USER MOD reduce.3.24.130724 H: found=0, std=0, add=1032, rem=0, adj=52 USER MOD reduce.3.24.130724 removed 1031 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 128 ASN : amide:sc= -0.0902 K(o=-0.35,f=-3.9!) USER MOD Set 1.2: A 135 SER OG : rot 120:sc= -0.256 USER MOD Set 2.1: A 101 GLN : amide:sc= -0.0705 K(o=0.28,f=-2.8) USER MOD Set 2.2: A 150 ASN : amide:sc= 0.349 K(o=0.28,f=-0.79) USER MOD Set 3.1: A 93 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 98 SER OG : rot -112:sc= 0.552 USER MOD Set 3.3: A 153 HIS : no HD1:sc= 0.628 K(o=1.2,f=-3.4) USER MOD Set 4.1: A 47 SER OG : rot 89:sc= 1.23 USER MOD Set 4.2: A 62 TYR OH : rot -147:sc= 1.79 USER MOD Set 4.3: A 71 SER OG : rot -5:sc= -0.518! USER MOD Set 5.1: A 57 CYS SG : rot 168:sc= -0.258 USER MOD Set 5.2: A 109 HIS : no HD1:sc= 0.658 K(o=0.4,f=-3!) USER MOD Set 6.1: A 43 SER OG : rot -99:sc= 0.347 USER MOD Set 6.2: A 89 THR OG1 : rot 180:sc= 0.0796 USER MOD Set 6.3: A 155 ASN : amide:sc= -0.616 K(o=-0.19,f=-2.5!) USER MOD Set 7.1: A 36 THR OG1 : rot 80:sc= -0.343 USER MOD Set 7.2: A 38 GLN :FLIP amide:sc= -0.305 F(o=-1.2,f=-0.65) USER MOD Single : A 1 MET CE :methyl -140:sc= -0.118 (180deg=-0.593) USER MOD Single : A 1 MET N :NH3+ -170:sc= -0.209 (180deg=-0.365) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 THR OG1 : rot -38:sc= 1.11 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 HIS : no HD1:sc= -0.0637 X(o=-0.064,f=-0.064) USER MOD Single : A 25 ASN : amide:sc= 0.435 K(o=0.44,f=-6!) USER MOD Single : A 32 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 33 THR OG1 : rot 180:sc= -0.346 USER MOD Single : A 34 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 37 ASN : amide:sc= -0.0918 X(o=-0.092,f=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 3:sc= 0.357 USER MOD Single : A 42 GLN : amide:sc= -1.42 K(o=-1.4,f=-2.6!) USER MOD Single : A 44 THR OG1 : rot -160:sc= 0 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 50 ASN : amide:sc= -0.875 X(o=-0.88,f=-1.3) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 GLN : amide:sc= -0.996 K(o=-1,f=-5.7!) USER MOD Single : A 58 THR OG1 : rot 138:sc= 0.305 USER MOD Single : A 60 TYR OH : rot 180:sc= -0.0414 USER MOD Single : A 64 LYS NZ :NH3+ 151:sc= 0.91 (180deg=0.458) USER MOD Single : A 68 ASN : amide:sc= 1.16 K(o=1.2,f=0) USER MOD Single : A 72 THR OG1 : rot -34:sc= 0.16 USER MOD Single : A 75 ASN : amide:sc=-0.00791 X(o=-0.0079,f=0) USER MOD Single : A 77 ASN : amide:sc=-0.00328 X(o=-0.0033,f=-0.21) USER MOD Single : A 78 ASN : amide:sc= 0.641 K(o=0.64,f=-0.42) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 75:sc= 0.801 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 88 TYR OH : rot 53:sc= 0.00783 USER MOD Single : A 91 ASN : amide:sc= -0.61 X(o=-0.61,f=-0.58) USER MOD Single : A 92 ASN :FLIP amide:sc=-0.00119 F(o=-1,f=-0.0012) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot -17:sc= 1.14 USER MOD Single : A 107 TYR OH : rot 180:sc= 0 USER MOD Single : A 112 TYR OH : rot 180:sc= -1.01 USER MOD Single : A 115 ASN : amide:sc= 0.415 X(o=0.42,f=-0.08) USER MOD Single : A 117 ASN :FLIP amide:sc= -0.0386 F(o=-0.74!,f=-0.039) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 125 SER OG : rot 160:sc= -0.0367 USER MOD Single : A 127 MET CE :methyl 142:sc= -0.37 (180deg=-1.2) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 130 ASN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 140 THR OG1 : rot 180:sc= -0.0254 USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD Single : A 147 SER OG : rot -21:sc= 0.251 USER MOD Single : A 148 SER OG : rot -17:sc= 0.221 USER MOD Single : A 149 TYR OH : rot 180:sc= 0 USER MOD Single : A 151 TYR OH : rot -140:sc= -2.41 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 58.853 25.079 -62.187 1.00 55.41 N ATOM 2 CA MET A 1 57.797 26.053 -62.591 1.00 44.10 C ATOM 3 C MET A 1 56.395 25.421 -62.550 1.00 75.23 C ATOM 4 O MET A 1 55.404 26.077 -62.865 1.00 35.32 O ATOM 5 CB MET A 1 58.078 26.584 -64.005 1.00 10.25 C ATOM 6 CG MET A 1 59.385 27.355 -64.122 1.00 55.45 C ATOM 7 SD MET A 1 59.719 27.921 -65.805 1.00 43.54 S ATOM 8 CE MET A 1 59.831 26.361 -66.682 1.00 61.31 C ATOM 0 H1 MET A 1 59.757 25.579 -62.062 1.00 55.41 H new ATOM 0 H2 MET A 1 58.582 24.625 -61.292 1.00 55.41 H new ATOM 0 H3 MET A 1 58.957 24.354 -62.925 1.00 55.41 H new ATOM 0 HA MET A 1 57.821 26.876 -61.877 1.00 44.10 H new ATOM 0 HB2 MET A 1 58.098 25.745 -64.701 1.00 10.25 H new ATOM 0 HB3 MET A 1 57.256 27.232 -64.310 1.00 10.25 H new ATOM 0 HG2 MET A 1 59.354 28.216 -63.454 1.00 55.45 H new ATOM 0 HG3 MET A 1 60.206 26.721 -63.788 1.00 55.45 H new ATOM 0 HE1 MET A 1 60.641 26.410 -67.410 1.00 61.31 H new ATOM 0 HE2 MET A 1 60.029 25.558 -65.972 1.00 61.31 H new ATOM 0 HE3 MET A 1 58.891 26.166 -67.198 1.00 61.31 H new ATOM 20 N LYS A 2 56.316 24.148 -62.157 1.00 32.50 N ATOM 21 CA LYS A 2 55.042 23.414 -62.137 1.00 10.51 C ATOM 22 C LYS A 2 54.585 23.090 -60.706 1.00 43.00 C ATOM 23 O LYS A 2 55.246 22.339 -59.986 1.00 72.40 O ATOM 24 CB LYS A 2 55.181 22.110 -62.935 1.00 2.01 C ATOM 25 CG LYS A 2 55.507 22.307 -64.414 1.00 12.52 C ATOM 26 CD LYS A 2 54.353 22.949 -65.179 1.00 73.14 C ATOM 27 CE LYS A 2 54.647 23.049 -66.673 1.00 74.23 C ATOM 28 NZ LYS A 2 53.475 23.545 -67.439 1.00 13.43 N ATOM 0 H LYS A 2 57.119 23.600 -61.847 1.00 32.50 H new ATOM 0 HA LYS A 2 54.288 24.056 -62.592 1.00 10.51 H new ATOM 0 HB2 LYS A 2 55.963 21.502 -62.481 1.00 2.01 H new ATOM 0 HB3 LYS A 2 54.251 21.547 -62.852 1.00 2.01 H new ATOM 0 HG2 LYS A 2 56.395 22.932 -64.508 1.00 12.52 H new ATOM 0 HG3 LYS A 2 55.746 21.343 -64.863 1.00 12.52 H new ATOM 0 HD2 LYS A 2 53.446 22.364 -65.026 1.00 73.14 H new ATOM 0 HD3 LYS A 2 54.162 23.945 -64.779 1.00 73.14 H new ATOM 0 HE2 LYS A 2 55.493 23.717 -66.832 1.00 74.23 H new ATOM 0 HE3 LYS A 2 54.939 22.069 -67.051 1.00 74.23 H new ATOM 0 HZ1 LYS A 2 53.717 23.598 -68.449 1.00 13.43 H new ATOM 0 HZ2 LYS A 2 52.674 22.894 -67.309 1.00 13.43 H new ATOM 0 HZ3 LYS A 2 53.211 24.491 -67.096 1.00 13.43 H new ATOM 42 N LYS A 3 53.447 23.657 -60.303 1.00 13.24 N ATOM 43 CA LYS A 3 52.847 23.355 -58.996 1.00 14.24 C ATOM 44 C LYS A 3 51.334 23.650 -58.990 1.00 24.45 C ATOM 45 O LYS A 3 50.909 24.802 -58.886 1.00 65.55 O ATOM 46 CB LYS A 3 53.561 24.132 -57.871 1.00 31.02 C ATOM 47 CG LYS A 3 53.632 25.644 -58.086 1.00 20.23 C ATOM 48 CD LYS A 3 54.257 26.353 -56.887 1.00 12.44 C ATOM 49 CE LYS A 3 54.310 27.867 -57.075 1.00 31.32 C ATOM 50 NZ LYS A 3 54.878 28.555 -55.881 1.00 40.23 N ATOM 0 H LYS A 3 52.920 24.329 -60.861 1.00 13.24 H new ATOM 0 HA LYS A 3 52.978 22.289 -58.811 1.00 14.24 H new ATOM 0 HB2 LYS A 3 53.047 23.936 -56.930 1.00 31.02 H new ATOM 0 HB3 LYS A 3 54.575 23.745 -57.767 1.00 31.02 H new ATOM 0 HG2 LYS A 3 54.216 25.858 -58.981 1.00 20.23 H new ATOM 0 HG3 LYS A 3 52.629 26.035 -58.259 1.00 20.23 H new ATOM 0 HD2 LYS A 3 53.683 26.120 -55.990 1.00 12.44 H new ATOM 0 HD3 LYS A 3 55.266 25.973 -56.728 1.00 12.44 H new ATOM 0 HE2 LYS A 3 54.913 28.103 -57.952 1.00 31.32 H new ATOM 0 HE3 LYS A 3 53.306 28.244 -57.268 1.00 31.32 H new ATOM 0 HZ1 LYS A 3 54.897 29.581 -56.048 1.00 40.23 H new ATOM 0 HZ2 LYS A 3 54.288 28.351 -55.049 1.00 40.23 H new ATOM 0 HZ3 LYS A 3 55.846 28.214 -55.711 1.00 40.23 H new ATOM 64 N LEU A 4 50.522 22.601 -59.117 1.00 62.11 N ATOM 65 CA LEU A 4 49.060 22.746 -59.150 1.00 23.14 C ATOM 66 C LEU A 4 48.393 21.948 -58.014 1.00 13.33 C ATOM 67 O LEU A 4 48.097 20.760 -58.167 1.00 45.03 O ATOM 68 