA TRP A 66 15.478 13.592 4.788 1.00 0.00 H new ATOM 0 HB2 TRP A 66 18.385 14.380 4.805 1.00 0.00 H new ATOM 0 HB3 TRP A 66 17.679 13.067 5.726 1.00 0.00 H new ATOM 0 HD1 TRP A 66 18.167 14.101 2.001 1.00 0.00 H new ATOM 0 HE1 TRP A 66 18.300 11.974 0.540 1.00 0.00 H new ATOM 0 HE3 TRP A 66 17.258 10.618 5.645 1.00 0.00 H new ATOM 0 HZ2 TRP A 66 18.058 9.204 0.930 1.00 0.00 H new ATOM 0 HZ3 TRP A 66 17.230 8.236 5.013 1.00 0.00 H new ATOM 0 HH2 TRP A 66 17.623 7.544 2.686 1.00 0.00 H new ATOM 955 N MET A 67 15.623 16.449 5.850 1.00 0.00 N ATOM 956 CA MET A 67 15.415 17.397 6.921 1.00 0.00 C ATOM 957 C MET A 67 14.145 17.057 7.665 1.00 0.00 C ATOM 958 O MET A 67 14.111 17.079 8.900 1.00 0.00 O ATOM 959 CB MET A 67 15.364 18.829 6.386 1.00 0.00 C ATOM 960 CG MET A 67 16.731 19.410 6.054 1.00 0.00 C ATOM 961 SD MET A 67 16.635 21.079 5.380 1.00 0.00 S ATOM 962 CE MET A 67 18.369 21.431 5.101 1.00 0.00 C ATOM 0 H MET A 67 15.365 16.801 4.928 1.00 0.00 H new ATOM 0 HA MET A 67 16.257 17.333 7.611 1.00 0.00 H new ATOM 0 HB2 MET A 67 14.743 18.850 5.490 1.00 0.00 H new ATOM 0 HB3 MET A 67 14.879 19.466 7.125 1.00 0.00 H new ATOM 0 HG2 MET A 67 17.344 19.422 6.955 1.00 0.00 H new ATOM 0 HG3 MET A 67 17.232 18.761 5.336 1.00 0.00 H new ATOM 0 HE1 MET A 67 18.474 22.432 4.684 1.00 0.00 H new ATOM 0 HE2 MET A 67 18.909 21.373 6.046 1.00 0.00 H new ATOM 0 HE3 MET A 67 18.781 20.702 4.403 1.00 0.00 H new ATOM 972 N LEU A 68 13.110 16.722 6.900 1.00 0.00 N ATOM 973 CA LEU A 68 11.856 16.322 7.483 1.00 0.00 C ATOM 974 C LEU A 68 11.431 14.958 6.921 1.00 0.00 C ATOM 975 O LEU A 68 10.271 14.559 7.075 1.00 0.00 O ATOM 976 CB LEU A 68 10.778 17.428 7.302 1.00 0.00 C ATOM 977 CG LEU A 68 10.285 17.723 5.880 1.00 0.00 C ATOM 978 CD1 LEU A 68 9.034 16.902 5.570 1.00 0.00 C ATOM 979 CD2 LEU A 68 9.991 19.207 5.714 1.00 0.00 C ATOM 0 H LEU A 68 13.125 16.723 5.880 1.00 0.00 H new ATOM 0 HA LEU A 68 11.976 16.200 8.559 1.00 0.00 H new ATOM 0 HB2 LEU A 68 9.913 17.154 7.906 1.00 0.00 H new ATOM 0 HB3 LEU A 68 11.176 18.354 7.717 1.00 0.00 H new ATOM 0 HG LEU A 68 11.072 17.443 5.179 1.00 0.00 H new ATOM 0 HD11 LEU A 68 8.696 17.122 4.557 1.00 0.00 H new ATOM 0 HD12 LEU A 68 9.266 15.840 5.652 1.00 0.00 H new ATOM 0 HD13 LEU A 68 8.246 17.157 6.279 1.00 0.00 H new ATOM 0 HD21 LEU A 68 9.642 19.398 4.699 1.00 0.00 H new ATOM 0 HD22 LEU A 68 9.221 19.507 6.425 1.00 0.00 H new ATOM 0 HD23 LEU A 68 10.899 19.781 5.899 1.00 0.00 H new ATOM 991 N TRP A 69 12.380 14.229 6.261 1.00 0.00 N ATOM 992 CA TRP A 69 12.036 12.919 5.678 1.00 0.00 C ATOM 993 C TRP A 69 13.118 11.862 5.926 1.00 0.00 C ATOM 994 O TRP A 69 14.218 11.930 5.366 1.00 0.00 O ATOM 995 CB TRP A 69 11.753 13.000 4.152 1.00 0.00 C ATOM 996 CG TRP A 69 11.120 14.284 3.651 1.00 0.00 C ATOM 997 CD1 TRP A 69 11.592 15.554 3.824 1.00 0.00 C ATOM 998 CD2 TRP A 69 9.931 14.415 2.861 1.00 0.00 C ATOM 999 NE1 TRP A 69 10.758 16.457 3.236 1.00 0.00 N ATOM 1000 CE2 TRP A 69 9.736 15.788 2.627 1.00 0.00 C ATOM 1001 CE3 TRP A 69 9.005 13.511 2.340 1.00 0.00 C ATOM 1002 CZ2 TRP A 69 8.661 16.279 1.899 1.00 0.00 C ATOM 1003 CZ3 TRP A 69 7.941 14.001 1.615 1.00 0.00 C ATOM 1004 CH2 TRP A 69 7.776 15.374 1.399 1.00 0.00 C ATOM 0 H TRP A 69 13.348 14.521 6.129 1.00 0.00 H new ATOM 0 HA TRP A 69 11.123 12.616 6.190 1.00 0.00 H new ATOM 0 HB2 TRP A 69 12.694 12.853 3.622 1.00 0.00 H new ATOM 0 HB3 TRP A 69 11.101 12.169 3.881 1.00 0.00 H new ATOM 0 HD1 TRP A 69 12.499 15.807 4.353 1.00 0.00 H new ATOM 0 HE1 TRP A 69 10.878 17.470 3.249 1.00 0.00 H new ATOM 0 HE3 TRP A 69 9.120 12.449 2.502 1.00 0.00 H new ATOM 0 HZ2 TRP A 69 8.532 17.339 1.736 1.00 0.00 H new ATOM 0 HZ3 TRP A 69 7.219 13.311 1.205 1.00 0.00 H new ATOM 0 HH2 TRP A 69 6.930 15.722 0.825 1.00 0.00 H new ATOM 1015 N MET A 70 12.769 10.850 6.730 1.00 0.00 N ATOM 1016 CA MET A 70 13.691 9.754 7.050 1.00 0.00 C ATOM 1017 C MET A 70 13.250 8.431 6.413 1.00 0.00 C ATOM 1018 O MET A 70 14.095 7.630 6.005 1.00 0.00 O ATOM 1019 CB MET A 70 13.816 9.574 8.564 1.00 0.00 C ATOM 1020 CG MET A 70 14.696 10.613 9.240 1.00 0.00 C ATOM 1021 SD MET A 70 13.945 12.250 9.272 1.00 0.00 S ATOM 1022 CE MET A 70 15.085 13.118 10.347 1.00 0.00 C ATOM 0 H MET A 70 11.853 10.768 7.171 1.00 0.00 H new ATOM 0 HA MET A 70 14.662 10.026 6.636 1.00 0.00 H new ATOM 0 HB2 MET A 70 12.821 9.612 9.007 1.00 0.00 H new ATOM 0 HB3 MET A 70 14.219 8.582 8.770 1.00 0.00 H new ATOM 0 HG2 MET A 70 14.907 10.295 10.261 1.00 0.00 H new ATOM 0 HG3 MET A 70 15.652 10.667 8.719 1.00 0.00 H new ATOM 0 HE1 MET A 70 14.757 14.150 10.467 1.00 0.00 H new ATOM 0 HE2 MET A 70 15.110 12.629 11.321 1.00 0.00 H new ATOM 0 HE3 MET A 70 16.082 13.103 9.908 1.00 0.00 H new ATOM 1032 N ALA A 71 11.926 8.222 6.305 1.00 0.00 N ATOM 1033 CA ALA A 71 11.372 6.978 5.744 1.00 0.00 C ATOM 1034 C ALA A 71 11.271 6.996 4.218 1.00 0.00 C ATOM 1035 O ALA A 71 11.163 5.938 3.595 1.00 0.00 O ATOM 1036 CB ALA A 71 10.010 6.689 6.355 1.00 0.00 C ATOM 0 H ALA A 71 11.221 8.898 6.599 1.00 0.00 H new ATOM 0 HA ALA A 71 12.071 6.182 6.001 1.00 0.00 H new ATOM 0 HB1 ALA A 71 9.610 5.767 5.933 1.00 0.00 H new ATOM 0 HB2 ALA A 71 10.111 6.580 7.435 1.00 0.00 H new ATOM 0 HB3 ALA A 71 9.331 7.513 6.136 1.00 0.00 H new ATOM 1042 N GLY A 72 11.310 8.193 3.634 1.00 0.00 N ATOM 1043 CA GLY A 72 11.236 8.331 2.184 1.00 0.00 C ATOM 1044 C GLY A 72 9.854 8.700 1.669 1.00 0.00 C ATOM 1045 O GLY A 72 9.260 9.685 2.115 1.00 0.00 O ATOM 0 H GLY A 72 11.392 9.075 4.140 1.00 0.00 H new ATOM 0 HA2 GLY A 72 11.947 9.093 1.865 1.00 0.00 H new ATOM 0 HA3 GLY A 72 11.546 7.393 1.723 1.00 0.00 H new ATOM 1049 N ASN A 73 9.358 7.894 0.716 1.00 0.00 N ATOM 1050 CA ASN A 73 8.059 8.092 0.083 1.00 0.00 C ATOM 1051 C ASN A 73 6.911 7.558 0.927 1.00 0.00 C ATOM 1052 O ASN A 73 7.041 6.524 1.593 1.00 0.00 O ATOM 1053 CB ASN A 73 8.020 7.388 -1.269 1.00 0.00 C ATOM 1054 CG ASN A 73 8.821 8.093 -2.339 1.00 0.00 C ATOM 1055 OD1 ASN A 73 8.274 8.843 -3.143 1.00 0.00 O ATOM 1056 ND2 ASN A 73 10.122 7.841 -2.359 1.00 0.00 N ATOM 0 H ASN A 73 9.860 7.079 0.364 1.00 0.00 H new ATOM 0 HA ASN A 73 7.933 9.169 -0.033 1.00 0.00 H new ATOM 0 HB2 ASN A 73 8.399 6.373 -1.152 1.00 0.00 H new ATOM 0 HB3 ASN A 73 6.984 7.306 -1.597 1.00 0.00 H new ATOM 0 HD21 ASN A 73 10.715 8.278 -3.064 1.00 0.00 H new ATOM 0 HD22 ASN A 73 10.530 7.210 -1.669 1.00 0.00 H new ATOM 1063 N ALA A 74 5.771 8.250 0.848 1.00 0.00 N ATOM 1064 CA ALA A 74 4.575 7.869 1.586 1.00 0.00 C ATOM 1065 C ALA A 74 3.314 8.325 0.873 1.00 0.00 C ATOM 1066 O ALA A 74 3.290 9.389 0.257 1.00 0.00 O ATOM 1067 CB ALA A 74 4.600 8.414 3.012 1.00 0.00 C ATOM 0 H ALA A 74 5.656 9.085 0.273 1.00 0.00 H new ATOM 0 HA ALA A 74 4.566 6.780 1.636 1.00 0.00 H new ATOM 0 HB1 ALA A 74 3.692 8.110 3.533 1.00 0.00 H new ATOM 0 HB2 ALA A 74 5.470 8.019 3.537 1.00 0.00 H new ATOM 0 HB3 ALA A 74 4.656 9.502 2.985 1.00 0.00 H new ATOM 1073 N VAL A 75 2.264 7.506 0.973 1.00 0.00 N ATOM 1074 CA VAL A 75 0.978 7.809 0.351 1.00 0.00 C ATOM 1075 C VAL A 75 -0.145 7.425 1.295 1.00 0.00 C ATOM 1076 O VAL A 75 -0.277 6.263 1.682 1.00 0.00 O ATOM 1077 CB VAL A 75 0.725 7.077 -1.008 1.00 0.00 C ATOM 1078 CG1 VAL A 75 -0.218 7.893 -1.887 1.00 0.00 C ATOM 1079 CG2 VAL A 75 2.008 6.788 -1.764 1.00 0.00 C ATOM 0 H VAL A 75 2.283 6.623 1.483 1.00 0.00 H new ATOM 0 HA VAL A 75 1.003 8.879 0.144 1.00 0.00 H new ATOM 0 HB VAL A 75 0.266 6.119 -0.765 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -0.383 7.369 -2.828 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -1.170 8.025 -1.374 1.00 0.00 H new ATOM 0 HG13 VAL A 75 0.225 8.869 -2.088 1.00 0.00 H new ATOM 0 HG21 VAL A 75 1.773 6.279 -2.699 1.00 0.00 H new ATOM 0 HG22 VAL A 75 2.522 7.725 -1.980 1.00 0.00 H new ATOM 0 HG23 VAL A 75 2.653 6.152 -1.157 1.00 0.00 H new ATOM 1089 N LEU A 76 -0.951 8.410 1.644 1.00 0.00 N ATOM 1090 CA LEU A 76 -2.088 8.198 2.505 1.00 0.00 C ATOM 1091 C LEU A 76 -3.307 8.629 1.761 1.00 0.00 C ATOM 1092 O LEU A 76 -3.383 9.733 1.223 1.00 0.00 O ATOM 1093 CB LEU A 76 -1.949 8.945 3.818 1.00 0.00 C ATOM 1094 CG LEU A 76 -2.237 8.139 5.087 1.00 0.00 C ATOM 1095 CD1 LEU A 76 -1.216 8.472 6.164 1.00 0.00 C ATOM 1096 CD2 LEU A 76 -3.643 8.414 5.591 1.00 0.00 C ATOM 0 H LEU A 76 -0.832 9.375 1.337 1.00 0.00 H new ATOM 0 HA LEU A 76 -2.160 7.142 2.767 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -0.934 9.337 3.884 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -2.621 9.803 3.797 1.00 0.00 H new ATOM 0 HG LEU A 76 -2.161 7.079 4.846 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -1.432 7.892 7.062 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -0.216 8.227 5.806 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -1.267 9.535 6.398 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -3.827 7.831 6.493 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -3.747 9.475 5.817 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -4.366 8.133 4.825 1.00 0.00 H new ATOM 1108 N ILE A 77 -4.235 7.719 1.745 1.00 0.00 N ATOM 1109 CA ILE A 77 -5.478 7.849 1.033 1.00 0.00 C ATOM 1110 C ILE A 77 -6.636 7.311 1.868 1.00 0.00 C ATOM 1111 O ILE A 77 -6.471 6.436 2.722 1.00 0.00 O ATOM 1112 CB ILE A 77 -5.384 7.103 -0.336 1.00 0.00 C ATOM 1113 CG1 ILE A 77 -4.478 7.867 -1.308 1.00 0.00 C ATOM 1114 CG2 ILE A 77 -6.753 6.851 -0.987 1.00 0.00 C ATOM 1115 CD1 ILE A 77 -3.629 6.975 -2.195 1.00 0.00 C ATOM 0 H ILE A 77 -4.147 6.834 2.244 1.00 0.00 H new ATOM 0 HA ILE A 77 -5.668 8.905 0.843 1.00 0.00 H new ATOM 0 HB ILE A 77 -4.951 6.127 -0.118 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -5.097 8.505 -1.939 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -3.822 8.523 -0.736 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -6.615 6.330 -1.934 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -7.365 