CB LEU A 4 48.511 22.281 -60.511 1.00 21.15 C ATOM 69 CG LEU A 4 49.107 22.981 -61.745 1.00 21.22 C ATOM 70 CD1 LEU A 4 48.501 22.420 -63.031 1.00 4.34 C ATOM 71 CD2 LEU A 4 48.897 24.492 -61.665 1.00 2.34 C ATOM 0 H LEU A 4 50.849 21.638 -59.199 1.00 62.11 H new ATOM 0 HA LEU A 4 48.824 23.801 -59.008 1.00 23.14 H new ATOM 0 HB2 LEU A 4 48.684 21.209 -60.605 1.00 21.15 H new ATOM 0 HB3 LEU A 4 47.431 22.431 -60.517 1.00 21.15 H new ATOM 0 HG LEU A 4 50.179 22.786 -61.760 1.00 21.22 H new ATOM 0 HD11 LEU A 4 48.937 22.929 -63.891 1.00 4.34 H new ATOM 0 HD12 LEU A 4 48.711 21.352 -63.097 1.00 4.34 H new ATOM 0 HD13 LEU A 4 47.423 22.578 -63.024 1.00 4.34 H new ATOM 0 HD21 LEU A 4 49.326 24.966 -62.548 1.00 2.34 H new ATOM 0 HD22 LEU A 4 47.830 24.709 -61.619 1.00 2.34 H new ATOM 0 HD23 LEU A 4 49.385 24.880 -60.771 1.00 2.34 H new ATOM 83 N VAL A 5 48.176 22.600 -56.869 1.00 74.41 N ATOM 84 CA VAL A 5 47.552 21.952 -55.703 1.00 24.52 C ATOM 85 C VAL A 5 46.555 22.891 -54.998 1.00 71.54 C ATOM 86 O VAL A 5 46.716 24.112 -55.019 1.00 42.11 O ATOM 87 CB VAL A 5 48.619 21.486 -54.670 1.00 44.41 C ATOM 88 CG1 VAL A 5 49.519 20.398 -55.255 1.00 21.04 C ATOM 89 CG2 VAL A 5 49.451 22.673 -54.184 1.00 31.12 C ATOM 0 H VAL A 5 48.422 23.579 -56.720 1.00 74.41 H new ATOM 0 HA VAL A 5 47.017 21.083 -56.085 1.00 24.52 H new ATOM 0 HB VAL A 5 48.094 21.059 -53.815 1.00 44.41 H new ATOM 0 HG11 VAL A 5 50.254 20.094 -54.509 1.00 21.04 H new ATOM 0 HG12 VAL A 5 48.913 19.538 -55.539 1.00 21.04 H new ATOM 0 HG13 VAL A 5 50.034 20.785 -56.134 1.00 21.04 H new ATOM 0 HG21 VAL A 5 50.191 22.327 -53.463 1.00 31.12 H new ATOM 0 HG22 VAL A 5 49.958 23.133 -55.032 1.00 31.12 H new ATOM 0 HG23 VAL A 5 48.798 23.406 -53.710 1.00 31.12 H new ATOM 99 N THR A 6 45.529 22.314 -54.372 1.00 42.11 N ATOM 100 CA THR A 6 44.542 23.096 -53.605 1.00 12.22 C ATOM 101 C THR A 6 43.803 22.221 -52.579 1.00 72.42 C ATOM 102 O THR A 6 43.469 21.069 -52.857 1.00 63.31 O ATOM 103 CB THR A 6 43.498 23.780 -54.524 1.00 33.05 C ATOM 104 OG1 THR A 6 42.602 24.586 -53.734 1.00 0.44 O ATOM 105 CG2 THR A 6 42.702 22.755 -55.333 1.00 42.52 C ATOM 0 H THR A 6 45.354 21.309 -54.377 1.00 42.11 H new ATOM 0 HA THR A 6 45.110 23.866 -53.083 1.00 12.22 H new ATOM 0 HB THR A 6 44.037 24.415 -55.228 1.00 33.05 H new ATOM 0 HG1 THR A 6 41.946 25.017 -54.321 1.00 0.44 H new ATOM 0 HG21 THR A 6 41.980 23.272 -55.965 1.00 42.52 H new ATOM 0 HG22 THR A 6 43.383 22.176 -55.957 1.00 42.52 H new ATOM 0 HG23 THR A 6 42.175 22.085 -54.654 1.00 42.52 H new ATOM 113 N ALA A 7 43.557 22.765 -51.388 1.00 31.13 N ATOM 114 CA ALA A 7 42.871 22.022 -50.324 1.00 70.41 C ATOM 115 C ALA A 7 41.660 22.795 -49.782 1.00 64.53 C ATOM 116 O ALA A 7 41.807 23.766 -49.036 1.00 4.41 O ATOM 117 CB ALA A 7 43.848 21.697 -49.198 1.00 31.24 C ATOM 0 H ALA A 7 43.821 23.717 -51.133 1.00 31.13 H new ATOM 0 HA ALA A 7 42.498 21.091 -50.752 1.00 70.41 H new ATOM 0 HB1 ALA A 7 43.329 21.146 -48.414 1.00 31.24 H new ATOM 0 HB2 ALA A 7 44.665 21.090 -49.589 1.00 31.24 H new ATOM 0 HB3 ALA A 7 44.249 22.623 -48.786 1.00 31.24 H new ATOM 123 N THR A 8 40.463 22.360 -50.168 1.00 43.10 N ATOM 124 CA THR A 8 39.211 22.999 -49.729 1.00 40.23 C ATOM 125 C THR A 8 38.561 22.221 -48.573 1.00 33.34 C ATOM 126 O THR A 8 38.494 20.991 -48.600 1.00 43.53 O ATOM 127 CB THR A 8 38.203 23.102 -50.899 1.00 33.01 C ATOM 128 OG1 THR A 8 37.942 21.794 -51.435 1.00 43.45 O ATOM 129 CG2 THR A 8 38.734 24.011 -52.003 1.00 13.32 C ATOM 0 H THR A 8 40.327 21.562 -50.789 1.00 43.10 H new ATOM 0 HA THR A 8 39.468 24.000 -49.383 1.00 40.23 H new ATOM 0 HB THR A 8 37.279 23.532 -50.514 1.00 33.01 H new ATOM 0 HG1 THR A 8 37.302 21.865 -52.174 1.00 43.45 H new ATOM 0 HG21 THR A 8 38.005 24.065 -52.812 1.00 13.32 H new ATOM 0 HG22 THR A 8 38.905 25.010 -51.601 1.00 13.32 H new ATOM 0 HG23 THR A 8 39.672 23.609 -52.386 1.00 13.32 H new ATOM 137 N THR A 9 38.080 22.941 -47.557 1.00 54.40 N ATOM 138 CA THR A 9 37.523 22.304 -46.346 1.00 62.10 C ATOM 139 C THR A 9 36.134 22.857 -45.973 1.00 0.00 C ATOM 140 O THR A 9 35.698 22.747 -44.824 1.00 2.10 O ATOM 141 CB THR A 9 38.491 22.480 -45.142 1.00 14.14 C ATOM 142 OG1 THR A 9 37.983 21.822 -43.968 1.00 74.34 O ATOM 143 CG2 THR A 9 38.727 23.957 -44.836 1.00 5.40 C ATOM 0 H THR A 9 38.062 23.961 -47.542 1.00 54.40 H new ATOM 0 HA THR A 9 37.408 21.245 -46.577 1.00 62.10 H new ATOM 0 HB THR A 9 39.440 22.022 -45.422 1.00 14.14 H new ATOM 0 HG1 THR A 9 37.011 21.938 -43.923 1.00 74.34 H new ATOM 0 HG21 THR A 9 39.408 24.049 -43.990 1.00 5.40 H new ATOM 0 HG22 THR A 9 39.164 24.444 -45.708 1.00 5.40 H new ATOM 0 HG23 THR A 9 37.778 24.434 -44.592 1.00 5.40 H new ATOM 151 N LEU A 10 35.425 23.418 -46.949 1.00 34.44 N ATOM 152 CA LEU A 10 34.079 23.959 -46.709 1.00 53.52 C ATOM 153 C LEU A 10 33.052 22.821 -46.588 1.00 22.10 C ATOM 154 O LEU A 10 32.423 22.424 -47.571 1.00 62.24 O ATOM 155 CB LEU A 10 33.660 24.932 -47.831 1.00 52.15 C ATOM 156 CG LEU A 10 34.473 26.239 -47.934 1.00 22.54 C ATOM 157 CD1 LEU A 10 35.907 25.974 -48.399 1.00 40.03 C ATOM 158 CD2 LEU A 10 33.777 27.226 -48.870 1.00 54.13 C ATOM 0 H LEU A 10 35.753 23.512 -47.910 1.00 34.44 H new ATOM 0 HA LEU A 10 34.107 24.512 -45.770 1.00 53.52 H new ATOM 0 HB2 LEU A 10 33.731 24.408 -48.784 1.00 52.15 H new ATOM 0 HB3 LEU A 10 32.611 25.191 -47.687 1.00 52.15 H new ATOM 0 HG LEU A 10 34.527 26.678 -46.938 1.00 22.54 H new ATOM 0 HD11 LEU A 10 36.450 26.917 -48.460 1.00 40.03 H new ATOM 0 HD12 LEU A 10 36.404 25.315 -47.688 1.00 40.03 H new ATOM 0 HD13 LEU A 10 35.890 25.501 -49.381 1.00 40.03 H new ATOM 0 HD21 LEU A 10 34.363 28.143 -48.932 1.00 54.13 H new ATOM 0 HD22 LEU A 10 33.687 26.785 -49.863 1.00 54.13 H new ATOM 0 HD23 LEU A 10 32.784 27.455 -48.484 1.00 54.13 H new ATOM 170 N THR A 11 32.901 22.286 -45.377 1.00 42.33 N ATOM 171 CA THR A 11 32.010 21.138 -45.126 1.00 50.33 C ATOM 172 C THR A 11 30.953 21.446 -44.051 1.00 10.32 C ATOM 173 O THR A 11 30.322 20.536 -43.510 1.00 51.13 O ATOM 174 CB THR A 11 32.818 19.889 -44.689 1.00 52.44 C ATOM 175 OG1 THR A 11 33.568 20.170 -43.495 1.00 14.41 O ATOM 176 CG2 THR A 11 33.772 19.435 -45.793 1.00 30.53 C ATOM 0 H THR A 11 33.384 22.627 -44.546 1.00 42.33 H new ATOM 0 HA THR A 11 31.500 20.937 -46.068 1.00 50.33 H new ATOM 0 HB THR A 11 32.106 19.087 -44.491 1.00 52.44 H new ATOM 0 HG1 THR A 11 34.072 19.372 -43.230 1.00 14.41 H new ATOM 0 HG21 THR A 11 34.325 18.558 -45.458 1.00 30.53 H new ATOM 0 HG22 THR A 11 33.201 19.184 -46.687 1.00 30.53 H new ATOM 0 HG23 THR A 11 34.471 20.239 -46.023 1.00 30.53 H new ATOM 184 N ALA A 12 30.746 22.729 -43.766 1.00 73.02 N ATOM 185 CA ALA A 12 29.791 23.154 -42.735 1.00 42.02 C ATOM 186 C ALA A 12 28.332 22.832 -43.117 1.00 1.53 C ATOM 187 O ALA A 12 27.833 23.279 -44.152 1.00 23.21 O ATOM 188 CB ALA A 12 29.948 24.646 -42.466 1.00 32.13 C ATOM 0 H ALA A 12 31.226 23.498 -44.234 1.00 73.02 H new ATOM 0 HA ALA A 12 30.017 22.591 -41.829 1.00 42.02 H new ATOM 0 HB1 ALA A 12 29.236 24.954 -41.700 1.00 32.13 H new ATOM 0 HB2 ALA A 12 30.962 24.849 -42.122 1.00 32.13 H new ATOM 0 HB3 ALA A 12 29.758 25.203 -43.383 1.00 32.13 H new ATOM 194 N GLY A 13 27.654 22.059 -42.267 1.00 15.12 N ATOM 195 CA GLY A 13 26.252 21.710 -42.502 1.00 52.40 C ATOM 196 C GLY A 13 25.462 21.553 -41.202 1.00 64.25 C ATOM 197 O GLY A 13 24.903 20.490 -40.924 1.00 25.05 O ATOM 0 H GLY A 13 28.050 21.664 -41.414 1.00 15.12 H new ATOM 0 HA2 GLY A 13 25.787 22.482 -43.115 1.00 52.40 H new