6.241 -0.323 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -7.251 7.804 -1.167 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -3.017 7.592 -2.853 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -2.982 6.355 -1.575 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -4.277 6.336 -2.796 1.00 0.00 H new ATOM 1127 N GLN A 78 -7.788 7.896 1.614 1.00 0.00 N ATOM 1128 CA GLN A 78 -9.029 7.533 2.239 1.00 0.00 C ATOM 1129 C GLN A 78 -9.824 6.651 1.283 1.00 0.00 C ATOM 1130 O GLN A 78 -10.210 7.070 0.189 1.00 0.00 O ATOM 1131 CB GLN A 78 -9.821 8.782 2.620 1.00 0.00 C ATOM 1132 CG GLN A 78 -11.164 8.478 3.272 1.00 0.00 C ATOM 1133 CD GLN A 78 -12.280 9.295 2.689 1.00 0.00 C ATOM 1134 OE1 GLN A 78 -12.629 10.367 3.181 1.00 0.00 O ATOM 1135 NE2 GLN A 78 -12.829 8.770 1.616 1.00 0.00 N ATOM 0 H GLN A 78 -7.882 8.660 0.945 1.00 0.00 H new ATOM 0 HA GLN A 78 -8.831 6.978 3.156 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -9.224 9.386 3.303 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -9.988 9.383 1.726 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -11.392 7.419 3.152 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -11.097 8.671 4.343 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -12.494 7.876 1.257 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -13.590 9.257 1.143 1.00 0.00 H new ATOM 1144 N HIS A 79 -10.049 5.434 1.734 1.00 0.00 N ATOM 1145 CA HIS A 79 -10.774 4.412 0.980 1.00 0.00 C ATOM 1146 C HIS A 79 -12.260 4.685 0.832 1.00 0.00 C ATOM 1147 O HIS A 79 -12.775 5.722 1.258 1.00 0.00 O ATOM 1148 CB HIS A 79 -10.558 3.033 1.603 1.00 0.00 C ATOM 1149 CG HIS A 79 -9.310 2.352 1.130 1.00 0.00 C ATOM 1150 ND1 HIS A 79 -8.739 2.616 -0.096 1.00 0.00 N ATOM 1151 CD2 HIS A 79 -8.517 1.427 1.722 1.00 0.00 C ATOM 1152 CE1 HIS A 79 -7.646 1.888 -0.238 1.00 0.00 C ATOM 1153 NE2 HIS A 79 -7.490 1.157 0.849 1.00 0.00 N ATOM 0 H HIS A 79 -9.731 5.114 2.649 1.00 0.00 H new ATOM 0 HA HIS A 79 -10.357 4.441 -0.027 1.00 0.00 H new ATOM 0 HB2 HIS A 79 -10.518 3.135 2.687 1.00 0.00 H new ATOM 0 HB3 HIS A 79 -11.416 2.401 1.374 1.00 0.00 H new ATOM 0 HD1 HIS A 79 -9.104 3.272 -0.787 1.00 0.00 H new ATOM 0 HD2 HIS A 79 -8.664 0.985 2.696 1.00 0.00 H new ATOM 0 HE1 HIS A 79 -6.992 1.891 -1.097 1.00 0.00 H new ATOM 1162 N ALA A 80 -12.929 3.708 0.211 1.00 0.00 N ATOM 1163 CA ALA A 80 -14.348 3.769 -0.084 1.00 0.00 C ATOM 1164 C ALA A 80 -15.253 3.781 1.154 1.00 0.00 C ATOM 1165 O ALA A 80 -16.421 4.170 1.064 1.00 0.00 O ATOM 1166 CB ALA A 80 -14.737 2.626 -1.007 1.00 0.00 C ATOM 0 H ALA A 80 -12.486 2.844 -0.102 1.00 0.00 H new ATOM 0 HA ALA A 80 -14.509 4.728 -0.576 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -15.804 2.680 -1.223 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -14.174 2.702 -1.937 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -14.512 1.675 -0.524 1.00 0.00 H new ATOM 1172 N ASP A 81 -14.706 3.369 2.295 1.00 0.00 N ATOM 1173 CA ASP A 81 -15.455 3.322 3.543 1.00 0.00 C ATOM 1174 C ASP A 81 -15.104 4.506 4.436 1.00 0.00 C ATOM 1175 O ASP A 81 -15.762 4.751 5.454 1.00 0.00 O ATOM 1176 CB ASP A 81 -15.210 2.013 4.270 1.00 0.00 C ATOM 1177 CG ASP A 81 -16.499 1.304 4.634 1.00 0.00 C ATOM 1178 OD1 ASP A 81 -16.961 0.468 3.830 1.00 0.00 O ATOM 1179 OD2 ASP A 81 -17.046 1.586 5.720 1.00 0.00 O ATOM 0 H ASP A 81 -13.737 3.061 2.378 1.00 0.00 H new ATOM 0 HA ASP A 81 -16.516 3.385 3.299 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -14.604 1.360 3.642 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -14.636 2.206 5.176 1.00 0.00 H new ATOM 1184 N GLY A 82 -14.064 5.237 4.032 1.00 0.00 N ATOM 1185 CA GLY A 82 -13.623 6.405 4.759 1.00 0.00 C ATOM 1186 C GLY A 82 -12.359 6.146 5.543 1.00 0.00 C ATOM 1187 O GLY A 82 -11.775 7.075 6.109 1.00 0.00 O ATOM 0 H GLY A 82 -13.515 5.030 3.198 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -13.453 7.223 4.059 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -14.411 6.726 5.440 1.00 0.00 H new ATOM 1191 N MET A 83 -11.926 4.876 5.559 1.00 0.00 N ATOM 1192 CA MET A 83 -10.731 4.460 6.244 1.00 0.00 C ATOM 1193 C MET A 83 -9.477 4.996 5.562 1.00 0.00 C ATOM 1194 O MET A 83 -9.533 5.423 4.404 1.00 0.00 O ATOM 1195 CB MET A 83 -10.694 2.932 6.356 1.00 0.00 C ATOM 1196 CG MET A 83 -11.092 2.147 5.106 1.00 0.00 C ATOM 1197 SD MET A 83 -11.642 0.473 5.492 1.00 0.00 S ATOM 1198 CE MET A 83 -12.124 -0.115 3.869 1.00 0.00 C ATOM 0 H MET A 83 -12.413 4.115 5.087 1.00 0.00 H new ATOM 0 HA MET A 83 -10.750 4.881 7.249 1.00 0.00 H new ATOM 0 HB2 MET A 83 -9.684 2.635 6.638 1.00 0.00 H new ATOM 0 HB3 MET A 83 -11.354 2.633 7.171 1.00 0.00 H new ATOM 0 HG2 MET A 83 -11.889 2.678 4.586 1.00 0.00 H new ATOM 0 HG3 MET A 83 -10.243 2.099 4.424 1.00 0.00 H new ATOM 0 HE1 MET A 83 -13.208 -0.216 3.826 1.00 0.00 H new ATOM 0 HE2 MET A 83 -11.795 0.597 3.112 1.00 0.00 H new ATOM 0 HE3 MET A 83 -11.662 -1.084 3.681 1.00 0.00 H new ATOM 1208 N HIS A 84 -8.356 4.965 6.274 1.00 0.00 N ATOM 1209 CA HIS A 84 -7.126 5.471 5.730 1.00 0.00 C ATOM 1210 C HIS A 84 -6.177 4.335 5.388 1.00 0.00 C ATOM 1211 O HIS A 84 -6.137 3.324 6.094 1.00 0.00 O ATOM 1212 CB HIS A 84 -6.458 6.445 6.700 1.00 0.00 C ATOM 1213 CG HIS A 84 -7.167 7.759 6.835 1.00 0.00 C ATOM 1214 ND1 HIS A 84 -6.735 8.917 6.222 1.00 0.00 N ATOM 1215 CD2 HIS A 84 -8.275 8.098 7.534 1.00 0.00 C ATOM 1216 CE1 HIS A 84 -7.546 9.911 6.541 1.00 0.00 C ATOM 1217 NE2 HIS A 84 -8.488 9.439 7.336 1.00 0.00 N ATOM 0 H HIS A 84 -8.285 4.595 7.222 1.00 0.00 H new ATOM 0 HA HIS A 84 -7.365 6.009 4.813 1.00 0.00 H new ATOM 0 HB2 HIS A 84 -6.394 5.976 7.682 1.00 0.00 H new ATOM 0 HB3 HIS A 84 -5.436 6.628 6.368 1.00 0.00 H new ATOM 0 HD2 HIS A 84 -8.880 7.436 8.136 1.00 0.00 H new ATOM 0 HE1 HIS A 84 -7.454 10.934 6.208 1.00 0.00 H new ATOM 0 HE2 HIS A 84 -9.251 9.983 7.738 1.00 0.00 H new ATOM 1226 N THR A 85 -5.410 4.504 4.308 1.00 0.00 N ATOM 1227 CA THR A 85 -4.470 3.510 3.880 1.00 0.00 C ATOM 1228 C THR A 85 -3.181 4.174 3.458 1.00 0.00 C ATOM 1229 O THR A 85 -3.184 5.110 2.651 1.00 0.00 O ATOM 1230 CB THR A 85 -5.015 2.684 2.706 1.00 0.00 C ATOM 1231 OG1 THR A 85 -6.204 3.285 2.172 1.00 0.00 O ATOM 1232 CG2 THR A 85 -5.309 1.260 3.147 1.00 0.00 C ATOM 0 H THR A 85 -5.436 5.337 3.719 1.00 0.00 H new ATOM 0 HA THR A 85 -4.293 2.839 4.720 1.00 0.00 H new ATOM 0 HB THR A 85 -4.254 2.662 1.926 1.00 0.00 H new ATOM 0 HG1 THR A 85 -6.060 3.513 1.230 1.00 0.00 H new ATOM 0 HG21 THR A 85 -5.694 0.690 2.302 1.00 0.00 H new ATOM 0 HG22 THR A 85 -4.393 0.795 3.511 1.00 0.00 H new ATOM 0 HG23 THR A 85 -6.051 1.272 3.945 1.00 0.00 H new ATOM 1240 N GLY A 86 -2.093 3.699 4.034 1.00 0.00 N ATOM 1241 CA GLY A 86 -0.794 4.227 3.713 1.00 0.00 C ATOM 1242 C GLY A 86 0.022 3.273 2.876 1.00 0.00 C ATOM 1243 O GLY A 86 -0.183 2.054 2.919 1.00 0.00 O ATOM 0 H GLY A 86 -2.090 2.949 4.725 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -0.910 5.169 3.177 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -0.257 4.449 4.635 1.00 0.00 H new ATOM 1247 N TYR A 87 0.949 3.857 2.122 1.00 0.00 N ATOM 1248 CA TYR A 87 1.857 3.157 1.251 1.00 0.00 C ATOM 1249 C TYR A 87 3.199 3.864 1.460 1.00 0.00 C ATOM 1250 O TYR A 87 3.434 4.948 0.909 1.00 0.00 O ATOM 1251 CB TYR A 87 1.390 3.243 -0.233 1.00 0.00 C ATOM 1252 CG TYR A 87 -0.087 2.903 -0.508 1.00 0.00 C ATOM 1253 CD1 TYR A 87 -0.437 1.778 -1.259 1.00 0.00 C ATOM 1254 CD2 TYR A 87 -1.131 3.716 -0.044 1.00 0.00 C ATOM 1255 CE1 TYR A 87 -1.768 1.477 -1.528 1.00 0.00 C ATOM 1256 CE2 TYR A 87 -2.453 3.412 -0.309 1.00 0.00 C ATOM 1257 CZ TYR A 87 -2.764 2.296 -1.050 1.00 0.00 C ATOM 1258 OH TYR A 87 -4.080 1.998 -1.316 1.00 0.00 O ATOM 0 H TYR A 87 1.084 4.868 2.108 1.00 0.00 H new ATOM 0 HA TYR A 87 1.914 2.092 1.475 1.00 0.00 H new ATOM 0 HB2 TYR A 87 1.580 4.254 -0.593 1.00 0.00 H new ATOM 0 HB3 TYR A 87 2.011 2.572 -0.826 1.00 0.00 H new ATOM 0 HD1 TYR A 87 0.340 1.130 -1.637 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -0.897 4.599 0.533 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -2.019 0.603 -2.110 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -3.240 4.050 0.065 1.00 0.00 H new ATOM 0 HH TYR A 87 -4.658 2.675 -0.906 1.00 0.00 H new ATOM 1268 N ALA A 88 4.057 3.282 2.299 1.00 0.00 N ATOM 1269 CA ALA A 88 5.338 3.913 2.621 1.00 0.00 C ATOM 1270 C ALA A 88 6.544 3.093 2.171 1.00 0.00 C ATOM 1271 O ALA A 88 6.407 1.953 1.720 1.00 0.00 O ATOM 1272 CB ALA A 88 5.401 4.234 4.116 1.00 0.00 C ATOM 0 H ALA A 88 3.892 2.388 2.762 1.00 0.00 H new ATOM 0 HA ALA A 88 5.392 4.843 2.055 1.00 0.00 H new ATOM 0 HB1 ALA A 88 6.357 4.703 4.347 1.00 0.00 H new ATOM 0 HB2 ALA A 88 4.590 4.915 4.376 1.00 0.00 H new ATOM 0 HB3 ALA A 88 5.300 3.313 4.690 1.00 0.00 H new ATOM 1278 N HIS A 89 7.742 3.704 2.328 1.00 0.00 N ATOM 1279 CA HIS A 89 9.042 3.111 1.944 1.00 0.00 C ATOM 1280 C HIS A 89 9.168 2.926 0.417 1.00 0.00 C ATOM 1281 O HIS A 89 10.003 2.156 -0.058 1.00 0.00 O ATOM 1282 CB HIS A 89 9.292 1.790 2.699 1.00 0.00 C ATOM 1283 CG HIS A 89 9.587 1.994 4.157 1.00 0.00 C ATOM 1284 ND1 HIS A 89 8.770 2.723 4.999 1.00 0.00 N ATOM 1285 CD2 HIS A 89 10.630 1.580 4.915 1.00 0.00 C ATOM 1286 CE1 HIS A 89 9.300 2.754 6.208 1.00 0.00 C ATOM 1287 NE2 HIS A 89 10.427 2.067 6.184 1.00 0.00 N ATOM 0 H HIS A 89 7.832 4.637 2.731 1.00 0.00 H new ATOM 0 HA HIS A 89 9.819 3.816 2.238 1.00 0.00 H new ATOM 0 HB2 HIS A 89 8.417 1.149 2.597 1.00 0.00 H new ATOM 0 HB3 HIS A 89 10.127 1.265 2.235 1.00 0.00 H new ATOM 0 HD2 HIS A 89 11.465 0.980 4.584 1.00 0.00 H new ATOM 0 HE1 HIS A 89 8.883 3.255 7.069 1.00 0.00 H new ATOM 0 HE2 HIS A 89 11.048 1.921 6.980 1.00 0.00 H new ATOM 1296 N LEU A 90 8.342 3.673 -0.336 1.00 0.00 N ATOM 1297 CA LEU A 90 8.337 3.654 -1.801 1.00 0.00 C ATOM 1298 C LEU A 90 9.476 4.509 -2.369 1.00 0.00 C ATOM 