ATOM 0 HA3 GLY A 13 26.202 20.780 -43.068 1.00 52.40 H new ATOM 201 N ILE A 14 25.408 22.623 -40.412 1.00 62.33 N ATOM 202 CA ILE A 14 24.770 22.595 -39.087 1.00 2.24 C ATOM 203 C ILE A 14 23.234 22.646 -39.188 1.00 72.12 C ATOM 204 O ILE A 14 22.680 23.356 -40.031 1.00 43.20 O ATOM 205 CB ILE A 14 25.276 23.771 -38.198 1.00 73.54 C ATOM 206 CG1 ILE A 14 26.764 23.589 -37.827 1.00 32.21 C ATOM 207 CG2 ILE A 14 24.425 23.916 -36.933 1.00 72.40 C ATOM 208 CD1 ILE A 14 27.725 23.694 -38.999 1.00 2.43 C ATOM 0 H ILE A 14 25.800 23.530 -40.665 1.00 62.33 H new ATOM 0 HA ILE A 14 25.050 21.649 -38.623 1.00 2.24 H new ATOM 0 HB ILE A 14 25.178 24.686 -38.782 1.00 73.54 H new ATOM 0 HG12 ILE A 14 27.034 24.340 -37.084 1.00 32.21 H new ATOM 0 HG13 ILE A 14 26.891 22.614 -37.356 1.00 32.21 H new ATOM 0 HG21 ILE A 14 24.803 24.744 -36.333 1.00 72.40 H new ATOM 0 HG22 ILE A 14 23.390 24.112 -37.212 1.00 72.40 H new ATOM 0 HG23 ILE A 14 24.476 22.995 -36.352 1.00 72.40 H new ATOM 0 HD11 ILE A 14 28.747 23.554 -38.646 1.00 2.43 H new ATOM 0 HD12 ILE A 14 27.487 22.926 -39.735 1.00 2.43 H new ATOM 0 HD13 ILE A 14 27.632 24.678 -39.459 1.00 2.43 H new ATOM 220 N GLY A 15 22.558 21.889 -38.322 1.00 22.22 N ATOM 221 CA GLY A 15 21.096 21.868 -38.297 1.00 33.40 C ATOM 222 C GLY A 15 20.544 20.882 -37.270 1.00 12.43 C ATOM 223 O GLY A 15 20.773 19.672 -37.375 1.00 3.35 O ATOM 0 H GLY A 15 23.000 21.284 -37.630 1.00 22.22 H new ATOM 0 HA2 GLY A 15 20.725 22.868 -38.072 1.00 33.40 H new ATOM 0 HA3 GLY A 15 20.722 21.605 -39.287 1.00 33.40 H new ATOM 227 N ALA A 16 19.812 21.392 -36.278 1.00 22.41 N ATOM 228 CA ALA A 16 19.279 20.551 -35.196 1.00 42.40 C ATOM 229 C ALA A 16 17.898 21.031 -34.719 1.00 31.23 C ATOM 230 O ALA A 16 17.471 22.149 -35.025 1.00 14.21 O ATOM 231 CB ALA A 16 20.260 20.516 -34.028 1.00 22.00 C ATOM 0 H ALA A 16 19.573 22.380 -36.198 1.00 22.41 H new ATOM 0 HA ALA A 16 19.153 19.544 -35.593 1.00 42.40 H new ATOM 0 HB1 ALA A 16 19.856 19.891 -33.232 1.00 22.00 H new ATOM 0 HB2 ALA A 16 21.212 20.105 -34.364 1.00 22.00 H new ATOM 0 HB3 ALA A 16 20.414 21.527 -33.652 1.00 22.00 H new ATOM 237 N ALA A 17 17.201 20.181 -33.961 1.00 72.25 N ATOM 238 CA ALA A 17 15.863 20.508 -33.446 1.00 53.12 C ATOM 239 C ALA A 17 15.597 19.881 -32.069 1.00 1.33 C ATOM 240 O ALA A 17 16.116 18.805 -31.748 1.00 44.12 O ATOM 241 CB ALA A 17 14.795 20.054 -34.435 1.00 64.53 C ATOM 0 H ALA A 17 17.539 19.258 -33.688 1.00 72.25 H new ATOM 0 HA ALA A 17 15.821 21.591 -33.326 1.00 53.12 H new ATOM 0 HB1 ALA A 17 13.808 20.301 -34.044 1.00 64.53 H new ATOM 0 HB2 ALA A 17 14.944 20.560 -35.389 1.00 64.53 H new ATOM 0 HB3 ALA A 17 14.868 18.976 -34.580 1.00 64.53 H new ATOM 247 N ILE A 18 14.790 20.566 -31.259 1.00 63.12 N ATOM 248 CA ILE A 18 14.356 20.049 -29.951 1.00 53.22 C ATOM 249 C ILE A 18 12.841 20.232 -29.758 1.00 50.45 C ATOM 250 O ILE A 18 12.227 21.096 -30.387 1.00 54.53 O ATOM 251 CB ILE A 18 15.094 20.746 -28.778 1.00 12.35 C ATOM 252 CG1 ILE A 18 14.863 22.270 -28.817 1.00 3.14 C ATOM 253 CG2 ILE A 18 16.587 20.422 -28.805 1.00 61.24 C ATOM 254 CD1 ILE A 18 15.531 23.025 -27.682 1.00 72.13 C ATOM 0 H ILE A 18 14.418 21.489 -31.484 1.00 63.12 H new ATOM 0 HA ILE A 18 14.603 18.987 -29.943 1.00 53.22 H new ATOM 0 HB ILE A 18 14.683 20.364 -27.844 1.00 12.35 H new ATOM 0 HG12 ILE A 18 15.233 22.659 -29.766 1.00 3.14 H new ATOM 0 HG13 ILE A 18 13.791 22.466 -28.788 1.00 3.14 H new ATOM 0 HG21 ILE A 18 17.083 20.922 -27.973 1.00 61.24 H new ATOM 0 HG22 ILE A 18 16.727 19.345 -28.717 1.00 61.24 H new ATOM 0 HG23 ILE A 18 17.017 20.768 -29.745 1.00 61.24 H new ATOM 0 HD11 ILE A 18 15.321 24.090 -27.780 1.00 72.13 H new ATOM 0 HD12 ILE A 18 15.144 22.666 -26.729 1.00 72.13 H new ATOM 0 HD13 ILE A 18 16.608 22.862 -27.721 1.00 72.13 H new ATOM 266 N VAL A 19 12.241 19.422 -28.887 1.00 43.22 N ATOM 267 CA VAL A 19 10.804 19.522 -28.600 1.00 35.55 C ATOM 268 C VAL A 19 10.522 19.328 -27.098 1.00 31.13 C ATOM 269 O VAL A 19 11.151 18.499 -26.438 1.00 72.11 O ATOM 270 CB VAL A 19 9.990 18.491 -29.426 1.00 60.52 C ATOM 271 CG1 VAL A 19 10.344 17.061 -29.024 1.00 62.02 C ATOM 272 CG2 VAL A 19 8.488 18.747 -29.292 1.00 44.43 C ATOM 0 H VAL A 19 12.723 18.689 -28.367 1.00 43.22 H new ATOM 0 HA VAL A 19 10.488 20.524 -28.889 1.00 35.55 H new ATOM 0 HB VAL A 19 10.258 18.615 -30.475 1.00 60.52 H new ATOM 0 HG11 VAL A 19 9.758 16.360 -29.619 1.00 62.02 H new ATOM 0 HG12 VAL A 19 11.406 16.886 -29.198 1.00 62.02 H new ATOM 0 HG13 VAL A 19 10.121 16.914 -27.967 1.00 62.02 H new ATOM 0 HG21 VAL A 19 7.940 18.011 -29.880 1.00 44.43 H new ATOM 0 HG22 VAL A 19 8.197 18.665 -28.245 1.00 44.43 H new ATOM 0 HG23 VAL A 19 8.256 19.748 -29.655 1.00 44.43 H new ATOM 282 N GLY A 20 9.575 20.098 -26.560 1.00 74.31 N ATOM 283 CA GLY A 20 9.281 20.041 -25.129 1.00 62.50 C ATOM 284 C GLY A 20 7.815 19.760 -24.809 1.00 72.34 C ATOM 285 O GLY A 20 6.992 20.677 -24.785 1.00 13.13 O ATOM 0 H GLY A 20 9.005 20.760 -27.086 1.00 74.31 H new ATOM 0 HA2 GLY A 20 9.897 19.267 -24.672 1.00 62.50 H new ATOM 0 HA3 GLY A 20 9.568 20.988 -24.671 1.00 62.50 H new ATOM 289 N LEU A 21 7.488 18.494 -24.560 1.00 41.33 N ATOM 290 CA LEU A 21 6.130 18.106 -24.154 1.00 60.32 C ATOM 291 C LEU A 21 5.932 18.298 -22.638 1.00 73.12 C ATOM 292 O LEU A 21 6.214 17.397 -21.844 1.00 15.35 O ATOM 293 CB LEU A 21 5.841 16.641 -24.533 1.00 15.24 C ATOM 294 CG LEU A 21 5.684 16.345 -26.040 1.00 64.31 C ATOM 295 CD1 LEU A 21 6.981 16.597 -26.805 1.00 12.03 C ATOM 296 CD2 LEU A 21 5.210 14.907 -26.250 1.00 23.21 C ATOM 0 H LEU A 21 8.143 17.715 -24.631 1.00 41.33 H new ATOM 0 HA LEU A 21 5.431 18.752 -24.685 1.00 60.32 H new ATOM 0 HB2 LEU A 21 6.649 16.021 -24.144 1.00 15.24 H new ATOM 0 HB3 LEU A 21 4.928 16.330 -24.026 1.00 15.24 H new ATOM 0 HG LEU A 21 4.933 17.029 -26.436 1.00 64.31 H new ATOM 0 HD11 LEU A 21 6.829 16.377 -27.862 1.00 12.03 H new ATOM 0 HD12 LEU A 21 7.274 17.640 -26.690 1.00 12.03 H new ATOM 0 HD13 LEU A 21 7.767 15.954 -26.410 1.00 12.03 H new ATOM 0 HD21 LEU A 21 5.103 14.711 -27.317 1.00 23.21 H new ATOM 0 HD22 LEU A 21 5.940 14.218 -25.826 1.00 23.21 H new ATOM 0 HD23 LEU A 21 4.248 14.765 -25.757 1.00 23.21 H new ATOM 308 N ASP A 22 5.460 19.480 -22.239 1.00 63.33 N ATOM 309 CA ASP A 22 5.279 19.801 -20.816 1.00 52.44 C ATOM 310 C ASP A 22 3.962 19.218 -20.268 1.00 74.02 C ATOM 311 O ASP A 22 2.870 19.627 -20.668 1.00 71.11 O ATOM 312 CB ASP A 22 5.312 21.323 -20.614 1.00 40.03 C ATOM 313 CG ASP A 22 5.355 21.723 -19.143 1.00 1.14 C ATOM 314 OD1 ASP A 22 6.467 21.817 -18.582 1.00 33.21 O ATOM 315 OD2 ASP A 22 4.276 21.944 -18.544 1.00 15.50 O ATOM 0 H ASP A 22 5.196 20.231 -22.876 1.00 63.33 H new ATOM 0 HA ASP A 22 6.099 19.346 -20.261 1.00 52.44 H new ATOM 0 HB2 ASP A 22 6.184 21.734 -21.123 1.00 40.03 H new ATOM 0 HB3 ASP A 22 4.432 21.766 -21.081 1.00 40.03 H new ATOM 320 N HIS A 23 4.076 18.248 -19.362 1.00 63.44 N ATOM 321 CA HIS A 23 2.908 17.632 -18.718 1.00 4.11 C ATOM 322 C HIS A 23 3.206 17.303 -17.244 1.00 24.23 C ATOM 323 O HIS A 23 4.342 17.443 -16.784 1.00 54.24 O ATOM 324 CB HIS A 23 2.493 16.352 -19.459 1.00 53.13 C ATOM 325 CG HIS A 23 2.067 16.575 -20.883 1.00 1.51 C ATOM 326 ND1 HIS A 23 0.787 16.941 -21.237 1.00 33.53 N ATOM 327 CD2 HIS A 23 2.756 16.473 -22.047 1.00 41.45 C ATOM 328 CE1 HIS A 23 0.707 17.055 -22.548 1.00 43.52 C ATOM 329 NE2 HIS A 23 1.885 16.777 -23.063 1.00 64.41 N ATOM 0 H HIS A 23 4.970 17.867 -19.053 1.00 63.44 H new ATOM 0 HA HIS A 23 2.088 18.349 -18.760 1.00 4.11 H new ATOM 0 HB2 HIS A 23 3.328 15.652 -19.447 1.00 53.13 H new ATOM 0 HB3 HIS A 23 1.674 15.881 -18.916 1.00 53.13 H new ATOM 0 HD2 HIS A 23 3.796 16.203 -22.154 1.00 41.45 H new ATOM 0 HE1 HIS A 23 -0.176 17.330 -23.105 1.00 43.52 H new ATOM 0 HE2 HIS A 23 2.114 16.786 -24.057 1.00 64.41 H new ATOM 338 N GLY A 24 2.183 16.870 -16.509 1.00 65.45 N ATOM 339 CA GLY A 24 2.373 16.480 -15.114 1.00 55.42 C ATOM 340 C GLY A 24 1.722 17.439 -14.118 1.00 11.21 C ATOM 341 O GLY A 24 2.119 18.600 -14.007 1.00 73.02 O ATOM 0 H GLY A 24 1.226 16.781 -16.851 1.00 65.45 H new ATOM 0 HA2 GLY A 24 1.963 15.481 -14.965 1.00 55.42 H new ATOM 0 HA3 GLY A 24 3.441 16.421 -14.904 1.00 55.42 H new ATOM 345 N ASN A 25 0.722 16.947 -13.390 1.00 73.24 N ATOM 346 CA ASN A 25 0.044 17.730 -12.349 1.00 51.51 C ATOM 347 C ASN A 25 0.367 17.181 -10.945 1.00 5.23 C ATOM 348 O ASN A 25 1.326 16.425 -10.768 1.00 1.12 O ATOM 349 CB ASN A 25 -1.472 17.719 -12.590 1.00 21.54 C ATOM 350 CG ASN A 25 -2.053 16.314 -12.648 1.00 61.13 C ATOM 351 OD1 ASN A 25 -1.403 15.373 -13.092 1.00 60.44 O ATOM 352 ND2 ASN A 25 -3.281 16.160 -12.203 1.00 12.04 N ATOM 0 H ASN A 25 0.358 16.001 -13.501 1.00 73.24 H new ATOM 0 HA ASN A 25 0.406 18.757 -12.400 1.00 51.51 H new ATOM 0 HB2 ASN A 25 -1.965 18.278 -11.795 1.00 21.54 H new ATOM 0 HB3 ASN A 25 -1.690 18.235 -13.525 1.00 21.54 H new ATOM 0 HD21 ASN A 25 -3.718 15.239 -12.221 1.00 12.04 H new ATOM 0 HD22 ASN A 25 -3.796 16.962 -11.840 1.00 12.04 H new ATOM 359 N GLU A 26 -0.412 17.591 -9.944 1.00 34.20 N ATOM 360 CA GLU A 26 -0.259 17.077 -8.578 1.00 31.01 C ATOM 361 C GLU A 26 -1.596 17.096 -7.822 1.00 5.21 C ATOM 362 O GLU A 26 -2.619 17.530 -8.353 1.00 13.05 O ATOM 363 CB GLU A 26 0.790 17.895 -7.798 1.00 33.23 C ATOM 364 CG GLU A 26 0.375 19.334 -7.471 1.00 34.24 C ATOM 365 CD GLU A 26 0.279 20.237 -8.692 1.00 62.54 C ATOM 366 OE1 GLU A 26 -0.809 20.314 -9.300 1.00 70.55 O ATOM 367 OE2 GLU A 26 1.290 20.880 -9.044 1.00 4.10 O ATOM 0 H GLU A 26 -1.157 18.279 -10.051 1.00 34.20 H new ATOM 0 HA GLU A 26 0.081 16.044 -8.656 1.00 31.01 H new ATOM 0 HB2 GLU A 26 1.014 17.376 -6.866 1.00 33.23 H new ATOM 0 HB3 GLU A 26 1.713 17.921 -8.378 1.00 33.23 H new ATOM 0 HG2 GLU A 26 -0.591 19.318 -6.965 1.00 34.24 H new ATOM 0 HG3 GLU A 26 1.094 19.760 -6.771 1.00 34.24 H new ATOM 374 N ALA A 27 -1.576 16.619 -6.581 1.00 33.24 N ATOM 375 CA ALA A 27 -2.758 16.649 -5.715 1.00 21.41 C ATOM 376 C ALA A 27 -2.631 17.753 -4.656 1.00 64.43 C ATOM 377 O ALA A 27 -1.641 18.484 -4.620 1.00 4.33 O ATOM 378 CB ALA A 27 -2.951 15.292 -5.049 1.00 51.04 C ATOM 0 H ALA A 27 -0.751 16.204 -6.148 1.00 33.24 H new ATOM 0 HA ALA A 27 -3.631 16.869 -6.329 1.00 21.41 H new ATOM 0 HB1 ALA A 27 -3.832 15.324 -4.407 1.00 51.04 H new ATOM 0 HB2 ALA A 27 -3.087 14.527 -5.814 1.00 51.04 H new ATOM 0 HB3 ALA A 27 -2.073 15.053 -4.449 1.00 51.04 H new ATOM 384 N ASP A 28 -3.633 17.869 -3.789 1.00 73.41 N ATOM 385 CA ASP A 28 -3.612 18.868 -2.711 1.00 52.42 C ATOM 386 C ASP A 28 -2.779 18.389 -1.505 1.00 1.12 C ATOM 387 O ASP A 28 -2.583 19.132 -0.538 1.00 22.15 O ATOM 388 CB ASP A 28 -5.043 19.178 -2.267 1.00 40.30 C ATOM 389 CG ASP A 28 -5.907 19.661 -3.419 1.00 60.25 C ATOM 390 OD1 ASP A 28 -5.944 20.884 -3.673 1.00 41.42 O ATOM 391 OD2 ASP A 28 -6.553 18.819 -4.078 1.00 43.14 O ATOM 0 H ASP A 28 -4.471 17.287 -3.807 1.00 73.41 H new ATOM 0 HA ASP A 28 -3.142 19.772 -3.100 1.00 52.42 H new ATOM 0 HB2 ASP A 28 -5.488 18.284 -1.831 1.00 40.30 H new ATOM 0 HB3 ASP A 28 -5.023 19.938 -1.486 1.00 40.30 H new ATOM 396 N ALA A 29 -2.285 17.156 -1.578 1.00 31.03 N ATOM 397 CA ALA A 29 -1.505 16.556 -0.491 1.00 62.23 C ATOM 398 C ALA A 29 -0.065 17.096 -0.440 1.00 51.51 C ATOM 399 O ALA A 29 0.756 16.799 -1.311 1.00 61.15 O ATOM 400 CB ALA A 29 -1.495 15.039 -0.638 1.00 65.14 C ATOM 0 H ALA A 29 -2.411 16.545 -2.385 1.00 31.03 H new ATOM 0 HA ALA A 29 -1.984 16.831 0.449 1.00 62.23 H new ATOM 0 HB1 ALA A 29 -0.914 14.599 0.172 1.00 65.14 H new ATOM 0 HB2 ALA A 29 -2.517 14.663 -0.598 1.00 65.14 H new ATOM 0 HB3 ALA A 29 -1.047 14.769 -1.594 1.00 65.14 H new ATOM 406 N ALA A 30 0.228 17.890 0.589 1.00 31.31 N ATOM 407 CA ALA A 30 1.568 18.455 0.793 1.00 4.01 C ATOM 408 C ALA A 30 1.859 18.677 2.287 1.00 50.11 C ATOM 409 O ALA A 30 0.954 18.606 3.124 1.00 55.32 O ATOM 410 CB ALA A 30 1.714 19.763 0.019 1.00 32.11 C ATOM 0 H ALA A 30 -0.449 18.160 1.302 1.00 31.31 H new ATOM 0 HA ALA A 30 2.297 17.739 0.415 1.00 4.01 H new ATOM 0 HB1 ALA A 30 2.712 20.171 0.179 1.00 32.11 H new ATOM 0 HB2 ALA A 30 1.565 19.575 -1.044 1.00 32.11 H new ATOM 0 HB3 ALA A 30 0.969 20.478 0.369 1.00 32.11 H new ATOM 416 N GLU A 31 3.121 18.955 2.620 1.00 74.53 N ATOM 417 CA GLU A 31 3.528 19.163 4.018 1.00 2.21 C ATOM 418 C GLU A 31 4.382 20.434 4.181 1.00 74.44 C ATOM 419 O GLU A 31 5.211 20.754 3.329 1.00 61.33 O ATOM 420 CB GLU A 31 4.294 17.930 4.535 1.00 73.02 C ATOM 421 CG GLU A 31 4.736 18.045 5.990 1.00 32.55 C ATOM 422 CD GLU A 31 5.343 16.757 6.527 1.00 3.14 C ATOM 423 OE1 GLU A 31 6.561 16.551 6.356 1.00 33.11 O ATOM 424 OE2 GLU A 31 4.605 15.955 7.141 1.00 40.23 O ATOM 0 H GLU A 31 3.880 19.042 1.945 1.00 74.53 H new ATOM 0 HA GLU A 31 2.624 19.299 4.612 1.00 2.21 H new ATOM 0 HB2 GLU A 31 3.662 17.049 4.426 1.00 73.02 H new ATOM 0 HB3 GLU A 31 5.173 17.771 3.910 1.00 73.02 H new ATOM 0 HG2 GLU A 31 5.465 18.850 6.081 1.00 32.55 H new ATOM 0 HG3 GLU A 31 3.879 18.321 6.604 1.00 32.55 H new ATOM 431 N GLN A 32 4.173 21.152 5.287 1.00 53.24 N ATOM 432 CA GLN A 32 4.902 22.396 5.560 1.00 32.43 C ATOM 433 C GLN A 32 6.369 22.120 5.941 1.00 70.54 C ATOM 434 O GLN A 32 6.715 22.042 7.124 1.00 31.51 O ATOM 435 CB GLN A 32 4.198 23.185 6.677 1.00 50.32 C ATOM 436 CG GLN A 32 2.791 23.655 6.305 1.00 51.15 C ATOM 437 CD GLN A 32 2.067 24.365 7.444 1.00 11.32 C ATOM 438 OE1 GLN A 32 2.686 24.985 8.305 1.00 70.31 O ATOM 439 NE2 GLN A 32 0.747 24.286 7.452 1.00 21.41 N ATOM 0 H GLN A 32 3.503 20.893 6.011 1.00 53.24 H new ATOM 0 HA GLN A 32 4.905 22.992 4.647 1.00 32.43 H new ATOM 0 HB2 GLN A 32 4.139 22.561 7.569 1.00 50.32 H new ATOM 0 HB3 GLN A 32 4.805 24.053 6.935 1.00 50.32 H new ATOM 0 HG2 GLN A 32 2.855 24.328 5.450 1.00 51.15 H new ATOM 0 HG3 GLN A 32 2.200 22.795 5.990 1.00 51.15 H new ATOM 0 HE21 GLN A 32 0.263 23.763 6.722 1.00 21.41 H new ATOM 0 HE22 GLN A 32 0.213 24.748 8.188 1.00 21.41 H new ATOM 448 N THR A 33 7.219 21.954 4.929 1.00 55.41 N ATOM 449 CA THR A 33 8.654 21.691 5.135 1.00 43.33 C ATOM 450 C THR A 33 9.427 21.766 3.811 1.00 14.44 C ATOM 451 O THR A 33 8.831 21.887 2.741 1.00 35.32 O ATOM 452 CB THR A 33 8.901 20.297 5.777 1.00 61.31 C ATOM 453 OG1 THR A 33 10.306 20.082 6.005 1.00 31.35 O ATOM 454 CG2 THR A 33 8.354 19.177 4.897 1.00 11.13 C ATOM 0 H THR A 33 6.942 21.996 3.948 1.00 55.41 H new ATOM 0 HA THR A 33 9.013 22.463 5.815 1.00 43.33 H new ATOM 0 HB THR A 33 8.375 20.282 6.731 1.00 61.31 H new ATOM 0 HG1 THR A 33 10.440 19.200 6.411 1.00 31.35 H new ATOM 0 HG21 THR A 33 8.542 18.215 5.374 1.00 11.13 H new ATOM 0 HG22 THR A 33 7.281 19.311 4.762 1.00 11.13 H new ATOM 0 HG23 THR A 33 8.848 19.204 3.926 1.00 11.13 H new ATOM 462 N GLN A 34 10.754 21.702 3.891 1.00 23.15 N ATOM 463 CA GLN A 34 11.609 21.683 2.695 1.00 60.34 C ATOM 464 C GLN A 34 12.266 20.306 2.498 1.00 31.54 C ATOM 465 O GLN A 34 13.305 20.014 3.098 1.00 10.23 O ATOM 466 CB GLN A 34 12.695 22.767 2.790 1.00 44.11 C ATOM 467 CG GLN A 34 12.148 24.192 2.811 1.00 73.14 