1299 O LEU A 90 10.165 5.207 -1.616 1.00 0.00 O ATOM 1300 CB LEU A 90 6.974 4.145 -2.327 1.00 0.00 C ATOM 1301 CG LEU A 90 5.732 3.532 -1.660 1.00 0.00 C ATOM 1302 CD1 LEU A 90 4.518 4.391 -1.945 1.00 0.00 C ATOM 1303 CD2 LEU A 90 5.500 2.109 -2.141 1.00 0.00 C ATOM 0 H LEU A 90 7.654 4.312 0.063 1.00 0.00 H new ATOM 0 HA LEU A 90 8.496 2.628 -2.133 1.00 0.00 H new ATOM 0 HB2 LEU A 90 6.929 5.227 -2.207 1.00 0.00 H new ATOM 0 HB3 LEU A 90 6.925 3.941 -3.397 1.00 0.00 H new ATOM 0 HG LEU A 90 5.900 3.498 -0.584 1.00 0.00 H new ATOM 0 HD11 LEU A 90 3.641 3.951 -1.470 1.00 0.00 H new ATOM 0 HD12 LEU A 90 4.681 5.394 -1.549 1.00 0.00 H new ATOM 0 HD13 LEU A 90 4.357 4.448 -3.022 1.00 0.00 H new ATOM 0 HD21 LEU A 90 4.615 1.700 -1.653 1.00 0.00 H new ATOM 0 HD22 LEU A 90 5.351 2.110 -3.221 1.00 0.00 H new ATOM 0 HD23 LEU A 90 6.367 1.496 -1.894 1.00 0.00 H new ATOM 1315 N SER A 91 9.672 4.446 -3.691 1.00 0.00 N ATOM 1316 CA SER A 91 10.720 5.194 -4.351 1.00 0.00 C ATOM 1317 C SER A 91 10.163 6.389 -5.104 1.00 0.00 C ATOM 1318 O SER A 91 10.918 7.298 -5.466 1.00 0.00 O ATOM 1319 CB SER A 91 11.504 4.295 -5.312 1.00 0.00 C ATOM 1320 OG SER A 91 12.643 4.962 -5.831 1.00 0.00 O ATOM 0 H SER A 91 9.107 3.876 -4.320 1.00 0.00 H new ATOM 0 HA SER A 91 11.393 5.562 -3.576 1.00 0.00 H new ATOM 0 HB2 SER A 91 11.816 3.389 -4.792 1.00 0.00 H new ATOM 0 HB3 SER A 91 10.857 3.985 -6.132 1.00 0.00 H new ATOM 0 HG SER A 91 12.468 5.926 -5.870 1.00 0.00 H new ATOM 1326 N LYS A 92 8.839 6.401 -5.330 1.00 0.00 N ATOM 1327 CA LYS A 92 8.209 7.478 -6.068 1.00 0.00 C ATOM 1328 C LYS A 92 6.696 7.438 -5.973 1.00 0.00 C ATOM 1329 O LYS A 92 6.088 6.398 -5.699 1.00 0.00 O ATOM 1330 CB LYS A 92 8.625 7.450 -7.540 1.00 0.00 C ATOM 1331 CG LYS A 92 9.145 8.777 -8.023 1.00 0.00 C ATOM 1332 CD LYS A 92 9.690 8.666 -9.434 1.00 0.00 C ATOM 1333 CE LYS A 92 9.997 10.032 -10.026 1.00 0.00 C ATOM 1334 NZ LYS A 92 10.582 9.929 -11.392 1.00 0.00 N ATOM 0 H LYS A 92 8.198 5.676 -5.009 1.00 0.00 H new ATOM 0 HA LYS A 92 8.552 8.405 -5.608 1.00 0.00 H new ATOM 0 HB2 LYS A 92 9.394 6.690 -7.681 1.00 0.00 H new ATOM 0 HB3 LYS A 92 7.770 7.156 -8.149 1.00 0.00 H new ATOM 0 HG2 LYS A 92 8.345 9.517 -7.995 1.00 0.00 H new ATOM 0 HG3 LYS A 92 9.929 9.130 -7.353 1.00 0.00 H new ATOM 0 HD2 LYS A 92 10.596 8.060 -9.428 1.00 0.00 H new ATOM 0 HD3 LYS A 92 8.966 8.150 -10.065 1.00 0.00 H new ATOM 0 HE2 LYS A 92 9.082 10.623 -10.067 1.00 0.00 H new ATOM 0 HE3 LYS A 92 10.691 10.562 -9.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 10.776 10.882 -11.759 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 11.468 9.387 -11.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 9.910 9.446 -12.022 1.00 0.00 H new ATOM 1348 N ILE A 93 6.122 8.607 -6.209 1.00 0.00 N ATOM 1349 CA ILE A 93 4.692 8.823 -6.195 1.00 0.00 C ATOM 1350 C ILE A 93 4.214 9.405 -7.524 1.00 0.00 C ATOM 1351 O ILE A 93 4.951 10.117 -8.213 1.00 0.00 O ATOM 1352 CB ILE A 93 4.293 9.762 -5.016 1.00 0.00 C ATOM 1353 CG1 ILE A 93 3.808 8.969 -3.807 1.00 0.00 C ATOM 1354 CG2 ILE A 93 3.269 10.813 -5.392 1.00 0.00 C ATOM 1355 CD1 ILE A 93 4.918 8.618 -2.835 1.00 0.00 C ATOM 0 H ILE A 93 6.655 9.450 -6.420 1.00 0.00 H new ATOM 0 HA ILE A 93 4.206 7.858 -6.052 1.00 0.00 H new ATOM 0 HB ILE A 93 5.208 10.293 -4.754 1.00 0.00 H new ATOM 0 HG12 ILE A 93 3.046 9.547 -3.284 1.00 0.00 H new ATOM 0 HG13 ILE A 93 3.332 8.051 -4.151 1.00 0.00 H new ATOM 0 HG21 ILE A 93 3.042 11.428 -4.521 1.00 0.00 H new ATOM 0 HG22 ILE A 93 3.669 11.443 -6.186 1.00 0.00 H new ATOM 0 HG23 ILE A 93 2.358 10.326 -5.740 1.00 0.00 H new ATOM 0 HD11 ILE A 93 4.505 8.055 -1.999 1.00 0.00 H new ATOM 0 HD12 ILE A 93 5.669 8.014 -3.343 1.00 0.00 H new ATOM 0 HD13 ILE A 93 5.379 9.533 -2.463 1.00 0.00 H new ATOM 1367 N SER A 94 2.974 9.077 -7.853 1.00 0.00 N ATOM 1368 CA SER A 94 2.313 9.561 -9.041 1.00 0.00 C ATOM 1369 C SER A 94 1.145 10.464 -8.662 1.00 0.00 C ATOM 1370 O SER A 94 0.509 11.080 -9.526 1.00 0.00 O ATOM 1371 CB SER A 94 1.767 8.390 -9.828 1.00 0.00 C ATOM 1372 OG SER A 94 1.607 8.715 -11.198 1.00 0.00 O ATOM 0 H SER A 94 2.395 8.456 -7.288 1.00 0.00 H new ATOM 0 HA SER A 94 3.035 10.119 -9.637 1.00 0.00 H new ATOM 0 HB2 SER A 94 2.441 7.539 -9.731 1.00 0.00 H new ATOM 0 HB3 SER A 94 0.807 8.085 -9.411 1.00 0.00 H new ATOM 0 HG SER A 94 1.254 7.938 -11.680 1.00 0.00 H new ATOM 1378 N VAL A 95 0.871 10.527 -7.357 1.00 0.00 N ATOM 1379 CA VAL A 95 -0.218 11.269 -6.832 1.00 0.00 C ATOM 1380 C VAL A 95 0.218 12.590 -6.195 1.00 0.00 C ATOM 1381 O VAL A 95 1.390 12.972 -6.243 1.00 0.00 O ATOM 1382 CB VAL A 95 -1.045 10.432 -5.824 1.00 0.00 C ATOM 1383 CG1 VAL A 95 -2.149 9.672 -6.540 1.00 0.00 C ATOM 1384 CG2 VAL A 95 -0.176 9.474 -5.006 1.00 0.00 C ATOM 0 H VAL A 95 1.423 10.048 -6.646 1.00 0.00 H new ATOM 0 HA VAL A 95 -0.852 11.513 -7.684 1.00 0.00 H new ATOM 0 HB VAL A 95 -1.494 11.133 -5.121 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -2.719 9.090 -5.816 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -2.812 10.378 -7.040 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -1.709 9.002 -7.279 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -0.805 8.912 -4.316 1.00 0.00 H new ATOM 0 HG22 VAL A 95 0.334 8.783 -5.677 1.00 0.00 H new ATOM 0 HG23 VAL A 95 0.562 10.044 -4.442 1.00 0.00 H new ATOM 1394 N SER A 96 -0.761 13.268 -5.598 1.00 0.00 N ATOM 1395 CA SER A 96 -0.583 14.548 -4.953 1.00 0.00 C ATOM 1396 C SER A 96 -1.625 14.701 -3.867 1.00 0.00 C ATOM 1397 O SER A 96 -2.763 14.248 -4.014 1.00 0.00 O ATOM 1398 CB SER A 96 -0.698 15.708 -5.956 1.00 0.00 C ATOM 1399 OG SER A 96 0.293 15.613 -6.965 1.00 0.00 O ATOM 0 H SER A 96 -1.721 12.925 -5.554 1.00 0.00 H new ATOM 0 HA SER A 96 0.418 14.583 -4.523 1.00 0.00 H new ATOM 0 HB2 SER A 96 -1.688 15.701 -6.413 1.00 0.00 H new ATOM 0 HB3 SER A 96 -0.596 16.658 -5.431 1.00 0.00 H new ATOM 0 HG SER A 96 0.196 16.362 -7.590 1.00 0.00 H new ATOM 1405 N THR A 97 -1.224 15.350 -2.783 1.00 0.00 N ATOM 1406 CA THR A 97 -2.089 15.587 -1.632 1.00 0.00 C ATOM 1407 C THR A 97 -3.364 16.347 -2.038 1.00 0.00 C ATOM 1408 O THR A 97 -3.282 17.380 -2.708 1.00 0.00 O ATOM 1409 CB THR A 97 -1.338 16.386 -0.541 1.00 0.00 C ATOM 1410 OG1 THR A 97 0.012 15.918 -0.427 1.00 0.00 O ATOM 1411 CG2 THR A 97 -2.023 16.275 0.822 1.00 0.00 C ATOM 0 H THR A 97 -0.284 15.730 -2.675 1.00 0.00 H new ATOM 0 HA THR A 97 -2.376 14.614 -1.233 1.00 0.00 H new ATOM 0 HB THR A 97 -1.348 17.433 -0.844 1.00 0.00 H new ATOM 0 HG1 THR A 97 0.479 16.431 0.265 1.00 0.00 H new ATOM 0 HG21 THR A 97 -1.463 16.851 1.559 1.00 0.00 H new ATOM 0 HG22 THR A 97 -3.038 16.666 0.752 1.00 0.00 H new ATOM 0 HG23 THR A 97 -2.057 15.229 1.128 1.00 0.00 H new ATOM 1419 N ASP A 98 -4.530 15.791 -1.647 1.00 0.00 N ATOM 1420 CA ASP A 98 -5.871 16.364 -1.922 1.00 0.00 C ATOM 1421 C ASP A 98 -6.413 15.920 -3.283 1.00 0.00 C ATOM 1422 O ASP A 98 -7.554 16.242 -3.633 1.00 0.00 O ATOM 1423 CB ASP A 98 -5.911 17.903 -1.801 1.00 0.00 C ATOM 1424 CG ASP A 98 -6.492 18.362 -0.479 1.00 0.00 C ATOM 1425 OD1 ASP A 98 -7.734 18.437 -0.372 1.00 0.00 O ATOM 1426 OD2 ASP A 98 -5.707 18.643 0.450 1.00 0.00 O ATOM 0 H ASP A 98 -4.570 14.917 -1.123 1.00 0.00 H new ATOM 0 HA ASP A 98 -6.522 15.965 -1.144 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -4.902 18.300 -1.909 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -6.504 18.314 -2.618 1.00 0.00 H new ATOM 1431 N SER A 99 -5.601 15.164 -4.046 1.00 0.00 N ATOM 1432 CA SER A 99 -6.011 14.654 -5.340 1.00 0.00 C ATOM 1433 C SER A 99 -6.860 13.403 -5.171 1.00 0.00 C ATOM 1434 O SER A 99 -6.689 12.662 -4.203 1.00 0.00 O ATOM 1435 CB SER A 99 -4.791 14.315 -6.188 1.00 0.00 C ATOM 1436 OG SER A 99 -3.962 15.449 -6.373 1.00 0.00 O ATOM 0 H SER A 99 -4.654 14.899 -3.774 1.00 0.00 H new ATOM 0 HA SER A 99 -6.597 15.427 -5.838 1.00 0.00 H new ATOM 0 HB2 SER A 99 -4.221 13.520 -5.708 1.00 0.00 H new ATOM 0 HB3 SER A 99 -5.113 13.935 -7.158 1.00 0.00 H new ATOM 0 HG SER A 99 -3.625 15.461 -7.293 1.00 0.00 H new ATOM 1442 N THR A 100 -7.788 13.191 -6.097 1.00 0.00 N ATOM 1443 CA THR A 100 -8.639 12.020 -6.070 1.00 0.00 C ATOM 1444 C THR A 100 -7.949 10.827 -6.700 1.00 0.00 C ATOM 1445 O THR A 100 -7.185 10.971 -7.662 1.00 0.00 O ATOM 1446 CB THR A 100 -9.979 12.244 -6.772 1.00 0.00 C ATOM 1447 OG1 THR A 100 -9.800 12.986 -7.985 1.00 0.00 O ATOM 1448 CG2 THR A 100 -10.938 12.967 -5.849 1.00 0.00 C ATOM 0 H THR A 100 -7.966 13.822 -6.878 1.00 0.00 H new ATOM 0 HA THR A 100 -8.836 11.822 -5.016 1.00 0.00 H new ATOM 0 HB THR A 100 -10.401 11.272 -7.026 1.00 0.00 H new ATOM 0 HG1 THR A 100 -10.669 13.117 -8.420 1.00 0.00 H new ATOM 0 HG21 THR A 100 -11.888 13.121 -6.360 1.00 0.00 H new ATOM 0 HG22 THR A 100 -11.101 12.369 -4.952 1.00 0.00 H new ATOM 0 HG23 THR A 100 -10.516 13.932 -5.570 1.00 0.00 H new ATOM 1456 N VAL A 101 -8.228 9.656 -6.150 1.00 0.00 N ATOM 1457 CA VAL A 101 -7.643 8.437 -6.618 1.00 0.00 C ATOM 1458 C VAL A 101 -8.689 7.389 -6.963 1.00 0.00 C ATOM 1459 O VAL A 101 -9.859 7.503 -6.586 1.00 0.00 O ATOM 1460 CB VAL A 101 -6.665 7.829 -5.597 1.00 0.00 C ATOM 1461 CG1 VAL A 101 -5.235 8.157 -5.975 1.00 0.00 C ATOM 1462 CG2 VAL A 101 -6.966 8.263 -4.166 1.00 0.00 C ATOM 0 H VAL A 101 -8.869 9.538 -5.366 1.00 0.00 H new ATOM 0 HA VAL A 101 -7.097 8.712 -7.521 1.00 0.00 H new ATOM 0 HB VAL A 101 -6.799 6.748 -5.627 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -4.556 7.720 -5.243 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -5.017 7.749 -6.962 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -5.102 9.239 -5.992 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -6.246 7.805 -3.488 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -6.895 9.348 -4.092 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -7.973 7.946 -3.894 1.00 0.00 H new ATOM 1472 N LYS A 102 -8.225 6.358 -7.667 1.00 0.00 N ATOM 1473 CA LYS A 102 -9.029 5.261 -8.097 1.00 0.00 C ATOM 1474 C LYS A 102 -8.260 3.966 -7.953 1.00 0.00 C ATOM 1475 O LYS A 102 -7.040 3.921 -8.100 1.00 0.00 O ATOM 1476 CB LYS A 102 -9.466 5.481 -9.528 1.00 0.00 C ATOM 1477 CG LYS A 102 -10.699 4.687 -9.934 1.00 0.00 C ATOM 1478 CD LYS A 102 -10.956 4.774 -11.429 1.00 0.00 C ATOM 1479 CE LYS A 102 -12.357 4.295 -11.778 1.00 0.00 C ATOM 1480 NZ LYS A 102 -12.643 4.415 -13.235 1.00 0.00 N ATOM 0 H LYS A 102 -7.249 6.279 -7.952 1.00 0.00 H new ATOM 0 HA LYS A 102 -9.919 5.194 -7.472 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -9.666 6.542 -9.676 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -8.643 5.217 -10.192 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -10.571 3.643 -9.647 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -11.568 5.062 -9.393 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -10.828 5.804 -11.763 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -10.220 4.172 -11.962 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -12.471 3.255 -11.471 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -13.089 4.876 -11.