C ATOM 468 CD GLN A 34 13.239 25.242 2.952 1.00 43.24 C ATOM 469 OE1 GLN A 34 14.373 25.046 2.523 1.00 71.43 O ATOM 470 NE2 GLN A 34 12.909 26.361 3.562 1.00 10.31 N ATOM 0 H GLN A 34 11.267 21.662 4.772 1.00 23.15 H new ATOM 0 HA GLN A 34 10.973 21.887 1.834 1.00 60.34 H new ATOM 0 HB2 GLN A 34 13.282 22.601 3.693 1.00 44.11 H new ATOM 0 HB3 GLN A 34 13.374 22.662 1.944 1.00 44.11 H new ATOM 0 HG2 GLN A 34 11.591 24.375 1.892 1.00 73.14 H new ATOM 0 HG3 GLN A 34 11.444 24.294 3.637 1.00 73.14 H new ATOM 0 HE21 GLN A 34 11.958 26.493 3.907 1.00 10.31 H new ATOM 0 HE22 GLN A 34 13.604 27.096 3.690 1.00 10.31 H new ATOM 479 N PRO A 35 11.652 19.426 1.681 1.00 61.14 N ATOM 480 CA PRO A 35 12.231 18.109 1.349 1.00 32.24 C ATOM 481 C PRO A 35 13.539 18.228 0.546 1.00 60.23 C ATOM 482 O PRO A 35 13.690 19.132 -0.281 1.00 41.25 O ATOM 483 CB PRO A 35 11.134 17.435 0.501 1.00 70.52 C ATOM 484 CG PRO A 35 9.890 18.211 0.788 1.00 53.01 C ATOM 485 CD PRO A 35 10.342 19.621 1.035 1.00 71.43 C ATOM 0 HA PRO A 35 12.499 17.547 2.244 1.00 32.24 H new ATOM 0 HB2 PRO A 35 11.382 17.465 -0.560 1.00 70.52 H new ATOM 0 HB3 PRO A 35 11.015 16.386 0.771 1.00 70.52 H new ATOM 0 HG2 PRO A 35 9.196 18.163 -0.051 1.00 53.01 H new ATOM 0 HG3 PRO A 35 9.369 17.809 1.657 1.00 53.01 H new ATOM 0 HD2 PRO A 35 10.427 20.188 0.108 1.00 71.43 H new ATOM 0 HD3 PRO A 35 9.649 20.163 1.678 1.00 71.43 H new ATOM 493 N THR A 36 14.474 17.307 0.779 1.00 0.44 N ATOM 494 CA THR A 36 15.790 17.353 0.120 1.00 14.11 C ATOM 495 C THR A 36 15.684 17.203 -1.407 1.00 24.00 C ATOM 496 O THR A 36 15.376 16.129 -1.930 1.00 74.41 O ATOM 497 CB THR A 36 16.756 16.274 0.673 1.00 3.13 C ATOM 498 OG1 THR A 36 17.987 16.294 -0.064 1.00 55.55 O ATOM 499 CG2 THR A 36 16.142 14.878 0.610 1.00 14.11 C ATOM 0 H THR A 36 14.350 16.520 1.416 1.00 0.44 H new ATOM 0 HA THR A 36 16.196 18.339 0.345 1.00 14.11 H new ATOM 0 HB THR A 36 16.948 16.509 1.720 1.00 3.13 H new ATOM 0 HG1 THR A 36 18.552 17.025 0.263 1.00 55.55 H new ATOM 0 HG21 THR A 36 16.850 14.151 1.007 1.00 14.11 H new ATOM 0 HG22 THR A 36 15.228 14.855 1.204 1.00 14.11 H new ATOM 0 HG23 THR A 36 15.908 14.630 -0.425 1.00 14.11 H new ATOM 507 N ASN A 37 15.937 18.294 -2.122 1.00 64.21 N ATOM 508 CA ASN A 37 15.884 18.290 -3.585 1.00 70.32 C ATOM 509 C ASN A 37 17.221 17.823 -4.183 1.00 14.43 C ATOM 510 O ASN A 37 17.958 18.607 -4.784 1.00 14.21 O ATOM 511 CB ASN A 37 15.525 19.688 -4.104 1.00 45.35 C ATOM 512 CG ASN A 37 14.240 20.219 -3.496 1.00 51.30 C ATOM 513 OD1 ASN A 37 13.148 19.992 -4.009 1.00 31.14 O ATOM 514 ND2 ASN A 37 14.357 20.933 -2.398 1.00 14.51 N ATOM 0 H ASN A 37 16.182 19.196 -1.714 1.00 64.21 H new ATOM 0 HA ASN A 37 15.111 17.588 -3.898 1.00 70.32 H new ATOM 0 HB2 ASN A 37 16.341 20.376 -3.881 1.00 45.35 H new ATOM 0 HB3 ASN A 37 15.424 19.655 -5.189 1.00 45.35 H new ATOM 0 HD21 ASN A 37 13.526 21.316 -1.948 1.00 14.51 H new ATOM 0 HD22 ASN A 37 15.279 21.104 -1.996 1.00 14.51 H new ATOM 521 N GLN A 38 17.538 16.543 -3.994 1.00 32.12 N ATOM 522 CA GLN A 38 18.777 15.964 -4.529 1.00 74.31 C ATOM 523 C GLN A 38 18.774 15.960 -6.065 1.00 4.41 C ATOM 524 O GLN A 38 19.593 16.626 -6.703 1.00 12.44 O ATOM 525 CB GLN A 38 18.972 14.532 -3.998 1.00 33.23 C ATOM 526 CG GLN A 38 19.163 14.444 -2.485 1.00 44.32 C ATOM 527 CD GLN A 38 20.372 15.227 -1.995 1.00 54.22 C ATOM 528 OE1 GLN A 38 20.163 16.465 -1.595 1.00 13.33 O flip ATOM 529 NE2 GLN A 38 21.484 14.712 -1.955 1.00 21.15 N flip ATOM 0 H GLN A 38 16.957 15.885 -3.475 1.00 32.12 H new ATOM 0 HA GLN A 38 19.607 16.586 -4.193 1.00 74.31 H new ATOM 0 HB2 GLN A 38 18.107 13.932 -4.279 1.00 33.23 H new ATOM 0 HB3 GLN A 38 19.839 14.090 -4.488 1.00 33.23 H new ATOM 0 HG2 GLN A 38 18.268 14.819 -1.988 1.00 44.32 H new ATOM 0 HG3 GLN A 38 19.273 13.398 -2.198 1.00 44.32 H new ATOM 0 HE21 GLN A 38 21.613 13.751 -2.272 1.00 21.15 H new ATOM 0 HE22 GLN A 38 22.280 15.244 -1.605 1.00 21.15 H new ATOM 538 N SER A 39 17.846 15.215 -6.650 1.00 23.23 N ATOM 539 CA SER A 39 17.730 15.125 -8.111 1.00 52.24 C ATOM 540 C SER A 39 16.826 16.234 -8.666 1.00 11.12 C ATOM 541 O SER A 39 15.746 16.484 -8.135 1.00 61.12 O ATOM 542 CB SER A 39 17.168 13.756 -8.515 1.00 14.21 C ATOM 543 OG SER A 39 17.997 12.701 -8.054 1.00 31.43 O ATOM 0 H SER A 39 17.158 14.661 -6.140 1.00 23.23 H new ATOM 0 HA SER A 39 18.728 15.249 -8.532 1.00 52.24 H new ATOM 0 HB2 SER A 39 16.164 13.638 -8.106 1.00 14.21 H new ATOM 0 HB3 SER A 39 17.079 13.703 -9.600 1.00 14.21 H new ATOM 0 HG SER A 39 17.613 11.841 -8.325 1.00 31.43 H new ATOM 549 N THR A 40 17.259 16.876 -9.750 1.00 0.35 N ATOM 550 CA THR A 40 16.479 17.952 -10.392 1.00 53.21 C ATOM 551 C THR A 40 15.372 17.399 -11.308 1.00 21.30 C ATOM 552 O THR A 40 14.959 18.050 -12.269 1.00 33.00 O ATOM 553 CB THR A 40 17.392 18.887 -11.224 1.00 21.43 C ATOM 554 OG1 THR A 40 18.140 18.125 -12.188 1.00 51.21 O ATOM 555 CG2 THR A 40 18.352 19.657 -10.326 1.00 50.12 C ATOM 0 H THR A 40 18.147 16.674 -10.209 1.00 0.35 H new ATOM 0 HA THR A 40 16.016 18.515 -9.582 1.00 53.21 H new ATOM 0 HB THR A 40 16.754 19.602 -11.744 1.00 21.43 H new ATOM 0 HG1 THR A 40 18.712 18.727 -12.709 1.00 51.21 H new ATOM 0 HG21 THR A 40 18.981 20.305 -10.937 1.00 50.12 H new ATOM 0 HG22 THR A 40 17.783 20.263 -9.620 1.00 50.12 H new ATOM 0 HG23 THR A 40 18.980 18.955 -9.778 1.00 50.12 H new ATOM 563 N THR A 41 14.887 16.200 -10.995 1.00 72.43 N ATOM 564 CA THR A 41 13.817 15.554 -11.766 1.00 30.51 C ATOM 565 C THR A 41 13.006 14.604 -10.880 1.00 30.13 C ATOM 566 O THR A 41 13.532 13.612 -10.374 1.00 23.53 O ATOM 567 CB THR A 41 14.375 14.764 -12.983 1.00 63.43 C ATOM 568 OG1 THR A 41 14.952 15.673 -13.940 1.00 42.03 O ATOM 569 CG2 THR A 41 13.286 13.935 -13.661 1.00 43.02 C ATOM 0 H THR A 41 15.220 15.648 -10.205 1.00 72.43 H new ATOM 0 HA THR A 41 13.172 16.350 -12.137 1.00 30.51 H new ATOM 0 HB THR A 41 15.141 14.083 -12.612 1.00 63.43 H new ATOM 0 HG1 THR A 41 14.902 16.588 -13.593 1.00 42.03 H new ATOM 0 HG21 THR A 41 13.713 13.396 -14.507 1.00 43.02 H new ATOM 0 HG22 THR A 41 12.874 13.222 -12.947 1.00 43.02 H new ATOM 0 HG23 THR A 41 12.493 14.595 -14.013 1.00 43.02 H new ATOM 577 N GLN A 42 11.728 14.921 -10.683 1.00 34.24 N ATOM 578 CA GLN A 42 10.824 14.075 -9.888 1.00 12.03 C ATOM 579 C GLN A 42 9.814 13.326 -10.778 1.00 42.23 C ATOM 580 O GLN A 42 9.828 13.458 -12.006 1.00 23.24 O ATOM 581 CB GLN A 42 10.096 14.917 -8.815 1.00 74.31 C ATOM 582 CG GLN A 42 9.705 16.334 -9.248 1.00 43.55 C ATOM 583 CD GLN A 42 8.811 16.375 -10.475 1.00 63.01 C ATOM 584 OE1 GLN A 42 9.282 16.477 -11.605 1.00 4.33 O ATOM 585 NE2 GLN A 42 7.516 16.289 -10.266 1.00 4.04 N ATOM 0 H GLN A 42 11.289 15.760 -11.062 1.00 34.24 H new ATOM 0 HA GLN A 42 11.432 13.323 -9.385 1.00 12.03 H new ATOM 0 HB2 GLN A 42 9.194 14.386 -8.511 1.00 74.31 H new ATOM 0 HB3 GLN A 42 10.737 14.987 -7.936 1.00 74.31 H new ATOM 0 HG2 GLN A 42 9.195 16.829 -8.422 1.00 43.55 H new ATOM 0 HG3 GLN A 42 10.611 16.905 -9.451 1.00 43.55 H new ATOM 0 HE21 GLN A 42 7.157 16.205 -9.315 1.00 4.04 H new ATOM 0 HE22 GLN A 42 6.870 16.306 -11.055 1.00 4.04 H new ATOM 594 N SER A 43 8.940 12.535 -10.153 1.00 1.54 N ATOM 595 CA SER A 43 7.953 11.732 -10.893 1.00 20.31 C ATOM 596 C SER A 43 6.517 12.177 -10.578 1.00 72.44 C ATOM 597 O SER A 43 6.189 12.497 -9.436 1.00 15.32 O ATOM 598 CB SER A 43 8.117 10.237 -10.568 1.00 72.50 C ATOM 599 OG SER A 43 7.808 9.955 -9.212 1.00 64.34 O ATOM 0 H SER A 43 8.892 12.430 -9.140 1.00 1.54 H new ATOM 0 HA SER A 43 8.135 11.890 -11.956 1.00 20.31 H new ATOM 0 HB2 SER A 43 7.468 9.650 -11.218 1.00 72.50 H new ATOM 0 HB3 SER A 43 9.141 9.930 -10.779 1.00 72.50 H new ATOM 0 HG SER A 43 8.637 9.898 -8.693 1.00 64.34 H new ATOM 605 N THR A 44 5.671 12.224 -11.611 1.00 51.25 N ATOM 606 CA THR A 44 4.243 12.560 -11.448 1.00 21.13 C ATOM 607 C THR A 44 3.364 11.662 -12.329 1.00 44.23 C ATOM 608 O THR A 44 2.276 12.056 -12.753 1.00 55.03 O ATOM 609 CB THR A 44 3.948 14.042 -11.806 1.00 4.23 C ATOM 610 OG1 THR A 44 4.380 14.331 -13.146 1.00 40.32 O ATOM 611 CG2 THR A 44 4.629 14.999 -10.831 1.00 75.34 C ATOM 0 H THR A 44 5.946 12.034 -12.575 1.00 51.25 H new ATOM 0 HA THR A 44 4.008 12.397 -10.396 1.00 21.13 H new ATOM 0 HB THR A 44 2.870 14.187 -11.733 1.00 4.23 H new ATOM 0 HG1 THR A 44 4.488 15.299 -13.253 1.00 40.32 H new ATOM 0 HG21 THR A 44 4.401 16.027 -11.112 1.00 75.34 H new ATOM 0 HG22 THR A 44 4.265 14.809 -9.821 1.00 75.34 H new ATOM 0 HG23 THR A 44 5.708 14.845 -10.863 1.00 75.34 H new ATOM 619 N SER A 45 3.833 10.445 -12.583 1.00 3.33 N ATOM 620 CA SER A 45 3.127 9.512 -13.468 1.00 50.15 C ATOM 621 C SER A 45 2.001 8.780 -12.726 1.00 52.10 C ATOM 622 O SER A 45 2.150 7.622 -12.328 1.00 20.20 O ATOM 623 CB SER A 45 4.109 8.495 -14.073 1.00 40.11 C ATOM 624 OG SER A 45 5.168 9.146 -14.763 1.00 3.33 O ATOM 0 H SER A 45 4.699 10.077 -12.190 1.00 3.33 H new ATOM 0 HA SER A 45 2.679 10.095 -14.273 1.00 50.15 H new ATOM 0 HB2 SER A 45 4.519 7.868 -13.282 1.00 40.11 H new ATOM 0 HB3 SER A 45 3.577 7.836 -14.759 1.00 40.11 H new ATOM 0 HG SER A 45 5.777 8.475 -15.135 1.00 3.33 H new ATOM 630 N GLY A 46 0.882 9.472 -12.528 1.00 1.31 N ATOM 631 CA GLY A 46 -0.264 8.881 -11.842 1.00 12.34 C ATOM 632 C GLY A 46 -1.486 8.739 -12.745 1.00 14.24 C ATOM 633 O GLY A 46 -2.106 9.734 -13.126 1.00 54.11 O ATOM 0 H GLY A 46 0.744 10.436 -12.831 1.00 1.31 H new ATOM 0 HA2 GLY A 46 0.015 7.899 -11.459 1.00 12.34 H new ATOM 0 HA3 GLY A 46 -0.524 9.497 -10.981 1.00 12.34 H new ATOM 637 N SER A 47 -1.825 7.502 -13.100 1.00 31.10 N ATOM 638 CA SER A 47 -3.006 7.226 -13.925 1.00 63.45 C ATOM 639 C SER A 47 -4.283 7.227 -13.071 1.00 53.44 C ATOM 640 O SER A 47 -4.561 6.274 -12.344 1.00 41.41 O ATOM 641 CB SER A 47 -2.850 5.882 -14.660 1.00 15.32 C ATOM 642 OG SER A 47 -2.477 4.833 -13.774 1.00 43.34 O ATOM 0 H SER A 47 -1.299 6.671 -12.830 1.00 31.10 H new ATOM 0 HA SER A 47 -3.093 8.019 -14.668 1.00 63.45 H new ATOM 0 HB2 SER A 47 -3.789 5.626 -15.151 1.00 15.32 H new ATOM 0 HB3 SER A 47 -2.098 5.981 -15.442 1.00 15.32 H new ATOM 0 HG SER A 47 -3.283 4.417 -13.402 1.00 43.34 H new ATOM 648 N SER A 48 -5.053 8.313 -13.158 1.00 14.45 N ATOM 649 CA SER A 48 -6.272 8.480 -12.347 1.00 32.11 C ATOM 650 C SER A 48 -7.423 7.602 -12.848 1.00 74.11 C ATOM 651 O SER A 48 -8.285 7.188 -12.071 1.00 60.45 O ATOM 652 CB SER A 48 -6.710 9.951 -12.345 1.00 74.42 C ATOM 653 OG SER A 48 -5.655 10.806 -11.917 1.00 63.43 O ATOM 0 H SER A 48 -4.858 9.095 -13.783 1.00 14.45 H new ATOM 0 HA SER A 48 -6.029 8.165 -11.332 1.00 32.11 H new ATOM 0 HB2 SER A 48 -7.030 10.238 -13.347 1.00 74.42 H new ATOM 0 HB3 SER A 48 -7.571 10.075 -11.688 1.00 74.42 H new ATOM 0 HG SER A 48 -5.963 11.736 -11.928 1.00 63.43 H new ATOM 659 N ALA A 49 -7.445 7.336 -14.151 1.00 3.13 N ATOM 660 CA ALA A 49 -8.463 6.460 -14.744 1.00 52.03 C ATOM 661 C ALA A 49 -8.188 4.980 -14.427 1.00 33.11 C ATOM 662 O ALA A 49 -7.072 4.609 -14.074 1.00 31.14 O ATOM 663 CB ALA A 49 -8.528 6.684 -16.251 1.00 64.45 C ATOM 0 H ALA A 49 -6.772 7.712 -14.819 1.00 3.13 H new ATOM 0 HA ALA A 49 -9.427 6.714 -14.304 1.00 52.03 H new ATOM 0 HB1 ALA A 49 -9.286 6.030 -16.684 1.00 64.45 H new ATOM 0 HB2 ALA A 49 -8.787 7.723 -16.454 1.00 64.45 H new ATOM 0 HB3 ALA A 49 -7.558 6.459 -16.695 1.00 64.45 H new ATOM 669 N ASN A 50 -9.203 4.132 -14.558 1.00 43.24 N ATOM 670 CA ASN A 50 -9.059 2.707 -14.235 1.00 11.31 C ATOM 671 C ASN A 50 -8.535 1.900 -15.437 1.00 72.51 C ATOM 672 O ASN A 50 -9.277 1.618 -16.379 1.00 15.12 O ATOM 673 CB ASN A 50 -10.403 2.132 -13.768 1.00 62.32 C ATOM 674 CG ASN A 50 -10.311 0.675 -13.340 1.00 73.51 C ATOM 675 OD1 ASN A 50 -11.237 -0.102 -13.543 1.00 61.40 O ATOM 676 ND2 ASN A 50 -9.215 0.297 -12.708 1.00 22.02 N ATOM 0 H ASN A 50 -10.132 4.400 -14.883 1.00 43.24 H new ATOM 0 HA ASN A 50 -8.328 2.624 -13.431 1.00 11.31 H new ATOM 0 HB2 ASN A 50 -10.776 2.727 -12.934 1.00 62.32 H new ATOM 0 HB3 ASN A 50 -11.130 2.223 -14.575 1.00 62.32 H new ATOM 0 HD21 ASN A 50 -9.124 -0.663 -12.375 1.00 22.02 H new ATOM 0 HD22 ASN A 50 -8.460 0.965 -12.553 1.00 22.02 H new ATOM 683 N LEU A 51 -7.249 1.541 -15.403 1.00 54.43 N ATOM 684 CA LEU A 51 -6.649 0.693 -16.447 1.00 52.43 C ATOM 685 C LEU A 51 -6.560 -0.781 -16.001 1.00 63.13 C ATOM 686 O LEU A 51 -6.086 -1.634 -16.750 1.00 52.32 O ATOM 687 CB LEU A 51 -5.236 1.191 -16.817 1.00 73.33 C ATOM 688 CG LEU A 51 -5.140 2.560 -17.525 1.00 43.25 C ATOM 689 CD1 LEU A 51 -6.015 2.596 -18.771 1.00 72.30 C ATOM 690 CD2 LEU A 51 -5.495 3.704 -16.579 1.00 51.32 C ATOM 0 H LEU A 51 -6.601 1.822 -14.667 1.00 54.43 H new ATOM 0 HA LEU A 51 -7.300 0.759 -17.319 1.00 52.43 H new ATOM 0 HB2 LEU A 51 -4.644 1.239 -15.903 1.00 73.33 H new ATOM 0 HB3 LEU A 51 -4.770 0.444 -17.459 1.00 73.33 H new ATOM 0 HG LEU A 51 -4.104 2.695 -17.835 1.00 43.25 H new ATOM 0 HD11 LEU A 51 -5.928 3.572 -19.249 1.00 72.30 H new ATOM 0 HD12 LEU A 51 -5.691 1.821 -19.466 1.00 72.30 H new ATOM 0 HD13 LEU A 51 -7.054 2.421 -18.491 1.00 72.30 H new ATOM 0 HD21 LEU A 51 -5.417 4.653 -17.110 1.00 51.32 H new ATOM 0 HD22 LEU A 51 -6.515 3.574 -16.217 1.00 51.32 H new ATOM 0 HD23 LEU A 51 -4.807 3.704 -15.734 1.00 51.32 H new ATOM 702 N TYR A 52 -7.026 -1.081 -14.788 1.00 55.23 N ATOM 703 CA TYR A 52 -6.862 -2.426 -14.205 1.00 52.31 C ATOM 704 C TYR A 52 -8.222 -3.135 -14.019 1.00 64.20 C ATOM 705 O TYR A 52 -9.269 -2.484 -13.993 1.00 13.32 O ATOM 706 CB TYR A 52 -6.128 -2.312 -12.857 1.00 51.45 C ATOM 707 CG TYR A 52 -5.257 -3.512 -12.521 1.00 30.22 C ATOM 708 CD1 TYR A 52 -5.772 -4.616 -11.850 1.00 12.03 C ATOM 709 CD2 TYR A 52 -3.912 -3.537 -12.884 1.00 51.44 C ATOM 710 CE1 TYR A 52 -4.975 -5.703 -11.546 1.00 53.13 C ATOM 711 CE2 TYR A 52 -3.109 -4.621 -12.583 1.00 43.33 C ATOM 712 CZ TYR A 52 -3.646 -5.702 -11.918 1.00 45.33 C ATOM 713 OH TYR A 52 -2.850 -6.784 -11.613 1.00 14.32 O ATOM 0 H TYR A 52 -7.518 -0.419 -14.188 1.00 55.23 H new ATOM 0 HA TYR A 52 -6.272 -3.030 -14.894 1.00 52.31 H new ATOM 0 HB2 TYR A 52 -5.506 -1.417 -12.869 1.00 51.45 H new ATOM 0 HB3 TYR A 52 -6.864 -2.178 -12.065 1.00 51.45 H new ATOM 0 HD1 TYR A 52 -6.813 -4.624 -11.562 1.00 12.03 H new ATOM 0 HD2 TYR A 52 -3.489 -2.694 -13.410 1.00 51.44 H new ATOM 0 HE1 TYR A 52 -5.390 -6.550 -11.020 1.00 53.13 H new ATOM 0 HE2 TYR A 52 -2.067 -4.621 -12.867 1.00 43.33 H new ATOM 0 HH TYR A 52 -1.942 -6.626 -11.945 1.00 14.32 H new ATOM 723 N THR A 53 -8.200 -4.466 -13.885 1.00 54.15 N ATOM 724 CA THR A 53 -9.437 -5.257 -13.720 1.00 31.44 C ATOM 725 C THR A 53 -10.069 -5.059 -12.332 1.00 72.15 C ATOM 726 O THR A 53 -9.367 -4.911 -11.331 1.00 31.30 O ATOM 727 CB THR A 53 -9.188 -6.772 -13.942 1.00 71.33 C ATOM 728 OG1 THR A 53 -10.410 -7.514 -13.777 1.00 62.21 O ATOM 729 CG2 THR A 53 -8.138 -7.309 -12.974 1.00 24.32 C ATOM 0 H THR A 53 -7.345 -5.022 -13.887 1.00 54.15 H new ATOM 0 HA THR A 53 -10.126 -4.890 -14.481 1.00 31.44 H new ATOM 0 HB THR A 53 -8.821 -6.897 -14.961 1.00 71.33 H new ATOM 0 HG1 THR A 53 -10.236 -8.467 -13.922 