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -13.608 4.078 -13.428 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -12.560 5.410 -13.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -11.962 3.841 -13.771 1.00 0.00 H new ATOM 1494 N GLN A 103 -9.015 2.917 -7.683 1.00 0.00 N ATOM 1495 CA GLN A 103 -8.493 1.576 -7.498 1.00 0.00 C ATOM 1496 C GLN A 103 -7.721 1.103 -8.734 1.00 0.00 C ATOM 1497 O GLN A 103 -8.130 1.337 -9.874 1.00 0.00 O ATOM 1498 CB GLN A 103 -9.650 0.622 -7.177 1.00 0.00 C ATOM 1499 CG GLN A 103 -9.245 -0.681 -6.479 1.00 0.00 C ATOM 1500 CD GLN A 103 -9.001 -1.813 -7.448 1.00 0.00 C ATOM 1501 OE1 GLN A 103 -9.126 -2.988 -7.101 1.00 0.00 O ATOM 1502 NE2 GLN A 103 -8.667 -1.460 -8.671 1.00 0.00 N ATOM 0 H GLN A 103 -10.029 2.975 -7.584 1.00 0.00 H new ATOM 0 HA GLN A 103 -7.791 1.584 -6.664 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -10.368 1.146 -6.546 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -10.164 0.374 -8.106 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -8.342 -0.509 -5.894 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -10.028 -0.971 -5.778 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -8.576 -0.473 -8.910 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -8.499 -2.174 -9.380 1.00 0.00 H new ATOM 1511 N GLY A 104 -6.597 0.452 -8.460 1.00 0.00 N ATOM 1512 CA GLY A 104 -5.717 -0.083 -9.491 1.00 0.00 C ATOM 1513 C GLY A 104 -4.864 0.963 -10.182 1.00 0.00 C ATOM 1514 O GLY A 104 -4.020 0.627 -11.012 1.00 0.00 O ATOM 0 H GLY A 104 -6.269 0.279 -7.510 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -5.063 -0.831 -9.043 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -6.322 -0.595 -10.239 1.00 0.00 H new ATOM 1518 N GLN A 105 -5.109 2.233 -9.854 1.00 0.00 N ATOM 1519 CA GLN A 105 -4.373 3.352 -10.418 1.00 0.00 C ATOM 1520 C GLN A 105 -2.986 3.404 -9.832 1.00 0.00 C ATOM 1521 O GLN A 105 -2.782 3.085 -8.659 1.00 0.00 O ATOM 1522 CB GLN A 105 -5.145 4.646 -10.149 1.00 0.00 C ATOM 1523 CG GLN A 105 -4.643 5.898 -10.855 1.00 0.00 C ATOM 1524 CD GLN A 105 -5.613 7.045 -10.673 1.00 0.00 C ATOM 1525 OE1 GLN A 105 -6.393 7.365 -11.569 1.00 0.00 O ATOM 1526 NE2 GLN A 105 -5.590 7.648 -9.490 1.00 0.00 N ATOM 0 H GLN A 105 -5.828 2.509 -9.186 1.00 0.00 H new ATOM 0 HA GLN A 105 -4.271 3.228 -11.496 1.00 0.00 H new ATOM 0 HB2 GLN A 105 -6.185 4.488 -10.434 1.00 0.00 H new ATOM 0 HB3 GLN A 105 -5.134 4.833 -9.075 1.00 0.00 H new ATOM 0 HG2 GLN A 105 -3.666 6.176 -10.460 1.00 0.00 H new ATOM 0 HG3 GLN A 105 -4.511 5.693 -11.917 1.00 0.00 H new ATOM 0 HE21 GLN A 105 -4.925 7.348 -8.777 1.00 0.00 H new ATOM 0 HE22 GLN A 105 -6.238 8.411 -9.294 1.00 0.00 H new ATOM 1535 N ILE A 106 -2.039 3.785 -10.669 1.00 0.00 N ATOM 1536 CA ILE A 106 -0.665 3.869 -10.260 1.00 0.00 C ATOM 1537 C ILE A 106 -0.469 5.092 -9.377 1.00 0.00 C ATOM 1538 O ILE A 106 -0.405 6.234 -9.847 1.00 0.00 O ATOM 1539 CB ILE A 106 0.317 3.844 -11.452 1.00 0.00 C ATOM 1540 CG1 ILE A 106 0.275 2.463 -12.138 1.00 0.00 C ATOM 1541 CG2 ILE A 106 1.751 4.182 -11.017 1.00 0.00 C ATOM 1542 CD1 ILE A 106 0.620 2.482 -13.617 1.00 0.00 C ATOM 0 H ILE A 106 -2.207 4.041 -11.642 1.00 0.00 H new ATOM 0 HA ILE A 106 -0.430 2.978 -9.678 1.00 0.00 H new ATOM 0 HB ILE A 106 0.003 4.610 -12.161 1.00 0.00 H new ATOM 0 HG12 ILE A 106 0.968 1.796 -11.625 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -0.723 2.041 -12.016 1.00 0.00 H new ATOM 0 HG21 ILE A 106 2.411 4.154 -11.884 1.00 0.00 H new ATOM 0 HG22 ILE A 106 1.772 5.179 -10.577 1.00 0.00 H new ATOM 0 HG23 ILE A 106 2.089 3.453 -10.280 1.00 0.00 H new ATOM 0 HD11 ILE A 106 0.565 1.469 -14.016 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -0.087 3.120 -14.147 1.00 0.00 H new ATOM 0 HD13 ILE A 106 1.630 2.870 -13.750 1.00 0.00 H new ATOM 1554 N ILE A 107 -0.410 4.806 -8.094 1.00 0.00 N ATOM 1555 CA ILE A 107 -0.245 5.800 -7.066 1.00 0.00 C ATOM 1556 C ILE A 107 1.228 6.008 -6.678 1.00 0.00 C ATOM 1557 O ILE A 107 1.540 6.875 -5.855 1.00 0.00 O ATOM 1558 CB ILE A 107 -1.061 5.422 -5.805 1.00 0.00 C ATOM 1559 CG1 ILE A 107 -1.052 3.907 -5.538 1.00 0.00 C ATOM 1560 CG2 ILE A 107 -2.493 5.918 -5.927 1.00 0.00 C ATOM 1561 CD1 ILE A 107 -0.644 3.548 -4.130 1.00 0.00 C ATOM 0 H ILE A 107 -0.477 3.854 -7.733 1.00 0.00 H new ATOM 0 HA ILE A 107 -0.616 6.738 -7.479 1.00 0.00 H new ATOM 0 HB ILE A 107 -0.580 5.910 -4.957 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -2.046 3.505 -5.734 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -0.370 3.426 -6.240 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -3.051 5.643 -5.032 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -2.494 7.002 -6.037 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -2.962 5.465 -6.800 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -0.660 2.465 -4.012 1.00 0.00 H new ATOM 0 HD12 ILE A 107 0.362 3.920 -3.937 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -1.340 4.000 -3.423 1.00 0.00 H new ATOM 1573 N GLY A 108 2.122 5.207 -7.273 1.00 0.00 N ATOM 1574 CA GLY A 108 3.533 5.328 -7.016 1.00 0.00 C ATOM 1575 C GLY A 108 4.324 4.152 -7.540 1.00 0.00 C ATOM 1576 O GLY A 108 3.869 3.413 -8.416 1.00 0.00 O ATOM 0 H GLY A 108 1.876 4.471 -7.935 1.00 0.00 H new ATOM 0 HA2 GLY A 108 3.905 6.244 -7.475 1.00 0.00 H new ATOM 0 HA3 GLY A 108 3.696 5.421 -5.942 1.00 0.00 H new ATOM 1580 N TYR A 109 5.522 4.020 -6.995 1.00 0.00 N ATOM 1581 CA TYR A 109 6.472 2.975 -7.324 1.00 0.00 C ATOM 1582 C TYR A 109 7.177 2.557 -6.041 1.00 0.00 C ATOM 1583 O TYR A 109 7.568 3.412 -5.236 1.00 0.00 O ATOM 1584 CB TYR A 109 7.516 3.445 -8.362 1.00 0.00 C ATOM 1585 CG TYR A 109 6.938 4.107 -9.603 1.00 0.00 C ATOM 1586 CD1 TYR A 109 6.831 3.418 -10.805 1.00 0.00 C ATOM 1587 CD2 TYR A 109 6.508 5.427 -9.565 1.00 0.00 C ATOM 1588 CE1 TYR A 109 6.309 4.027 -11.932 1.00 0.00 C ATOM 1589 CE2 TYR A 109 5.983 6.042 -10.684 1.00 0.00 C ATOM 1590 CZ TYR A 109 5.887 5.341 -11.866 1.00 0.00 C ATOM 1591 OH TYR A 109 5.367 5.951 -12.983 1.00 0.00 O ATOM 0 H TYR A 109 5.871 4.663 -6.284 1.00 0.00 H new ATOM 0 HA TYR A 109 5.933 2.138 -7.768 1.00 0.00 H new ATOM 0 HB2 TYR A 109 8.196 4.146 -7.878 1.00 0.00 H new ATOM 0 HB3 TYR A 109 8.111 2.585 -8.671 1.00 0.00 H new ATOM 0 HD1 TYR A 109 7.161 2.391 -10.860 1.00 0.00 H new ATOM 0 HD2 TYR A 109 6.586 5.983 -8.642 1.00 0.00 H new ATOM 0 HE1 TYR A 109 6.232 3.478 -12.859 1.00 0.00 H new ATOM 0 HE2 TYR A 109 5.649 7.068 -10.633 1.00 0.00 H new ATOM 0 HH TYR A 109 5.118 6.874 -12.766 1.00 0.00 H new ATOM 1601 N THR A 110 7.350 1.246 -5.870 1.00 0.00 N ATOM 1602 CA THR A 110 7.982 0.659 -4.682 1.00 0.00 C ATOM 1603 C THR A 110 9.409 1.166 -4.472 1.00 0.00 C ATOM 1604 O THR A 110 10.082 1.527 -5.444 1.00 0.00 O ATOM 1605 CB THR A 110 8.000 -0.876 -4.776 1.00 0.00 C ATOM 1606 OG1 THR A 110 8.081 -1.301 -6.142 1.00 0.00 O ATOM 1607 CG2 THR A 110 6.765 -1.473 -4.121 1.00 0.00 C ATOM 0 H THR A 110 7.054 0.553 -6.557 1.00 0.00 H new ATOM 0 HA THR A 110 7.382 0.970 -3.827 1.00 0.00 H new ATOM 0 HB THR A 110 8.883 -1.231 -4.245 1.00 0.00 H new ATOM 0 HG1 THR A 110 8.737 -2.025 -6.221 1.00 0.00 H new ATOM 0 HG21 THR A 110 6.800 -2.560 -4.200 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.736 -1.187 -3.070 1.00 0.00 H new ATOM 0 HG23 THR A 110 5.871 -1.102 -4.623 1.00 0.00 H new ATOM 1615 N GLY A 111 9.872 1.194 -3.207 1.00 0.00 N ATOM 1616 CA GLY A 111 11.209 1.681 -2.940 1.00 0.00 C ATOM 1617 C GLY A 111 11.875 1.005 -1.778 1.00 0.00 C ATOM 1618 O GLY A 111 11.370 0.011 -1.245 1.00 0.00 O ATOM 0 H GLY A 111 9.347 0.892 -2.387 1.00 0.00 H new ATOM 0 HA2 GLY A 111 11.822 1.541 -3.831 1.00 0.00 H new ATOM 0 HA3 GLY A 111 11.164 2.753 -2.749 1.00 0.00 H new ATOM 1622 N ALA A 112 13.021 1.561 -1.391 1.00 0.00 N ATOM 1623 CA ALA A 112 13.796 1.061 -0.283 1.00 0.00 C ATOM 1624 C ALA A 112 14.451 2.241 0.447 1.00 0.00 C ATOM 1625 O ALA A 112 15.633 2.199 0.816 1.00 0.00 O ATOM 1626 CB ALA A 112 14.849 0.059 -0.770 1.00 0.00 C ATOM 0 H ALA A 112 13.431 2.376 -1.847 1.00 0.00 H new ATOM 0 HA ALA A 112 13.141 0.535 0.411 1.00 0.00 H new ATOM 0 HB1 ALA A 112 15.424 -0.307 0.081 1.00 0.00 H new ATOM 0 HB2 ALA A 112 14.354 -0.779 -1.261 1.00 0.00 H new ATOM 0 HB3 ALA A 112 15.519 0.550 -1.476 1.00 0.00 H new ATOM 1632 N THR A 113 13.653 3.296 0.664 1.00 0.00 N ATOM 1633 CA THR A 113 14.130 4.531 1.297 1.00 0.00 C ATOM 1634 C THR A 113 14.174 4.459 2.836 1.00 0.00 C ATOM 1635 O THR A 113 14.575 5.429 3.491 1.00 0.00 O ATOM 1636 CB THR A 113 13.265 5.739 0.872 1.00 0.00 C ATOM 1637 OG1 THR A 113 11.880 5.460 1.111 1.00 0.00 O ATOM 1638 CG2 THR A 113 13.467 6.075 -0.601 1.00 0.00 C ATOM 0 H THR A 113 12.666 3.317 0.407 1.00 0.00 H new ATOM 0 HA THR A 113 15.155 4.659 0.947 1.00 0.00 H new ATOM 0 HB THR A 113 13.576 6.597 1.467 1.00 0.00 H new ATOM 0 HG1 THR A 113 11.729 5.355 2.074 1.00 0.00 H new ATOM 0 HG21 THR A 113 12.845 6.929 -0.868 1.00 0.00 H new ATOM 0 HG22 THR A 113 14.514 6.320 -0.778 1.00 0.00 H new ATOM 0 HG23 THR A 113 13.187 5.217 -1.212 1.00 0.00 H new ATOM 1646 N GLY A 114 13.774 3.313 3.400 1.00 0.00 N ATOM 1647 CA GLY A 114 13.784 3.142 4.850 1.00 0.00 C ATOM 1648 C GLY A 114 14.969 2.325 5.334 1.00 0.00 C ATOM 1649 O GLY A 114 15.893 2.053 4.561 1.00 0.00 O ATOM 0 H GLY A 114 13.444 2.501 2.878 1.00 0.00 H new ATOM 0 HA2 GLY A 114 13.804 4.122 5.327 1.00 0.00 H new ATOM 0 HA3 GLY A 114 12.860 2.654 5.161 1.00 0.00 H new ATOM 1653 N GLN A 115 14.932 1.921 6.612 1.00 0.00 N ATOM 1654 CA GLN A 115 16.014 1.129 7.209 1.00 0.00 C ATOM 1655 C GLN A 115 15.716 -0.372 7.108 1.00 0.00 C ATOM 1656 O GLN A 115 15.066 -0.960 7.984 1.00 0.00 O ATOM 1657 CB GLN A 115 16.245 1.539 8.670 1.00 0.00 C ATOM 1658 CG GLN A 115 17.038 2.827 8.827 1.00 0.00 C ATOM 1659 CD GLN A 115 17.520 3.040 10.249 1.00 0.00 C ATOM 1660 OE1 GLN A 115 18.605 2.594 10.621 1.00 0.00 O ATOM 1661 NE2 GLN A 115 16.714 3.724 11.051 1.00 0.00 N ATOM 0 H GLN A 115 14.165 2.130 7.251 1.00 0.00 H new ATOM 0 HA GLN A 115 16.927 1.330 6.649 1.00 0.00 H new ATOM 0 HB2 GLN A 115 15.279 1.655 9.162 1.00 0.00 H new ATOM 0 HB3 GLN A 115 16.770 0.735 9.185 1.00 0.00 H new ATOM 0 HG2 GLN A 115 17.896 2.806 8.155 1.00 0.00 H new ATOM 0 HG3 GLN A 115 16.418 3.671 8.526 1.00 0.00 H new ATOM 0 HE21 GLN A 115 15.823 4.075 10.700 1.00 0.00 H new ATOM 0 HE22 GLN A 115 16.985 3.899 12.019 1.00 0.00 H new ATOM 1670 N VAL A 116 16.212 -0.975 6.023 1.00 0.00 N ATOM 1671 CA VAL A 116 16.029 -2.406 5.744 1.00 0.00 C ATOM 1672 C VAL A 116 17.144 -2.924 4.831 1.00 0.00 C ATOM 1673 O VAL A 116 17.866 -2.132 4.215 1.00 0.00 O ATOM 1674 CB VAL A 116 14.637 -2.725 5.108 1.00 0.00 C ATOM 1675 CG1 VAL A 116 13.599 -2.950 6.196 1.00 0.00 C ATOM 1676 CG2 VAL A 116 14.170 -1.623 4.153 1.00 0.00 C ATOM 0 H VAL A 116 16.753 -0.485 5.311 1.00 0.00 H new ATOM 0 HA VAL A 116 16.074 -2.917 6.706 1.00 0.00 H new ATOM 0 HB VAL A 116 14.751 -3.637 4.522 1.00 0.00 H new ATOM 0 HG11 VAL A 116 12.635 -3.171 5.739 1.00 0.00 H new ATOM 0 HG12 VAL A 116 13.904 -3.788 6.822 1.00 0.00 H new ATOM 0 HG13 VAL A 116 13.513 -2.052 6.808 1.00 0.00 H new ATOM 0 HG21 VAL A 116 13.199 -1.890 3.736 1.00 0.00 H new ATOM 0 HG22 VAL A 116 14.085 -0.682 4.697 1.00 0.00 H new ATOM 0 HG23 VAL A 116 14.893 -1.511 3.345 1.00 0.00 H new ATOM 1686 N THR A 117 17.273 -4.257 4.737 1.00 0.00 N ATOM 1687 CA THR A 117 18.305 -4.892 3.900 1.00 0.00 C ATOM 1688 C THR A 117 17.915 -4.924 2.418 1.00 0.00 C ATOM 1689 O THR A 117 18.725 -5.308 1.567 1.00 0.00 O ATOM 1690 CB THR A 117 18.604 -6.334 4.360 1.00 0.00 C ATOM 1691 OG1 THR A 117 17.379 -7.049 4.567 1.00 0.00 O ATOM 1692 CG2 THR A 117 19.431 -6.339 5.638 1.00 0.00 C ATOM 0 H THR A 117 16.674 -4.918 5.232 1.00 0.00 H new ATOM 0 HA THR A 117 19.197 -4.277 4.018 1.00 0.00 H new ATOM 0 HB THR A 117 19.180 -6.828 3.577 1.00 0.00 H new ATOM 0 HG1 THR A 117 17.579 -7.963 4.857 1.00 0.00 H new ATOM 0 HG21 THR A 117 19.627 -7.368 5.940 1.00 0.00 H new ATOM 0 HG22 THR A 117 20.376 -5.826 5.462 1.00 0.00 H new ATOM 0 HG23 THR A 117 18.882 -5.827 6.429 1.00 0.00 H new ATOM 1700 N GLY A 118 16.678 -4.513 2.121 1.00 0.00 N ATOM 1701 CA GLY A 118 16.199 -4.498 0.749 1.00 0.00 C ATOM 1702 C GLY A 118 14.957 -3.633 0.563 1.00 0.00 C ATOM 1703 O GLY A 118 14.580 -2.899 1.477 1.00 0.00 O ATOM 0 H GLY A 118 16.000 -4.190 2.811 1.00 0.00 H new ATOM 0 HA2 GLY A 118 16.992 -4.131 0.097 1.00 0.00 H new ATOM 0 HA3 GLY A 118 15.975 -5.518 0.437 1.00 0.00 H new ATOM 1707 N PRO A 119 14.297 -3.690 -0.631 1.00 0.00 N ATOM 1708 CA PRO A 119 13.074 -2.906 -0.930 1.00 0.00 C ATOM 1709 C PRO A 119 11.863 -3.419 -0.154 1.00 0.00 C ATOM 1710 O PRO A 119 11.773 -4.618 0.125 1.00 0.00 O ATOM 1711 CB PRO A 119 12.894 -3.109 -2.450 1.00 0.00 C ATOM 1712 CG PRO A 119 14.207 -3.639 -2.916 1.00 0.00 C ATOM 1713 CD PRO A 119 14.685 -4.497 -1.799 1.00 0.00 C ATOM 0 HA PRO A 119 13.163 -1.859 -0.641 1.00 0.00 H new ATOM 0 HB2 PRO A 119 12.086 -3.808 -2.664 1.00 0.00 H new ATOM 0 HB3 PRO A 119 12.645 -2.172 -2.948 1.00 0.00 H new ATOM 0 HG2 PRO A 119 14.099 -4.212 -3.837 1.00 0.00 H new ATOM 0 HG3 PRO A 119 14.909 -2.831 -3.124 1.00 0.00 H new ATOM 0 HD2 PRO A 119 14.207 -5.477 -1.799 1.00 0.00 H new ATOM 0 HD3 PRO A 119 15.761 -4.667 -1.842 1.00 0.00 H new ATOM 1721 N HIS A 120 10.943 -2.506 0.218 1.00 0.00 N ATOM 1722 CA HIS A 120 9.769 -2.873 0.980 1.00 0.00 C ATOM 1723 C HIS A 120 8.591 -1.948 0.729 1.00 0.00 C ATOM 1724 O HIS A 120 8.734 -0.799 0.299 1.00 0.00 O ATOM 1725 CB HIS A 120 10.078 -2.914 2.489 1.00 0.00 C ATOM 1726 CG HIS A 120 10.688 -4.203 2.947 1.00 0.00 C ATOM 1727 ND1 HIS A 120 12.022 -4.335 3.270 1.00 0.00 N ATOM 1728 CD2 HIS A 120 10.133 -5.423 3.143 1.00 0.00 C ATOM 1729 CE1 HIS A 120 12.262 -5.579 3.642 1.00 0.00 C ATOM 1730 NE2 HIS A 120 11.133 -6.259 3.575 1.00 0.00 N ATOM 0 H HIS A 120 11.006 -1.513 -0.005 1.00 0.00 H new ATOM 0 HA HIS A 120 9.488 -3.869 0.638 1.00 0.00 H new ATOM 0 HB2 HIS A 120 10.755 -2.095 2.734 1.00 0.00 H new ATOM 0 HB3 HIS A 120 9.156 -2.742 3.044 1.00 0.00 H new ATOM 0 HD2 HIS A 120 9.098 -5.689 2.988 1.00 0.00 H new ATOM 0 HE1 HIS A 120 13.220 -5.973 3.949 1.00 0.00 H new ATOM 0 HE2 HIS A 120 11.021 -7.246 3.807 1.00 0.00 H new ATOM 1739 N LEU A 121 7.432 -2.521 0.993 1.00 0.00 N ATOM 1740 CA LEU A 121 6.153 -1.891 0.871 1.00 0.00 C ATOM 1741 C LEU A 121 5.518 -1.834 2.245 1.00 0.00 C ATOM 1742 O LEU A 121 5.453 -2.838 2.963 1.00 0.00 O ATOM 1743 CB LEU A 121 5.273 -2.654 -0.141 1.00 0.00 C ATOM 1744 CG LEU A 121 3.742 -2.466 -0.058 1.00 0.00 C ATOM 1745 CD1 LEU A 121 3.322 -1.088 -0.556 1.00 0.00 C ATOM 1746 CD2 LEU A 121 3.031 -3.550 -0.859 1.00 0.00 C ATOM 0 H LEU A 121 7.366 -3.487 1.314 1.00 0.00 H new ATOM 0 HA LEU A 121 6.261 -0.875 0.490 1.00 0.00 H new ATOM 0 HB2 LEU A 121 5.591 -2.366 -1.143 1.00 0.00 H new ATOM 0 HB3 LEU A 121 5.485 -3.718 -0.032 1.00 0.00 H new ATOM 0 HG LEU A 121 3.454 -2.548 0.990 1.00 0.00 H new ATOM 0 HD11 LEU A 121 2.239 -0.990 -0.484 1.00 0.00 H new ATOM 0 HD12 LEU A 121 3.798 -0.320 0.054 1.00 0.00 H new ATOM 0 HD13 LEU A 121 3.629 -0.968 -1.595 1.00 0.00 H new ATOM 0 HD21 LEU A 121 1.953 -3.405 -0.791 1.00 0.00 H new ATOM 0 HD22 LEU A 121 3.340 -3.493 -1.903 1.00 0.00 H new ATOM 0 HD23 LEU A 121 3.291 -4.529 -0.457 1.00 0.00 H new ATOM 1758 N HIS A 122 5.098 -0.646 2.607 1.00 0.00 N ATOM 1759 CA HIS A 122 4.463 -0.417 3.872 1.00 0.00 C ATOM 1760 C HIS A 122 2.993 -0.055 3.668 1.00 0.00 C ATOM 1761 O HIS A 122 2.663 1.059 3.248 1.00 0.00 O ATOM 1762 CB HIS A 122 5.217 0.665 4.683 1.00 0.00 C ATOM 1763 CG HIS A 122 4.487 1.139 5.919 1.00 0.00 C ATOM 1764 ND1 HIS A 122 4.818 0.678 7.169 1.00 0.00 N ATOM 1765 CD2 HIS A 122 3.402 1.953 6.020 1.00 0.00 C ATOM 1766 CE1 HIS A 122 3.917 1.199 7.995 1.00 0.00 C ATOM 1767 NE2 HIS A 122 3.049 1.978 7.340 1.00 0.00 N ATOM 0 H HIS A 122 5.190 0.188 2.027 1.00 0.00 H new ATOM 0 HA HIS A 122 4.501 -1.337 4.455 1.00 0.00 H new ATOM 0 HB2 HIS A 122 6.189 0.269 4.979 1.00 0.00 H new ATOM 0 HB3 HIS A 122 5.405 1.522 4.036 1.00 0.00 H new ATOM 0 HD2 HIS A 122 2.914 2.478 5.213 1.00 0.00 H new ATOM 0 HE1 HIS A 122 3.889 1.017 9.059 1.00 0.00 H new ATOM 0 HE2 HIS A 122 2.270 2.494 7.749 1.00 0.00 H new ATOM 1775 N PHE A 123 2.132 -0.984 4.050 1.00 0.00 N ATOM 1776 CA PHE A 123 0.692 -0.820 3.926 1.00 0.00 C ATOM 1777 C PHE A 123 0.048 -0.802 5.313 1.00 0.00 C ATOM 1778 O PHE A 123 0.004 -1.824 6.011 1.00 0.00 O ATOM 1779 CB PHE A 123 0.110 -1.962 3.073 1.00 0.00 C ATOM 1780 CG PHE A 123 -1.305 -1.760 2.591 1.00 0.00 C ATOM 1781 CD1 PHE A 123 -1.566 -1.035 1.439 1.00 0.00 C ATOM 1782 CD2 PHE A 123 -2.369 -2.318 3.283 1.00 0.00 C ATOM 1783 CE1 PHE A 123 -2.860 -0.872 0.988 1.00 0.00 C ATOM 1784 CE2 PHE A 123 -3.665 -2.155 2.837 1.00 0.00 C ATOM 1785 CZ PHE A 123 -3.911 -1.432 1.687 1.00 0.00 C ATOM 0 H PHE A 123 2.413 -1.876 4.456 1.00 0.00 H new ATOM 0 HA PHE A 123 0.477 0.128 3.433 1.00 0.00 H new ATOM 0 HB2 PHE A 123 0.753 -2.107 2.205 1.00 0.00 H new ATOM 0 HB3 PHE A 123 0.148 -2.882 3.656 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -0.748 -0.593 0.889 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -2.182 -2.887 4.182 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -3.051 -0.306 0.088 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -4.485 -2.592 3.387 1.00 0.00 H new ATOM 0 HZ PHE A 123 -4.924 -1.305 1.335 1.00 0.00 H new ATOM 1795 N GLU A 124 -0.409 0.378 5.711 1.00 0.00 N ATOM 1796 CA GLU A 124 -1.070 0.565 6.972 1.00 0.00 C ATOM 1797 C GLU A 124 -2.481 1.101 6.737 1.00 0.00 C ATOM 1798 O GLU A 124 -2.674 2.116 6.071 1.00 0.00 O ATOM 1799 CB GLU A 124 -0.252 1.538 7.836 1.00 0.00 C ATOM 1800 CG GLU A 124 -0.517 1.437 9.331 1.00 0.00 C ATOM 1801 CD GLU A 124 0.289 2.442 10.130 1.00 0.00 C ATOM 1802 OE1 GLU A 124 -0.316 3.375 10.696 1.00 0.00 O ATOM 1803 OE2 GLU A 124 1.529 2.298 10.185 1.00 0.00 O ATOM 0 H GLU A 124 -0.325 1.230 5.156 1.00 0.00 H new ATOM 0 HA GLU A 124 -1.147 -0.388 7.496 1.00 0.00 H new ATOM 0 HB2 GLU A 124 0.808 1.359 7.656 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -0.463 2.557 7.511 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -1.579 1.594 9.520 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -0.278 0.430 9.672 1.00 0.00 H new ATOM 1810 N MET A 125 -3.450 0.401 7.299 1.00 0.00 N ATOM 1811 CA MET A 125 -4.825 0.741 7.217 1.00 0.00 C ATOM 1812 C MET A 125 -5.322 1.164 8.574 1.00 0.00 C ATOM 1813 O MET A 125 -5.040 