1.00 62.21 H new ATOM 0 HG21 THR A 53 -7.986 -8.373 -13.155 1.00 24.32 H new ATOM 0 HG22 THR A 53 -7.198 -6.778 -13.125 1.00 24.32 H new ATOM 0 HG23 THR A 53 -8.478 -7.160 -11.949 1.00 24.32 H new ATOM 737 N ALA A 54 -11.401 -5.076 -12.282 1.00 31.31 N ATOM 738 CA ALA A 54 -12.143 -4.811 -11.041 1.00 64.40 C ATOM 739 C ALA A 54 -12.249 -6.057 -10.146 1.00 10.42 C ATOM 740 O ALA A 54 -12.285 -7.187 -10.630 1.00 24.32 O ATOM 741 CB ALA A 54 -13.535 -4.281 -11.369 1.00 45.23 C ATOM 0 H ALA A 54 -11.994 -5.271 -13.089 1.00 31.31 H new ATOM 0 HA ALA A 54 -11.585 -4.059 -10.483 1.00 64.40 H new ATOM 0 HB1 ALA A 54 -14.078 -4.087 -10.444 1.00 45.23 H new ATOM 0 HB2 ALA A 54 -13.447 -3.356 -11.939 1.00 45.23 H new ATOM 0 HB3 ALA A 54 -14.076 -5.021 -11.959 1.00 45.23 H new ATOM 747 N GLY A 55 -12.308 -5.837 -8.831 1.00 54.25 N ATOM 748 CA GLY A 55 -12.455 -6.937 -7.879 1.00 53.55 C ATOM 749 C GLY A 55 -11.158 -7.290 -7.154 1.00 43.11 C ATOM 750 O GLY A 55 -11.176 -7.668 -5.980 1.00 52.21 O ATOM 0 H GLY A 55 -12.256 -4.912 -8.404 1.00 54.25 H new ATOM 0 HA2 GLY A 55 -13.213 -6.671 -7.143 1.00 53.55 H new ATOM 0 HA3 GLY A 55 -12.819 -7.818 -8.407 1.00 53.55 H new ATOM 754 N GLN A 56 -10.031 -7.168 -7.855 1.00 71.51 N ATOM 755 CA GLN A 56 -8.717 -7.482 -7.275 1.00 14.13 C ATOM 756 C GLN A 56 -8.326 -6.472 -6.181 1.00 35.55 C ATOM 757 O GLN A 56 -8.700 -5.298 -6.243 1.00 60.33 O ATOM 758 CB GLN A 56 -7.646 -7.502 -8.380 1.00 53.14 C ATOM 759 CG GLN A 56 -7.903 -8.526 -9.487 1.00 15.42 C ATOM 760 CD GLN A 56 -7.794 -9.975 -9.018 1.00 22.14 C ATOM 761 OE1 GLN A 56 -8.056 -10.299 -7.865 1.00 22.03 O ATOM 762 NE2 GLN A 56 -7.398 -10.860 -9.909 1.00 64.42 N ATOM 0 H GLN A 56 -9.997 -6.854 -8.825 1.00 71.51 H new ATOM 0 HA GLN A 56 -8.782 -8.467 -6.813 1.00 14.13 H new ATOM 0 HB2 GLN A 56 -7.583 -6.510 -8.827 1.00 53.14 H new ATOM 0 HB3 GLN A 56 -6.677 -7.710 -7.927 1.00 53.14 H new ATOM 0 HG2 GLN A 56 -8.898 -8.360 -9.899 1.00 15.42 H new ATOM 0 HG3 GLN A 56 -7.191 -8.360 -10.296 1.00 15.42 H new ATOM 0 HE21 GLN A 56 -7.186 -10.565 -10.862 1.00 64.42 H new ATOM 0 HE22 GLN A 56 -7.303 -11.841 -9.646 1.00 64.42 H new ATOM 771 N CYS A 57 -7.569 -6.932 -5.182 1.00 70.32 N ATOM 772 CA CYS A 57 -7.113 -6.063 -4.084 1.00 52.52 C ATOM 773 C CYS A 57 -6.328 -4.860 -4.621 1.00 62.11 C ATOM 774 O CYS A 57 -6.520 -3.728 -4.176 1.00 35.21 O ATOM 775 CB CYS A 57 -6.241 -6.851 -3.096 1.00 64.24 C ATOM 776 SG CYS A 57 -4.703 -7.494 -3.801 1.00 5.30 S ATOM 0 H CYS A 57 -7.257 -7.900 -5.107 1.00 70.32 H new ATOM 0 HA CYS A 57 -7.998 -5.697 -3.564 1.00 52.52 H new ATOM 0 HB2 CYS A 57 -5.997 -6.206 -2.252 1.00 64.24 H new ATOM 0 HB3 CYS A 57 -6.822 -7.685 -2.703 1.00 64.24 H new ATOM 0 HG CYS A 57 -3.927 -7.909 -2.844 1.00 5.30 H new ATOM 782 N THR A 58 -5.452 -5.119 -5.592 1.00 63.34 N ATOM 783 CA THR A 58 -4.682 -4.060 -6.260 1.00 42.12 C ATOM 784 C THR A 58 -5.601 -2.986 -6.858 1.00 14.05 C ATOM 785 O THR A 58 -5.305 -1.793 -6.795 1.00 22.41 O ATOM 786 CB THR A 58 -3.793 -4.637 -7.389 1.00 54.53 C ATOM 787 OG1 THR A 58 -4.604 -5.304 -8.371 1.00 34.24 O ATOM 788 CG2 THR A 58 -2.765 -5.616 -6.831 1.00 54.02 C ATOM 0 H THR A 58 -5.255 -6.058 -5.938 1.00 63.34 H new ATOM 0 HA THR A 58 -4.051 -3.607 -5.495 1.00 42.12 H new ATOM 0 HB THR A 58 -3.266 -3.805 -7.856 1.00 54.53 H new ATOM 0 HG1 THR A 58 -4.281 -5.080 -9.269 1.00 34.24 H new ATOM 0 HG21 THR A 58 -2.154 -6.006 -7.645 1.00 54.02 H new ATOM 0 HG22 THR A 58 -2.126 -5.103 -6.112 1.00 54.02 H new ATOM 0 HG23 THR A 58 -3.279 -6.440 -6.336 1.00 54.02 H new ATOM 796 N TRP A 59 -6.721 -3.426 -7.432 1.00 63.05 N ATOM 797 CA TRP A 59 -7.729 -2.518 -7.994 1.00 63.42 C ATOM 798 C TRP A 59 -8.301 -1.580 -6.920 1.00 3.23 C ATOM 799 O TRP A 59 -8.309 -0.365 -7.083 1.00 34.42 O ATOM 800 CB TRP A 59 -8.863 -3.327 -8.643 1.00 70.34 C ATOM 801 CG TRP A 59 -9.958 -2.479 -9.224 1.00 50.25 C ATOM 802 CD1 TRP A 59 -9.962 -1.869 -10.445 1.00 63.11 C ATOM 803 CD2 TRP A 59 -11.211 -2.151 -8.609 1.00 5.53 C ATOM 804 NE1 TRP A 59 -11.137 -1.185 -10.628 1.00 33.12 N ATOM 805 CE2 TRP A 59 -11.919 -1.340 -9.513 1.00 32.15 C ATOM 806 CE3 TRP A 59 -11.802 -2.465 -7.381 1.00 23.14 C ATOM 807 CZ2 TRP A 59 -13.186 -0.837 -9.229 1.00 4.21 C ATOM 808 CZ3 TRP A 59 -13.059 -1.966 -7.099 1.00 51.12 C ATOM 809 CH2 TRP A 59 -13.740 -1.160 -8.021 1.00 11.52 C ATOM 0 H TRP A 59 -6.957 -4.414 -7.522 1.00 63.05 H new ATOM 0 HA TRP A 59 -7.242 -1.904 -8.752 1.00 63.42 H new ATOM 0 HB2 TRP A 59 -8.445 -3.953 -9.431 1.00 70.34 H new ATOM 0 HB3 TRP A 59 -9.292 -3.996 -7.897 1.00 70.34 H new ATOM 0 HD1 TRP A 59 -9.157 -1.918 -11.163 1.00 63.11 H new ATOM 0 HE1 TRP A 59 -11.388 -0.649 -11.458 1.00 33.12 H new ATOM 0 HE3 TRP A 59 -11.285 -3.087 -6.665 1.00 23.14 H new ATOM 0 HZ2 TRP A 59 -13.712 -0.214 -9.937 1.00 4.21 H new ATOM 0 HZ3 TRP A 59 -13.524 -2.201 -6.153 1.00 51.12 H new ATOM 0 HH2 TRP A 59 -14.722 -0.786 -7.773 1.00 11.52 H new ATOM 820 N TYR A 60 -8.768 -2.149 -5.810 1.00 2.42 N ATOM 821 CA TYR A 60 -9.371 -1.346 -4.740 1.00 63.23 C ATOM 822 C TYR A 60 -8.365 -0.337 -4.163 1.00 42.24 C ATOM 823 O TYR A 60 -8.711 0.812 -3.888 1.00 43.13 O ATOM 824 CB TYR A 60 -9.921 -2.243 -3.624 1.00 2.44 C ATOM 825 CG TYR A 60 -10.709 -1.476 -2.576 1.00 64.00 C ATOM 826 CD1 TYR A 60 -11.735 -0.613 -2.951 1.00 10.24 C ATOM 827 CD2 TYR A 60 -10.423 -1.602 -1.218 1.00 33.25 C ATOM 828 CE1 TYR A 60 -12.455 0.094 -2.008 1.00 75.51 C ATOM 829 CE2 TYR A 60 -11.140 -0.896 -0.271 1.00 52.32 C ATOM 830 CZ TYR A 60 -12.154 -0.050 -0.673 1.00 54.05 C ATOM 831 OH TYR A 60 -12.867 0.659 0.265 1.00 25.04 O ATOM 0 H TYR A 60 -8.743 -3.152 -5.626 1.00 2.42 H new ATOM 0 HA TYR A 60 -10.199 -0.789 -5.178 1.00 63.23 H new ATOM 0 HB2 TYR A 60 -10.561 -3.008 -4.063 1.00 2.44 H new ATOM 0 HB3 TYR A 60 -9.092 -2.760 -3.140 1.00 2.44 H new ATOM 0 HD1 TYR A 60 -11.972 -0.494 -3.998 1.00 10.24 H new ATOM 0 HD2 TYR A 60 -9.629 -2.262 -0.901 1.00 33.25 H new ATOM 0 HE1 TYR A 60 -13.250 0.756 -2.317 1.00 75.51 H new ATOM 0 HE2 TYR A 60 -10.908 -1.006 0.778 1.00 52.32 H new ATOM 0 HH TYR A 60 -12.532 0.445 1.161 1.00 25.04 H new ATOM 841 N VAL A 61 -7.119 -0.773 -3.976 1.00 15.51 N ATOM 842 CA VAL A 61 -6.047 0.120 -3.515 1.00 71.11 C ATOM 843 C VAL A 61 -5.786 1.233 -4.545 1.00 75.40 C ATOM 844 O VAL A 61 -5.486 2.375 -4.191 1.00 72.55 O ATOM 845 CB VAL A 61 -4.734 -0.665 -3.255 1.00 15.32 C ATOM 846 CG1 VAL A 61 -3.619 0.269 -2.782 1.00 4.13 C ATOM 847 CG2 VAL A 61 -4.967 -1.784 -2.243 1.00 61.13 C ATOM 0 H VAL A 61 -6.824 -1.736 -4.135 1.00 15.51 H new ATOM 0 HA VAL A 61 -6.376 0.569 -2.578 1.00 71.11 H new ATOM 0 HB VAL A 61 -4.418 -1.114 -4.197 1.00 15.32 H new ATOM 0 HG11 VAL A 61 -2.711 -0.308 -2.607 1.00 4.13 H new ATOM 0 HG12 VAL A 61 -3.429 1.024 -3.545 1.00 4.13 H new ATOM 0 HG13 VAL A 61 -3.922 0.758 -1.856 1.00 4.13 H new ATOM 0 HG21 VAL A 61 -4.034 -2.322 -2.075 1.00 61.13 H new ATOM 0 HG22 VAL A 61 -5.315 -1.357 -1.302 1.00 61.13 H new ATOM 0 HG23 VAL A 61 -5.719 -2.473 -2.629 1.00 61.13 H new ATOM 857 N TYR A 62 -5.925 0.880 -5.820 1.00 2.25 N ATOM 858 CA TYR A 62 -5.774 1.826 -6.933 1.00 21.33 C ATOM 859 C TYR A 62 -6.748 3.015 -6.789 1.00 15.50 C ATOM 860 O TYR A 62 -6.359 4.177 -6.947 1.00 3.11 O ATOM 861 CB TYR A 62 -6.017 1.068 -8.245 1.00 24.10 C ATOM 862 CG TYR A 62 -5.693 1.832 -9.511 1.00 63.33 C ATOM 863 CD1 TYR A 62 -4.375 2.018 -9.912 1.00 53.20 C ATOM 864 CD2 TYR A 62 -6.704 2.336 -10.322 1.00 34.22 C ATOM 865 CE1 TYR A 62 -4.073 2.687 -11.080 1.00 2.10 C ATOM 