0.522 9.590 1.00 0.00 O ATOM 1814 CB MET A 125 -5.612 -0.453 6.685 1.00 0.00 C ATOM 1815 CG MET A 125 -5.578 -1.724 7.529 1.00 0.00 C ATOM 1816 SD MET A 125 -6.439 -3.080 6.717 1.00 0.00 S ATOM 1817 CE MET A 125 -8.112 -2.836 7.302 1.00 0.00 C ATOM 0 H MET A 125 -3.276 -0.446 7.840 1.00 0.00 H new ATOM 0 HA MET A 125 -4.964 1.576 6.530 1.00 0.00 H new ATOM 0 HB2 MET A 125 -6.652 -0.150 6.567 1.00 0.00 H new ATOM 0 HB3 MET A 125 -5.235 -0.694 5.691 1.00 0.00 H new ATOM 0 HG2 MET A 125 -4.543 -2.010 7.717 1.00 0.00 H new ATOM 0 HG3 MET A 125 -6.036 -1.530 8.499 1.00 0.00 H new ATOM 0 HE1 MET A 125 -8.814 -3.256 6.582 1.00 0.00 H new ATOM 0 HE2 MET A 125 -8.237 -3.334 8.263 1.00 0.00 H new ATOM 0 HE3 MET A 125 -8.305 -1.769 7.418 1.00 0.00 H new ATOM 1827 N LEU A 126 -6.066 2.240 8.561 1.00 0.00 N ATOM 1828 CA LEU A 126 -6.614 2.815 9.757 1.00 0.00 C ATOM 1829 C LEU A 126 -8.065 3.270 9.526 1.00 0.00 C ATOM 1830 O LEU A 126 -8.506 3.325 8.379 1.00 0.00 O ATOM 1831 CB LEU A 126 -5.767 4.030 10.181 1.00 0.00 C ATOM 1832 CG LEU A 126 -4.507 3.721 10.984 1.00 0.00 C ATOM 1833 CD1 LEU A 126 -3.300 3.623 10.065 1.00 0.00 C ATOM 1834 CD2 LEU A 126 -4.293 4.782 12.046 1.00 0.00 C ATOM 0 H LEU A 126 -6.310 2.745 7.709 1.00 0.00 H new ATOM 0 HA LEU A 126 -6.601 2.058 10.541 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -5.477 4.576 9.283 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -6.395 4.697 10.771 1.00 0.00 H new ATOM 0 HG LEU A 126 -4.633 2.758 11.479 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -2.410 3.402 10.655 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -3.460 2.827 9.338 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -3.163 4.570 9.542 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -3.391 4.552 12.613 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -4.184 5.756 11.570 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -5.150 4.801 12.719 1.00 0.00 H new ATOM 1846 N PRO A 127 -8.853 3.573 10.605 1.00 0.00 N ATOM 1847 CA PRO A 127 -10.228 4.081 10.475 1.00 0.00 C ATOM 1848 C PRO A 127 -10.291 5.429 9.783 1.00 0.00 C ATOM 1849 O PRO A 127 -9.263 5.990 9.393 1.00 0.00 O ATOM 1850 CB PRO A 127 -10.694 4.295 11.919 1.00 0.00 C ATOM 1851 CG PRO A 127 -9.461 4.270 12.747 1.00 0.00 C ATOM 1852 CD PRO A 127 -8.503 3.381 12.025 1.00 0.00 C ATOM 0 HA PRO A 127 -10.828 3.384 9.889 1.00 0.00 H new ATOM 0 HB2 PRO A 127 -11.217 5.245 12.025 1.00 0.00 H new ATOM 0 HB3 PRO A 127 -11.388 3.513 12.226 1.00 0.00 H new ATOM 0 HG2 PRO A 127 -9.050 5.272 12.866 1.00 0.00 H new ATOM 0 HG3 PRO A 127 -9.669 3.890 13.747 1.00 0.00 H new ATOM 0 HD2 PRO A 127 -7.469 3.661 12.224 1.00 0.00 H new ATOM 0 HD3 PRO A 127 -8.616 2.340 12.328 1.00 0.00 H new ATOM 1860 N ALA A 128 -11.511 5.950 9.667 1.00 0.00 N ATOM 1861 CA ALA A 128 -11.725 7.259 9.107 1.00 0.00 C ATOM 1862 C ALA A 128 -11.242 8.317 10.101 1.00 0.00 C ATOM 1863 O ALA A 128 -10.832 9.417 9.720 1.00 0.00 O ATOM 1864 CB ALA A 128 -13.193 7.464 8.791 1.00 0.00 C ATOM 0 H ALA A 128 -12.364 5.473 9.959 1.00 0.00 H new ATOM 0 HA ALA A 128 -11.161 7.351 8.179 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -13.339 8.458 8.368 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -13.519 6.713 8.072 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -13.779 7.369 9.705 1.00 0.00 H new ATOM 1870 N ASN A 129 -11.287 7.926 11.387 1.00 0.00 N ATOM 1871 CA ASN A 129 -10.874 8.764 12.508 1.00 0.00 C ATOM 1872 C ASN A 129 -10.531 7.884 13.677 1.00 0.00 C ATOM 1873 O ASN A 129 -11.409 7.381 14.388 1.00 0.00 O ATOM 1874 CB ASN A 129 -11.921 9.830 12.877 1.00 0.00 C ATOM 1875 CG ASN A 129 -11.511 11.220 12.427 1.00 0.00 C ATOM 1876 OD1 ASN A 129 -10.931 11.987 13.195 1.00 0.00 O ATOM 1877 ND2 ASN A 129 -11.808 11.549 11.176 1.00 0.00 N ATOM 0 H ASN A 129 -11.617 7.004 11.672 1.00 0.00 H new ATOM 0 HA ASN A 129 -9.990 9.326 12.208 1.00 0.00 H new ATOM 0 HB2 ASN A 129 -12.877 9.570 12.422 1.00 0.00 H new ATOM 0 HB3 ASN A 129 -12.072 9.830 13.957 1.00 0.00 H new ATOM 0 HD21 ASN A 129 -11.554 12.469 10.817 1.00 0.00 H new ATOM 0 HD22 ASN A 129 -12.290 10.882 10.574 1.00 0.00 H new ATOM 1884 N PRO A 130 -9.214 7.681 13.880 1.00 0.00 N ATOM 1885 CA PRO A 130 -8.708 6.814 14.921 1.00 0.00 C ATOM 1886 C PRO A 130 -8.816 7.326 16.341 1.00 0.00 C ATOM 1887 O PRO A 130 -9.028 8.514 16.600 1.00 0.00 O ATOM 1888 CB PRO A 130 -7.230 6.605 14.600 1.00 0.00 C ATOM 1889 CG PRO A 130 -7.013 7.258 13.271 1.00 0.00 C ATOM 1890 CD PRO A 130 -8.116 8.245 13.082 1.00 0.00 C ATOM 0 HA PRO A 130 -9.323 5.914 14.912 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -6.595 7.052 15.365 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -6.983 5.544 14.561 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -6.043 7.754 13.239 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -7.018 6.517 12.472 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -7.832 9.237 13.433 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -8.391 8.344 12.032 1.00 0.00 H new ATOM 1898 N ASN A 131 -8.661 6.365 17.239 1.00 0.00 N ATOM 1899 CA ASN A 131 -8.669 6.565 18.649 1.00 0.00 C ATOM 1900 C ASN A 131 -7.306 6.148 19.173 1.00 0.00 C ATOM 1901 O ASN A 131 -7.159 5.140 19.872 1.00 0.00 O ATOM 1902 CB ASN A 131 -9.765 5.735 19.265 1.00 0.00 C ATOM 1903 CG ASN A 131 -10.489 6.447 20.371 1.00 0.00 C ATOM 1904 OD1 ASN A 131 -10.114 6.368 21.540 1.00 0.00 O ATOM 1905 ND2 ASN A 131 -11.538 7.153 19.993 1.00 0.00 N ATOM 0 H ASN A 131 -8.521 5.389 16.976 1.00 0.00 H new ATOM 0 HA ASN A 131 -8.859 7.608 18.904 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -10.480 5.455 18.491 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -9.338 4.810 19.654 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -12.082 7.668 20.685 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -11.805 7.183 19.009 1.00 0.00 H new ATOM 1912 N TRP A 132 -6.310 6.977 18.839 1.00 0.00 N ATOM 1913 CA TRP A 132 -4.906 6.747 19.211 1.00 0.00 C ATOM 1914 C TRP A 132 -4.684 6.769 20.733 1.00 0.00 C ATOM 1915 O TRP A 132 -3.545 6.837 21.217 1.00 0.00 O ATOM 1916 CB TRP A 132 -3.985 7.799 18.570 1.00 0.00 C ATOM 1917 CG TRP A 132 -4.326 8.149 17.156 1.00 0.00 C ATOM 1918 CD1 TRP A 132 -4.032 7.421 16.045 1.00 0.00 C ATOM 1919 CD2 TRP A 132 -5.035 9.309 16.704 1.00 0.00 C ATOM 1920 NE1 TRP A 132 -4.496 8.064 14.928 1.00 0.00 N ATOM 1921 CE2 TRP A 132 -5.118 9.217 15.307 1.00 0.00 C ATOM 1922 CE3 TRP A 132 -5.605 10.417 17.340 1.00 0.00 C ATOM 1923 CZ2 TRP A 132 -5.743 10.179 14.533 1.00 0.00 C ATOM 1924 CZ3 TRP A 132 -6.230 11.378 16.567 1.00 0.00 C ATOM 1925 CH2 TRP A 132 -6.294 11.253 15.173 1.00 0.00 C ATOM 0 H TRP A 132 -6.454 7.831 18.300 1.00 0.00 H new ATOM 0 HA TRP A 132 -4.660 5.752 18.839 1.00 0.00 H new ATOM 0 HB2 TRP A 132 -4.018 8.707 19.173 1.00 0.00 H new ATOM 0 HB3 TRP A 132 -2.959 7.432 18.602 1.00 0.00 H new ATOM 0 HD1 TRP A 132 -3.510 6.476 16.044 1.00 0.00 H new ATOM 0 HE1 TRP A 132 -4.393 7.734 13.968 1.00 0.00 H new ATOM 0 HE3 TRP A 132 -5.558 10.520 18.414 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 -5.794 10.084 13.458 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 -6.676 12.238 17.045 1.00 0.00 H new ATOM 0 HH2 TRP A 132 -6.788 12.019 14.594 1.00 0.00 H new ATOM 1936 N GLN A 133 -5.785 6.681 21.468 1.00 0.00 N ATOM 1937 CA GLN A 133 -5.799 6.718 22.910 1.00 0.00 C ATOM 1938 C GLN A 133 -5.455 5.365 23.545 1.00 0.00 C ATOM 1939 O GLN A 133 -5.991 4.973 24.588 1.00 0.00 O ATOM 1940 CB GLN A 133 -7.165 7.197 23.355 1.00 0.00 C ATOM 1941 CG GLN A 133 -7.468 8.659 23.009 1.00 0.00 C ATOM 1942 CD GLN A 133 -7.977 8.834 21.579 1.00 0.00 C ATOM 1943 OE1 GLN A 133 -9.179 8.962 21.348 1.00 0.00 O ATOM 1944 NE2 GLN A 133 -7.059 8.802 20.610 1.00 0.00 N ATOM 0 H GLN A 133 -6.714 6.579 21.059 1.00 0.00 H new ATOM 0 HA GLN A 133 -5.023 7.405 23.249 1.00 0.00 H new ATOM 0 HB2 GLN A 133 -7.925 6.563 22.898 1.00 0.00 H new ATOM 0 HB3 GLN A 133 -7.248 7.067 24.434 1.00 0.00 H new ATOM 0 HG2 GLN A 133 -8.212 9.046 23.705 1.00 0.00 H new ATOM 0 HG3 GLN A 133 -6.565 9.255 23.144 1.00 0.00 H new ATOM 0 HE21 GLN A 133 -6.072 8.694 20.845 1.00 0.00 H new ATOM 0 HE22 GLN A 133 -7.344 8.885 19.634 1.00 0.00 H new ATOM 1953 N ASN A 134 -4.545 4.670 22.866 1.00 0.00 N ATOM 1954 CA ASN A 134 -4.009 3.360 23.247 1.00 0.00 C ATOM 1955 C ASN A 134 -5.051 2.283 23.078 1.00 0.00 C ATOM 1956 O ASN A 134 -6.172 2.400 23.583 1.00 0.00 O ATOM 1957 CB ASN A 134 -3.442 3.359 24.673 1.00 0.00 C ATOM 1958 CG ASN A 134 -2.134 4.118 24.754 1.00 0.00 C ATOM 1959 OD1 ASN A 134 -1.058 3.524 24.805 1.00 0.00 O ATOM 1960 ND2 ASN A 134 -2.225 5.441 24.748 1.00 0.00 N ATOM 0 H ASN A 134 -4.142 5.018 21.996 1.00 0.00 H new ATOM 0 HA ASN A 134 -3.179 3.144 22.574 1.00 0.00 H new ATOM 0 HB2 ASN A 134 -4.166 3.807 25.353 1.00 0.00 H new ATOM 0 HB3 ASN A 134 -3.288 2.332 25.003 1.00 0.00 H new ATOM 0 HD21 ASN A 134 -1.380 6.011 24.787 1.00 0.00 H new ATOM 0 HD22 ASN A 134 -3.140 5.889 24.705 1.00 0.00 H new ATOM 1967 N GLY A 135 -4.667 1.242 22.356 1.00 0.00 N ATOM 1968 CA GLY A 135 -5.570 0.152 22.107 1.00 0.00 C ATOM 1969 C GLY A 135 -5.328 -0.525 20.775 1.00 0.00 C ATOM 1970 O GLY A 135 -5.245 -1.754 20.712 1.00 0.00 O ATOM 0 H GLY A 135 -3.742 1.138 21.939 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -5.471 -0.584 22.905 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -6.595 0.522 22.139 1.00 0.00 H new ATOM 1974 N PHE A 136 -5.241 0.276 19.707 1.00 0.00 N ATOM 1975 CA PHE A 136 -4.995 -0.241 18.354 1.00 0.00 C ATOM 1976 C PHE A 136 -4.252 0.771 17.500 1.00 0.00 C ATOM 1977 O PHE A 136 -3.629 0.412 16.505 1.00 0.00 O ATOM 1978 CB PHE A 136 -6.311 -0.642 17.644 1.00 0.00 C ATOM 1979 CG PHE A 136 -7.555 0.172 17.985 1.00 0.00 C ATOM 1980 CD1 PHE A 136 -7.517 1.553 18.204 1.00 0.00 C ATOM 1981 CD2 PHE A 136 -8.782 -0.468 18.065 1.00 0.00 C ATOM 1982 CE1 PHE A 136 -8.667 2.252 18.493 1.00 0.00 C ATOM 1983 CE2 PHE A 136 -9.934 0.235 18.359 1.00 0.00 C ATOM 1984 CZ PHE A 136 -9.877 1.595 18.572 1.00 0.00 C ATOM 0 H PHE A 136 -5.338 1.290 19.753 1.00 0.00 H new ATOM 0 HA PHE A 136 -4.376 -1.131 18.471 1.00 0.00 H new ATOM 0 HB2 PHE A 136 -6.149 -0.579 16.568 1.00 0.00 H new ATOM 0 HB3 PHE A 136 -6.516 -1.687 17.875 1.00 0.00 H new ATOM 0 HD1 PHE A 136 -6.574 2.077 18.146 1.00 0.00 H new ATOM 0 HD2 PHE A 136 -8.838 -1.533 17.895 1.00 0.00 H new ATOM 0 HE1 PHE A 136 -8.622 3.318 18.658 1.00 0.00 H new ATOM 0 HE2 PHE A 136 -10.880 -0.282 18.422 1.00 0.00 H new ATOM 0 HZ PHE A 136 -10.778 2.145 18.800 1.00 0.00 H new ATOM 1994 N SER A 137 -4.340 2.047 17.902 1.00 0.00 N ATOM 1995 CA SER A 137 -3.724 3.191 17.204 1.00 0.00 C ATOM 1996 C SER A 137 -4.400 3.353 15.862 1.00 0.00 C ATOM 1997 O SER A 137 -3.914 4.034 14.952 1.00 0.00 O ATOM 1998 CB SER A 137 -2.197 3.039 17.067 1.00 0.00 C ATOM 1999 OG SER A 137 -1.552 3.264 18.308 1.00 0.00 O ATOM 0 H SER A 137 -4.852 2.321 18.740 1.00 0.00 H new ATOM 0 HA SER A 137 -3.873 4.094 17.797 1.00 0.00 H new ATOM 0 HB2 SER A 137 -1.958 2.039 16.705 1.00 0.00 H new ATOM 0 HB3 SER A 137 -1.823 3.744 16.325 1.00 0.00 H new ATOM 0 HG SER A 137 -0.584 3.160 18.197 1.00 0.00 H new ATOM 2005 N GLY A 138 -5.577 2.723 15.803 1.00 0.00 N ATOM 2006 CA GLY A 138 -6.405 2.727 14.629 1.00 0.00 C ATOM 2007 C GLY A 138 -5.903 1.781 13.557 1.00 0.00 C ATOM 2008 O GLY A 138 -6.591 1.536 12.566 1.00 0.00 O ATOM 0 H GLY A 138 -5.970 2.197 16.583 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -7.422 2.449 14.906 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -6.449 3.738 14.224 1.00 0.00 H new ATOM 2012 N ARG A 139 -4.695 1.242 13.744 1.00 0.00 N ATOM 2013 CA ARG A 139 -4.132 0.333 12.748 1.00 0.00 C ATOM 2014 C ARG A 139 -4.629 -1.105 12.911 1.00 0.00 C ATOM 2015 O ARG A 139 -4.544 -1.688 13.996 1.00 0.00 O ATOM 2016 CB ARG A 139 -2.590 0.377 12.717 1.00 0.00 C ATOM 2017 CG ARG A 139 -1.883 0.367 14.075 1.00 0.00 C ATOM 2018 CD ARG A 139 -1.758 -1.034 14.659 1.00 0.00 C ATOM 2019 NE ARG A 139 -1.027 -1.037 15.931 1.00 0.00 N ATOM 2020 CZ ARG A 139 -1.333 -1.808 16.986 1.00 0.00 C ATOM 2021 NH1 ARG A 139 -2.358 -2.657 16.945 1.00 0.00 N ATOM 2022 NH2 ARG A 139 -0.608 -1.719 18.093 1.00 0.00 N ATOM 0 H ARG A 139 -4.102 1.415 14.556 1.00 0.00 H new ATOM 0 HA ARG A 139 -4.494 0.695 11.786 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -2.235 -0.477 12.140 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -2.284 1.274 12.179 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -0.889 0.802 13.966 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -2.433 0.999 14.772 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -2.753 -1.453 14.812 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -1.246 -1.680 13.945 1.00 0.00 H new ATOM 0 HE ARG A 139 -0.229 -0.408 16.020 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -2.926 -2.730 16.101 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -2.575 -3.235 17.757 1.00 0.00 H new ATOM 0 HH21 ARG A 139 0.176 -1.068 18.138 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -0.834 -2.302 18.899 1.00 0.00 H new ATOM 2036 N ILE A 140 -5.167 -1.651 11.817 1.00 0.00 N ATOM 2037 CA ILE A 140 -5.662 -3.024 11.802 1.00 0.00 C ATOM 2038 C ILE A 140 -5.024 -3.851 10.674 1.00 0.00 C ATOM 2039 O ILE A 140 -4.156 -3.361 9.947 1.00 0.00 O ATOM 2040 CB ILE A 140 -7.210 -3.125 11.729 1.00 0.00 C ATOM 2041 CG1 ILE A 140 -7.907 -1.774 11.939 1.00 0.00 C ATOM 2042 CG2 ILE A 140 -7.714 -4.124 12.758 1.00 0.00 C ATOM 2043 CD1 ILE A 140 -8.079 -0.977 10.667 1.00 0.00 C ATOM 0 H ILE A 140 -5.270 -1.159 10.929 1.00 0.00 H new ATOM 0 HA ILE A 140 -5.360 -3.444 12.761 1.00 0.00 H new ATOM 0 HB ILE A 140 -7.457 -3.462 10.722 1.00 0.00 H new ATOM 0 HG12 ILE A 140 -8.886 -1.946 12.385 1.00 0.00 H new ATOM 0 HG13 ILE A 140 -7.331 -1.184 12.652 1.00 0.00 H new ATOM 0 HG21 ILE A 140 -8.801 -4.189 12.700 1.00 0.00 H new ATOM 0 HG22 ILE A 140 -7.281 -5.104 12.557 1.00 0.00 H new ATOM 0 HG23 ILE A 140 -7.423 -3.797 13.756 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -8.579 -0.035 10.893 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -7.101 -0.774 10.230 1.00 0.00 H new ATOM 0 HD13 ILE A 140 -8.681 -1.547 9.959 1.00 0.00 H new ATOM 2055 N ASP A 141 -5.512 -5.093 10.515 1.00 0.00 N ATOM 2056 CA ASP A 141 -4.978 -6.058 9.544 1.00 0.00 C ATOM 2057 C ASP A 141 -5.459 -5.823 8.090 1.00 0.00 C ATOM 2058 O ASP A 141 -6.650 -5.585 7.878 1.00 0.00 O ATOM 2059 CB ASP A 141 -5.327 -7.495 9.979 1.00 0.00 C ATOM 2060 CG ASP A 141 -6.799 -7.698 10.322 1.00 0.00 C ATOM 2061 OD1 ASP A 141 -7.092 -8.079 11.475 1.00 0.00 O ATOM 2062 OD2 ASP A 141 -7.652 -7.472 9.439 1.00 0.00 O ATOM 0 H ASP A 141 -6.293 -5.456 11.061 1.00 0.00 H new ATOM 0 HA ASP A 141 -3.898 -5.909 9.538 1.00 0.00 H new ATOM 0 HB2 ASP A 141 -5.053 -8.183 9.179 1.00 0.00 H new ATOM 0 HB3 ASP A 141 -4.722 -7.758 10.847 1.00 0.00 H new ATOM 2067 N PRO A 142 -4.535 -5.896 7.063 1.00 0.00 N ATOM 2068 CA PRO A 142 -4.895 -5.710 5.641 1.00 0.00 C ATOM 2069 C PRO A 142 -5.597 -6.938 5.025 1.00 0.00 C ATOM 2070 O PRO A 142 -5.966 -6.926 3.844 1.00 0.00 O ATOM 2071 CB PRO A 142 -3.555 -5.497 4.925 1.00 0.00 C ATOM 2072 CG PRO A 142 -2.477 -5.651 5.946 1.00 0.00 C ATOM 2073 CD PRO A 142 -3.093 -6.195 7.205 1.00 0.00 C ATOM 0 HA PRO A 142 -5.596 -4.881 5.540 1.00 0.00 H new ATOM 0 HB2 PRO A 142 -3.429 -6.222 4.121 1.00 0.00 H new ATOM 0 HB3 PRO A 142 -3.515 -4.507 4.470 1.00 0.00 H new ATOM 0 HG2 PRO A 142 -1.702 -6.325 5.581 1.00 0.00 H new ATOM 0 HG3 PRO A 142 -1.999 -4.691 6.141 1.00 0.00 H new ATOM 0 HD2 PRO A 142 -2.916 -7.266 7.304 1.00 0.00 H new ATOM 0 HD3 PRO A 142 -2.673 -5.719 8.091 1.00 0.00 H new ATOM 2081 N THR A 143 -5.812 -7.984 5.853 1.00 0.00 N ATOM 2082 CA THR A 143 -6.430 -9.250 5.440 1.00 0.00 C ATOM 2083 C THR A 143 -7.770 -9.076 4.731 1.00 0.00 C ATOM 2084 O THR A 143 -8.190 -9.945 3.960 1.00 0.00 O ATOM 2085 CB THR A 143 -6.603 -10.195 6.640 1.00 0.00 C ATOM 2086 OG1 THR A 143 -6.802 -9.453 7.849 1.00 0.00 O ATOM 2087 CG2 THR A 143 -5.395 -11.106 6.787 1.00 0.00 C ATOM 0 H THR A 143 -5.555 -7.966 6.840 1.00 0.00 H new ATOM 0 HA THR A 143 -5.741 -9.687 4.718 1.00 0.00 H new ATOM 0 HB THR A 143 -7.485 -10.808 6.456 1.00 0.00 H new ATOM 0 HG1 THR A 143 -7.393 -8.692 7.672 1.00 0.00 H new ATOM 0 HG21 THR A 143 -5.539 -11.766 7.642 1.00 0.00 H new ATOM 0 HG22 THR A 143 -5.278 -11.704 5.883 1.00 0.00 H new ATOM 0 HG23 THR A 143 -4.501 -10.502 6.941 1.00 0.00 H new ATOM 2095 N GLY A 144 -8.426 -7.947 4.999 1.00 0.00 N ATOM 2096 CA GLY A 144 -9.712 -7.640 4.383 1.00 0.00 C ATOM 2097 C GLY A 144 -9.565 -7.378 2.894 1.00 0.00 C ATOM 2098 O GLY A 144 -10.458 -7.703 2.108 1.00 0.00 O ATOM 0 H GLY A 144 -8.085 -7.230 5.640 1.00 0.00 H new ATOM 0 HA2 GLY A 144 -10.400 -8.470 4.542 1.00 0.00 H new ATOM 0 HA3 GLY A 144 -10.149 -6.766 4.866 1.00 0.00 H new ATOM 2102 N TYR A 145 -8.402 -6.825 2.521 1.00 0.00 N ATOM 2103 CA TYR A 145 -8.081 -6.512 1.134 1.00 0.00 C ATOM 2104 C TYR A 145 -7.297 -7.648 0.468 1.00 0.00 C ATOM 2105 O TYR A 145 -7.146 -7.677 -0.758 1.00 0.00 O ATOM 2106 CB TYR A 145 -7.243 -5.231 1.028 1.00 0.00 C ATOM 2107 CG TYR A 145 -7.790 -4.037 1.773 1.00 0.00 C ATOM 2108 CD1 TYR A 145 -7.526 -3.866 3.124 1.00 0.00 C ATOM 2109 CD2 TYR A 145 -8.553 -3.075 1.124 1.00 0.00 C ATOM 2110 CE1 TYR A 145 -8.006 -2.770 3.810 1.00 0.00 C ATOM 2111 CE2 TYR A 145 -9.040 -1.976 1.804 1.00 0.00 C ATOM 2112 CZ TYR A 145 -8.762 -1.829 3.146 1.00 0.00 C ATOM 2113 OH TYR A 145 -9.231 -0.733 3.827 1.00 0.00 O ATOM 0 H TYR A 145 -7.661 -6.584 3.179 1.00 0.00 H new ATOM 0 HA TYR A 145 -9.034 -6.374 0.624 1.00 0.00 H new ATOM 0 HB2 TYR A 145 -6.240 -5.441 1.399 1.00 0.00 H new ATOM 0 HB3 TYR A 145 -7.145 -4.967 -0.025 1.00 0.00 H new ATOM 0 HD1 TYR A 145 -6.935 -4.603 3.647 1.00 0.00 H new ATOM 0 HD2 TYR A 145 -8.769 -3.188 0.072 1.00 0.00 H new ATOM 0 HE1 TYR A 145 -7.790 -2.650 4.861 1.00 0.00 H new ATOM 0 HE2 TYR A 145 -9.635 -1.237 1.288 1.00 0.00 H new ATOM 0 HH TYR A 145 -9.513 -1.003 4.726 1.00 0.00 H new ATOM 2123 N ILE A 146 -6.800 -8.572 1.293 1.00 0.00 N ATOM 2124 CA ILE A 146 -6.001 -9.697 0.821 1.00 0.00 C ATOM 2125 C ILE A 146 -6.836 -10.985 0.742 1.00 0.00 C ATOM 2126 O ILE A 146 -6.385 -11.992 0.189 1.00 0.00 O ATOM 2127 CB ILE A 146 -4.750 -9.926 1.735 1.00 0.00 C ATOM 2128 CG1 ILE A 146 -4.045 -8.588 2.113 1.00 0.00 C ATOM 2129 CG2 ILE A 146 -3.746 -10.896 1.093 1.00 0.00 C ATOM 2130 CD1 ILE A 146 -3.568 -7.726 0.941 1.00 0.00 C ATOM 0 H ILE A 146 -6.941 -8.559 2.303 1.00 0.00 H new ATOM 0 HA ILE A 146 -5.658 -9.447 -0.183 1.00 0.00 H new ATOM 0 HB ILE A 146 -5.122 -10.378 2.654 1.00 0.00 H new ATOM 0 HG12 ILE A 146 -4.733 -7.996 2.717 1.00 0.00 H new ATOM 0 HG13 ILE A 146 -3.185 -8.818 2.742 1.00 0.00 H new ATOM 0 HG21 ILE A 146 -2.892 -11.029 1.758 1.00 0.00 H new ATOM 0 HG22 ILE A 146 -4.228 -11.859 0.924 1.00 0.00 H new ATOM 0 HG23 ILE A 146 -3.405 -10.489 0.141 1.00 0.00 H new ATOM 0 HD11 ILE A 146 -3.094 -6.822 1.323 1.00 0.00 H new ATOM 0 HD12 ILE A 146 -2.849 -8.288 0.345 1.00 0.00 H new ATOM 0 HD13 ILE A 146 -4.421 -7.453 0.319 1.00 0.00 H new ATOM 2142 N ALA A 147 -8.056 -10.927 1.277 1.00 0.00 N ATOM 2143 CA ALA A 147 -8.982 -12.057 1.266 1.00 0.00 C ATOM 2144 C ALA A 147 -9.652 -12.213 -0.090 1.00 0.00 C ATOM 2145 O ALA A 147 -9.989 -13.323 -0.514 1.00 0.00 O ATOM 2146 CB ALA A 147 -10.031 -11.877 2.342 1.00 0.00 C ATOM 0 H ALA A 147 -8.429 -10.093 1.731 1.00 0.00 H new ATOM 0 HA ALA A 147 -8.409 -12.963 1.465 1.00 0.00 H new ATOM 0 HB1 ALA A 147 -10.717 -12.724 2.327 1.00 0.00 H new ATOM 0 HB2 ALA A 147 -9.546 -11.820 3.317 1.00 0.00 H new ATOM 0 HB3 ALA A 147 -10.586 -10.957 2.159 1.00 0.00 H new ATOM 2152 N ASN A 148 -9.840 -11.077 -0.748 1.00 0.00 N ATOM 2153 CA ASN A 148 -10.452 -11.002 -2.048 1.00 0.00 C ATOM 2154 C ASN A 148 -9.384 -10.792 -3.103 1.00 0.00 C ATOM 2155 O ASN A 148 -9.666 -10.448 -4.259 1.00 0.00 O ATOM 2156 CB ASN A 148 -11.502 -9.867 -2.081 1.00 0.00 C ATOM 2157 CG ASN A 148 -11.475 -8.931 -0.881 1.00 0.00 C ATOM 2158 OD1 ASN A 148 -12.506 -8.651 -0.269 1.00 0.00 O ATOM 2159 ND2 ASN A 148 -10.301 -8.434 -0.561 1.00 0.00 N ATOM 0 H ASN A 148 -9.562 -10.169 -0.377 1.00 0.00 H new ATOM 0 HA ASN A 148 -10.967 -11.939 -2.261 1.00 0.00 H new ATOM 0 HB2 ASN A 148 -11.350 -9.278 -2.986 1.00 0.00 H new ATOM 0 HB3 ASN A 148 -12.494 -10.312 -2.153 1.00 0.00 H new ATOM 0 HD21 ASN A 148 -10.218 -7.788 0.224 1.00 0.00 H new ATOM 0 HD22 ASN A 148 -9.473 -8.695 -1.097 1.00 0.00 H new ATOM 2166 N ALA A 149 -8.152 -11.024 -2.674 1.00 0.00 N ATOM 2167 CA ALA A 149 -7.003 -10.863 -3.489 1.00 0.00 C ATOM 2168 C ALA A 149 -6.473 -12.210 -4.035 1.00 0.00 C ATOM 2169 O ALA A 149 -6.769 -13.270 -3.473 1.00 0.00 O ATOM 2170 CB ALA A 149 -5.966 -10.125 -2.669 1.00 0.00 C ATOM 0 H ALA A 149 -7.941 -11.335 -1.726 1.00 0.00 H new ATOM 0 HA ALA A 149 -7.256 -10.285 -4.378 1.00 0.00 H new ATOM 0 HB1 ALA A 149 -5.065 -9.982 -3.265 1.00 0.00 H new ATOM 0 HB2 ALA A 149 -6.361 -9.154 -2.371 1.00 0.00 H new ATOM 0 HB3 ALA A 149 -5.724 -10.707 -1.779 1.00 0.00 H new ATOM 2176 N PRO A 150 -5.701 -12.175 -5.162 1.00 0.00 N ATOM 2177 CA PRO A 150 -5.107 -13.369 -5.823 1.00 0.00 C ATOM 2178 C PRO A 150 -4.225 -14.248 -4.912 1.00 0.00 C ATOM 2179 O PRO A 150 -4.011 -13.928 -3.739 1.00 0.00 O ATOM 2180 CB PRO A 150 -4.276 -12.771 -6.971 1.00 0.00 C ATOM 2181 CG PRO A 150 -4.122 -11.337 -6.632 1.00 0.00 C ATOM 2182 CD PRO A 150 -5.375 -10.956 -5.910 1.00 0.00 C ATOM 0 HA PRO A 150 -5.893 -14.054 -6.141 1.00 0.00 H new ATOM 0 HB2 PRO A 150 -3.307 -13.263 -7.053 1.00 0.00 H new ATOM 0 HB3 PRO A 150 -4.780 -12.897 -7.929 1.00 0.00 H new ATOM 0 HG2 PRO A 150 -3.244 -11.175 -6.006 1.00 0.00 H new ATOM 0 HG3 PRO A 150 -3.989 -10.734 -7.530 1.00 0.00 H new ATOM 0 HD2 PRO A 150 -5.218 -10.105 -5.248 1.00 0.00 H new ATOM 0 HD3 PRO A 150 -6.172 -10.680 -6.600 1.00 0.00 H new ATOM 2190 N VAL A 151 -3.708 -15.346 -5.495 1.00 0.00 N ATOM 2191 CA VAL A 151 -2.886 -16.328 -4.802 1.00 0.00 C ATOM 2192 C VAL A 151 -1.456 -16.336 -5.340 1.00 0.00 C ATOM 2193 O VAL A 151 -1.227 -16.353 -6.551 1.00 0.00 O ATOM 2194 CB VAL A 151 -3.468 -17.751 -4.942 1.00 0.00 C ATOM 2195 CG1 VAL A 151 -2.567 -18.795 -4.283 1.00 0.00 C ATOM 2196 CG2 VAL A 151 -4.883 -17.835 -4.375 1.00 0.00 C ATOM 0 H VAL A 151 -3.859 -15.570 -6.479 1.00 0.00 H new ATOM 0 HA VAL A 151 -2.880 -16.039 -3.751 1.00 0.00 H new ATOM 0 HB VAL A 151 -3.515 -17.970 -6.009 1.00 0.00 H new ATOM 0 HG11 VAL A 151 -3.009 -19.784 -4.402 1.00 0.00 H new ATOM 0 HG12 VAL A 151 -1.585 -18.778 -4.755 1.00 0.00 H new ATOM 0 HG13 VAL A 151 -2.464 -18.569 -3.222 1.00 0.00 H new ATOM 0 HG21 VAL A 151 -5.261 -18.851 -4.490 1.00 0.00 H new ATOM 0 HG22 VAL A 151 -4.867 -17.571 -3.317 1.00 0.00 H new ATOM 0 HG23 VAL A 151 -5.532 -17.143 -4.912 1.00 0.00 H new ATOM 2206 N PHE A 152 -0.530 -16.358 -4.401 1.00 0.00 N ATOM 2207 CA PHE A 152 0.909 -16.407 -4.673 1.00 0.00 C ATOM 2208 C PHE A 152 1.429 -17.850 -4.493 1.00 0.00 C ATOM 2209 O PHE A 152 1.717 -18.285 -3.373 1.00 0.00 O ATOM 2210 CB PHE A 152 1.631 -15.405 -3.733 1.00 0.00 C ATOM 2211 CG PHE A 152 3.137 -15.531 -3.654 1.00 0.00 C ATOM 2212 CD1 PHE A 152 3.953 -14.942 -4.601 1.00 0.00 C ATOM 2213 CD2 PHE A 152 3.723 -16.237 -2.620 1.00 0.00 C ATOM 2214 CE1 PHE A 152 5.327 -15.053 -4.522 1.00 0.00 C ATOM 2215 CE2 PHE A 152 5.099 -16.354 -2.534 1.00 0.00 C ATOM 2216 CZ PHE A 152 5.901 -15.762 -3.487 1.00 0.00 C ATOM 0 H PHE A 152 -0.753 -16.342 -3.406 1.00 0.00 H new ATOM 0 HA PHE A 152 1.114 -16.117 -5.704 1.00 0.00 H new ATOM 0 HB2 PHE A 152 1.388 -14.394 -4.059 1.00 0.00 H new ATOM 0 HB3 PHE A 152 1.224 -15.523 -2.729 1.00 0.00 H new ATOM 0 HD1 PHE A 152 3.510 -14.387 -5.415 1.00 0.00 H new ATOM 0 HD2 PHE A 152 3.100 -16.703 -1.871 1.00 0.00 H new ATOM 0 HE1 PHE A 152 5.951 -14.586 -5.269 1.00 0.00 H new ATOM 0 HE2 PHE A 152 5.545 -16.908 -1.721 1.00 0.00 H new ATOM 0 HZ PHE A 152 6.975 -15.853 -3.423 1.00 0.00 H new ATOM 2226 N ASN A 153 1.539 -18.579 -5.623 1.00 0.00 N ATOM 2227 CA ASN A 153 2.038 -19.984 -5.679 1.00 0.00 C ATOM 2228 C ASN A 153 1.141 -21.004 -4.948 1.00 0.00 C ATOM 2229 O ASN A 153 1.141 -22.188 -5.303 1.00 0.00 O ATOM 2230 CB ASN A 153 3.480 -20.087 -5.152 1.00 0.00 C ATOM 2231 CG ASN A 153 4.509 -19.959 -6.260 1.00 0.00 C ATOM 2232 OD1 ASN A 153 5.002 -20.957 -6.785 1.00 0.00 O ATOM 2233 ND2 ASN A 153 4.830 -18.724 -6.628 1.00 0.00 N ATOM 0 H ASN A 153 1.282 -18.210 -6.539 1.00 0.00 H new ATOM 0 HA ASN A 153 2.012 -20.248 -6.736 1.00 0.00 H new ATOM 0 HB2 ASN A 153 3.650 -19.307 -4.410 1.00 0.00 H new ATOM 0 HB3 ASN A 153 3.612 -21.043 -4.645 1.00 0.00 H new ATOM 0 HD21 ASN A 153 5.510 -18.574 -7.373 1.00 0.00 H new ATOM 0 HD22 ASN A 153 4.396 -17.925 -6.165 1.00 0.00 H new ATOM 2240 N GLY A 154 0.387 -20.544 -3.943 1.00 0.00 N ATOM 2241 CA GLY A 154 -0.488 -21.424 -3.179 1.00 0.00 C ATOM 2242 C GLY A 154 -0.163 -21.405 -1.699 1.00 0.00 C ATOM 2243 O GLY A 154 0.440 -22.348 -1.179 1.00 0.00 O ATOM 0 H GLY A 154 0.369 -19.569 -3.645 1.00 0.00 H new ATOM 0 HA2 GLY A 154 -1.525 -21.121 -3.326 1.00 0.00 H new ATOM 0 HA3 GLY A 154 -0.397 -22.442 -3.557 1.00 0.00 H new ATOM 2247 N THR A 155 -0.570 -20.323 -1.026 1.00 0.00 N ATOM 2248 CA THR A 155 -0.332 -20.130 0.386 1.00 0.00 C ATOM 2249 C THR A 155 -1.504 -20.638 1.223 1.00 0.00 C ATOM 2250 O THR A 155 -2.571 -20.018 1.282 1.00 0.00 O ATOM 2251 CB THR A 155 -0.102 -18.638 0.677 1.00 0.00 C ATOM 2252 OG1 THR A 155 -1.065 -17.838 -0.024 1.00 0.00 O ATOM 2253 CG2 THR A 155 1.304 -18.215 0.281 1.00 0.00 C ATOM 0 H THR A 155 -1.079 -19.555 -1.463 1.00 0.00 H new ATOM 0 HA THR A 155 0.555 -20.702 0.658 1.00 0.00 H new ATOM 0 HB THR A 155 -0.221 -18.484 1.750 1.00 0.00 H new ATOM 0 HG1 THR A 155 -1.962 -18.205 0.120 1.00 0.00 H new ATOM 0 HG21 THR A 155 1.440 -17.155 0.498 1.00 0.00 H new ATOM 0 HG22 THR A 155 2.032 -18.797 0.846 1.00 0.00 H new ATOM 0 HG23 THR A 155 1.450 -18.389 -0.785 1.00 0.00 H new ATOM 2261 N THR A 156 -1.281 -21.787 1.847 1.00 0.00 N ATOM 2262 CA THR A 156 -2.273 -22.426 2.714 1.00 0.00 C ATOM 2263 C THR A 156 -1.717 -22.617 4.136 1.00 0.00 C ATOM 2264 O THR A 156 -0.677 -23.263 4.294 1.00 0.00 O ATOM 2265 CB THR A 156 -2.719 -23.798 2.163 1.00 0.00 C ATOM 2266 OG1 THR A 156 -1.581 -24.558 1.738 1.00 0.00 O ATOM 2267 CG2 THR A 156 -3.691 -23.631 1.003 1.00 0.00 C ATOM 0 H THR A 156 -0.407 -22.306 1.769 1.00 0.00 H new ATOM 0 HA THR A 156 -3.137 -21.762 2.743 1.00 0.00 H new ATOM 0 HB THR A 156 -3.227 -24.333 2.965 1.00 0.00 H new ATOM 0 HG1 THR A 156 -0.841 -24.417 2.365 1.00 0.00 H new ATOM 0 HG21 THR A 156 -3.989 -24.612 0.634 1.00 0.00 H new ATOM 0 HG22 THR A 156 -4.573 -23.088 1.343 1.00 0.00 H new ATOM 0 HG23 THR A 156 -3.208 -23.073 0.201 1.00 0.00 H new ATOM 2275 N PRO A 157 -2.378 -22.056 5.203 1.00 0.00 N ATOM 2276 CA PRO A 157 -1.912 -22.215 6.585 1.00 0.00 C ATOM 2277 C PRO A 157 -2.339 -23.547 7.203 1.00 0.00 C ATOM 2278 O PRO A 157 -1.568 -24.199 7.912 1.00 0.00 O ATOM 2279 CB PRO A 157 -2.555 -21.038 7.345 1.00 0.00 C ATOM 2280 CG PRO A 157 -3.451 -20.336 6.371 1.00 0.00 C ATOM 2281 CD PRO A 157 -3.595 -21.225 5.166 1.00 0.00 C ATOM 0 HA PRO A 157 -0.823 -22.216 6.633 1.00 0.00 H new ATOM 0 HB2 PRO A 157 -3.122 -21.396 8.204 1.00 0.00 H new ATOM 0 HB3 PRO A 157 -1.791 -20.360 7.727 1.00 0.00 H new ATOM 0 HG2 PRO A 157 -4.424 -20.138 6.820 1.00 0.00 H new ATOM 0 HG3 PRO A 157 -3.029 -19.372 6.088 1.00 0.00 H new ATOM 0 HD2 PRO A 157 -4.498 -21.833 5.222 1.00 0.00 H new ATOM 0 HD3 PRO A 157 -3.657 -20.645 4.245 1.00 0.00 H new ATOM 2289 N THR A 158 -3.574 -23.931 6.896 1.00 0.00 N ATOM 2290 CA THR A 158 -4.189 -25.164 7.377 1.00 0.00 C ATOM 2291 C THR A 158 -5.392 -25.514 6.503 1.00 0.00 C ATOM 2292 O THR A 158 -5.424 -26.554 5.838 1.00 0.00 O ATOM 2293 CB THR A 158 -4.602 -25.077 8.890 1.00 0.00 C ATOM 2294 OG1 THR A 158 -5.210 -26.301 9.321 1.00 0.00 O ATOM 2295 CG2 THR A 158 -5.539 -23.904 9.216 1.00 0.00 C ATOM 0 H THR A 158 -4.188 -23.383 6.294 1.00 0.00 H new ATOM 0 HA THR A 158 -3.445 -25.958 7.304 1.00 0.00 H new ATOM 0 HB THR A 158 -3.673 -24.901 9.432 1.00 0.00 H new ATOM 0 HG1 THR A 158 -5.459 -26.228 10.266 1.00 0.00 H new ATOM 0 HG21 THR A 158 -5.777 -23.914 10.280 1.00 0.00 H new ATOM 0 HG22 THR A 158 -5.048 -22.965 8.963 1.00 0.00 H new ATOM 0 HG23 THR A 158 -6.458 -24.001 8.637 1.00 0.00 H new ATOM 2303 N GLU A 159 -6.364 -24.610 6.531 1.00 0.00 N ATOM 2304 CA GLU A 159 -7.597 -24.725 5.764 1.00 0.00 C ATOM 2305 C GLU A 159 -7.402 -24.228 4.326 1.00 0.00 C ATOM 2306 O GLU A 159 -6.994 -23.058 4.150 1.00 0.00 O ATOM 2307 CB GLU A 159 -8.723 -23.942 6.455 1.00 0.00 C ATOM 2308 CG GLU A 159 -10.106 -24.549 6.261 1.00 0.00 C ATOM 2309 CD GLU A 159 -11.208 -23.705 6.871 1.00 0.00 C ATOM 2310 OE1 GLU A 159 -11.701 -22.785 6.184 1.00 0.00 O ATOM 2311 OE2 GLU A 159 -11.580 -23.965 8.035 1.00 0.00 O ATOM 2312 OXT GLU A 159 -7.659 -25.013 3.389 1.00 0.00 O ATOM 0 H GLU A 159 -6.316 -23.763 7.097 1.00 0.00 H new ATOM 0 HA GLU A 159 -7.874 -25.778 5.719 1.00 0.00 H new ATOM 0 HB2 GLU A 159 -8.509 -23.883 7.522 1.00 0.00 H new ATOM 0 HB3 GLU A 159 -8.729 -22.921 6.074 1.00 0.00 H new ATOM 0 HG2 GLU A 159 -10.297 -24.673 5.195 1.00 0.00 H new ATOM 0 HG3 GLU A 159 -10.127 -25.544 6.707 1.00 0.00 H new TER 2319 GLU A 159 HETATM 2320 ZN ZN A 201 6.436 -0.560 7.447 1.00 0.00 ZN HETATM 2321 O UNL A 202 8.093 0.604 7.744 1.00 0.00 O