866 CE2 TYR A 62 -6.409 2.998 -11.495 1.00 63.22 C ATOM 867 CZ TYR A 62 -5.093 3.172 -11.869 1.00 40.35 C ATOM 868 OH TYR A 62 -4.794 3.817 -13.045 1.00 24.13 O ATOM 0 H TYR A 62 -6.146 -0.071 -6.116 1.00 2.25 H new ATOM 0 HA TYR A 62 -4.766 2.242 -6.929 1.00 21.33 H new ATOM 0 HB2 TYR A 62 -5.423 0.154 -8.231 1.00 24.10 H new ATOM 0 HB3 TYR A 62 -7.064 0.767 -8.281 1.00 24.10 H new ATOM 0 HD1 TYR A 62 -3.574 1.632 -9.299 1.00 53.20 H new ATOM 0 HD2 TYR A 62 -7.735 2.207 -10.029 1.00 34.22 H new ATOM 0 HE1 TYR A 62 -3.044 2.830 -11.374 1.00 2.10 H new ATOM 0 HE2 TYR A 62 -7.205 3.379 -12.118 1.00 63.22 H new ATOM 0 HH TYR A 62 -5.460 4.516 -13.213 1.00 24.13 H new ATOM 878 N ASP A 63 -8.013 2.716 -6.487 1.00 45.11 N ATOM 879 CA ASP A 63 -9.016 3.754 -6.205 1.00 1.43 C ATOM 880 C ASP A 63 -8.753 4.450 -4.854 1.00 55.01 C ATOM 881 O ASP A 63 -8.893 5.668 -4.733 1.00 21.52 O ATOM 882 CB ASP A 63 -10.419 3.142 -6.204 1.00 25.14 C ATOM 883 CG ASP A 63 -10.820 2.622 -7.574 1.00 54.25 C ATOM 884 OD1 ASP A 63 -10.344 1.543 -7.966 1.00 51.33 O ATOM 885 OD2 ASP A 63 -11.624 3.294 -8.263 1.00 52.33 O ATOM 0 H ASP A 63 -8.371 1.763 -6.430 1.00 45.11 H new ATOM 0 HA ASP A 63 -8.942 4.505 -6.991 1.00 1.43 H new ATOM 0 HB2 ASP A 63 -10.457 2.326 -5.482 1.00 25.14 H new ATOM 0 HB3 ASP A 63 -11.140 3.891 -5.876 1.00 25.14 H new ATOM 890 N LYS A 64 -8.374 3.669 -3.841 1.00 24.42 N ATOM 891 CA LYS A 64 -8.109 4.207 -2.497 1.00 64.45 C ATOM 892 C LYS A 64 -6.959 5.229 -2.494 1.00 31.33 C ATOM 893 O LYS A 64 -6.954 6.166 -1.695 1.00 63.14 O ATOM 894 CB LYS A 64 -7.799 3.068 -1.513 1.00 12.00 C ATOM 895 CG LYS A 64 -9.012 2.208 -1.154 1.00 22.32 C ATOM 896 CD LYS A 64 -10.058 2.994 -0.365 1.00 42.41 C ATOM 897 CE LYS A 64 -9.520 3.449 0.986 1.00 21.31 C ATOM 898 NZ LYS A 64 -10.529 4.217 1.758 1.00 71.33 N ATOM 0 H LYS A 64 -8.242 2.661 -3.922 1.00 24.42 H new ATOM 0 HA LYS A 64 -9.013 4.727 -2.179 1.00 64.45 H new ATOM 0 HB2 LYS A 64 -7.028 2.429 -1.944 1.00 12.00 H new ATOM 0 HB3 LYS A 64 -7.385 3.494 -0.599 1.00 12.00 H new ATOM 0 HG2 LYS A 64 -9.463 1.819 -2.067 1.00 22.32 H new ATOM 0 HG3 LYS A 64 -8.686 1.349 -0.568 1.00 22.32 H new ATOM 0 HD2 LYS A 64 -10.372 3.863 -0.943 1.00 42.41 H new ATOM 0 HD3 LYS A 64 -10.942 2.374 -0.215 1.00 42.41 H new ATOM 0 HE2 LYS A 64 -9.208 2.579 1.563 1.00 21.31 H new ATOM 0 HE3 LYS A 64 -8.634 4.065 0.834 1.00 21.31 H new ATOM 0 HZ1 LYS A 64 -10.358 4.090 2.776 1.00 71.33 H new ATOM 0 HZ2 LYS A 64 -10.455 5.226 1.518 1.00 71.33 H new ATOM 0 HZ3 LYS A 64 -11.482 3.874 1.522 1.00 71.33 H new ATOM 912 N VAL A 65 -5.984 5.043 -3.382 1.00 41.15 N ATOM 913 CA VAL A 65 -4.867 5.988 -3.511 1.00 21.24 C ATOM 914 C VAL A 65 -5.236 7.165 -4.440 1.00 71.22 C ATOM 915 O VAL A 65 -4.397 8.003 -4.775 1.00 50.23 O ATOM 916 CB VAL A 65 -3.590 5.274 -4.033 1.00 72.24 C ATOM 917 CG1 VAL A 65 -3.751 4.842 -5.488 1.00 70.34 C ATOM 918 CG2 VAL A 65 -2.350 6.151 -3.854 1.00 30.44 C ATOM 0 H VAL A 65 -5.941 4.250 -4.023 1.00 41.15 H new ATOM 0 HA VAL A 65 -4.660 6.386 -2.518 1.00 21.24 H new ATOM 0 HB VAL A 65 -3.450 4.375 -3.433 1.00 72.24 H new ATOM 0 HG11 VAL A 65 -2.840 4.346 -5.823 1.00 70.34 H new ATOM 0 HG12 VAL A 65 -4.592 4.153 -5.572 1.00 70.34 H new ATOM 0 HG13 VAL A 65 -3.936 5.718 -6.109 1.00 70.34 H new ATOM 0 HG21 VAL A 65 -1.473 5.623 -4.229 1.00 30.44 H new ATOM 0 HG22 VAL A 65 -2.478 7.080 -4.409 1.00 30.44 H new ATOM 0 HG23 VAL A 65 -2.213 6.376 -2.796 1.00 30.44 H new ATOM 928 N GLY A 66 -6.501 7.219 -4.856 1.00 71.22 N ATOM 929 CA GLY A 66 -6.975 8.302 -5.713 1.00 74.23 C ATOM 930 C GLY A 66 -6.381 8.271 -7.119 1.00 41.00 C ATOM 931 O GLY A 66 -6.353 9.289 -7.810 1.00 63.53 O ATOM 0 H GLY A 66 -7.212 6.529 -4.614 1.00 71.22 H new ATOM 0 HA2 GLY A 66 -8.061 8.249 -5.785 1.00 74.23 H new ATOM 0 HA3 GLY A 66 -6.733 9.257 -5.246 1.00 74.23 H new ATOM 935 N GLY A 67 -5.902 7.101 -7.539 1.00 23.43 N ATOM 936 CA GLY A 67 -5.309 6.958 -8.866 1.00 55.05 C ATOM 937 C GLY A 67 -4.029 7.777 -9.053 1.00 31.21 C ATOM 938 O GLY A 67 -3.689 8.165 -10.169 1.00 14.23 O ATOM 0 H GLY A 67 -5.913 6.245 -6.984 1.00 23.43 H new ATOM 0 HA2 GLY A 67 -5.087 5.906 -9.045 1.00 55.05 H new ATOM 0 HA3 GLY A 67 -6.039 7.262 -9.616 1.00 55.05 H new ATOM 942 N ASN A 68 -3.312 8.040 -7.960 1.00 13.25 N ATOM 943 CA ASN A 68 -2.043 8.786 -8.025 1.00 74.23 C ATOM 944 C ASN A 68 -0.838 7.844 -8.224 1.00 30.50 C ATOM 945 O ASN A 68 0.294 8.176 -7.869 1.00 0.21 O ATOM 946 CB ASN A 68 -1.853 9.625 -6.754 1.00 32.45 C ATOM 947 CG ASN A 68 -2.866 10.751 -6.643 1.00 22.32 C ATOM 948 OD1 ASN A 68 -2.651 11.849 -7.142 1.00 75.13 O ATOM 949 ND2 ASN A 68 -3.970 10.497 -5.976 1.00 53.42 N ATOM 0 H ASN A 68 -3.582 7.751 -7.020 1.00 13.25 H new ATOM 0 HA ASN A 68 -2.094 9.449 -8.889 1.00 74.23 H new ATOM 0 HB2 ASN A 68 -1.936 8.979 -5.880 1.00 32.45 H new ATOM 0 HB3 ASN A 68 -0.847 10.044 -6.746 1.00 32.45 H new ATOM 0 HD21 ASN A 68 -4.676 11.224 -5.863 1.00 53.42 H new ATOM 0 HD22 ASN A 68 -4.120 9.573 -5.572 1.00 53.42 H new ATOM 956 N ILE A 69 -1.093 6.675 -8.814 1.00 42.52 N ATOM 957 CA ILE A 69 -0.044 5.688 -9.113 1.00 51.31 C ATOM 958 C ILE A 69 -0.161 5.196 -10.563 1.00 74.23 C ATOM 959 O ILE A 69 -1.089 5.569 -11.280 1.00 31.44 O ATOM 960 CB ILE A 69 -0.112 4.466 -8.155 1.00 54.40 C ATOM 961 CG1 ILE A 69 -1.468 3.744 -8.297 1.00 11.00 C ATOM 962 CG2 ILE A 69 0.133 4.897 -6.706 1.00 62.31 C ATOM 963 CD1 ILE A 69 -1.593 2.499 -7.439 1.00 32.01 C ATOM 0 H ILE A 69 -2.028 6.383 -9.099 1.00 42.52 H new ATOM 0 HA ILE A 69 0.914 6.189 -8.970 1.00 51.31 H new ATOM 0 HB ILE A 69 0.676 3.766 -8.432 1.00 54.40 H new ATOM 0 HG12 ILE A 69 -2.267 4.437 -8.034 1.00 11.00 H new ATOM 0 HG13 ILE A 69 -1.615 3.470 -9.342 1.00 11.00 H new ATOM 0 HG21 ILE A 69 0.081 4.026 -6.053 1.00 62.31 H new ATOM 0 HG22 ILE A 69 1.120 5.353 -6.624 1.00 62.31 H new ATOM 0 HG23 ILE A 69 -0.627 5.620 -6.408 1.00 62.31 H new ATOM 0 HD11 ILE A 69 -2.573 2.048 -7.594 1.00 32.01 H new ATOM 0 HD12 ILE A 69 -0.817 1.786 -7.717 1.00 32.01 H new ATOM 0 HD13 ILE A 69 -1.479 2.768 -6.389 1.00 32.01 H new ATOM 975 N GLY A 70 0.773 4.349 -10.992 1.00 41.34 N ATOM 976 CA GLY A 70 0.757 3.850 -12.367 1.00 41.03 C ATOM 977 C GLY A 70 0.233 2.420 -12.480 1.00 14.41 C ATOM 978 O GLY A 70 0.701 1.525 -11.778 1.00 54.44 O ATOM 0 H GLY A 70 1.540 3.998 -10.418 1.00 41.34 H new ATOM 0 HA2 GLY A 70 0.138 4.507 -12.978 1.00 41.03 H new ATOM 0 HA3 GLY A 70 1.767 3.894 -12.775 1.00 41.03 H new ATOM 982 N SER A 71 -0.728 2.198 -13.375 1.00 61.20 N ATOM 983 CA SER A 71 -1.292 0.851 -13.600 1.00 75.35 C ATOM 984 C SER A 71 -0.235 -0.141 -14.111 1.00 40.02 C ATOM 985 O SER A 71 -0.383 -1.356 -13.957 1.00 30.35 O ATOM 986 CB SER A 71 -2.454 0.913 -14.598 1.00 13.34 C ATOM 987 OG SER A 71 -3.576 1.592 -14.054 1.00 55.10 O ATOM 0 H SER A 71 -1.138 2.927 -13.960 1.00 61.20 H new ATOM 0 HA SER A 71 -1.653 0.495 -12.635 1.00 75.35 H new ATOM 0 HB2 SER A 71 -2.127 1.419 -15.506 1.00 13.34 H new ATOM 0 HB3 SER A 71 -2.743 -0.098 -14.883 1.00 13.34 H new ATOM 0 HG SER A 71 -3.399 1.817 -13.117 1.00 55.10 H new ATOM 993 N THR A 72 0.828 0.385 -14.719 1.00 3.51 N ATOM 994 CA THR A 72 1.927 -0.444 -15.251 1.00 71.43 C ATOM 995 C THR A 72 2.619 -1.281 -14.159 1.00 52.32 C ATOM 996 O THR A 72 3.348 -2.229 -14.460 1.00 74.31 O ATOM 997 CB THR A 72 2.996 0.423 -15.966 1.00 12.14 C ATOM 998 OG1 THR A 72 4.052 -0.408 -16.474 1.00 0.25 O ATOM 999 CG2 THR A 72 3.581 1.475 -15.021 1.00 74.23 C ATOM 0 H THR A 72 0.958 1.387 -14.859 1.00 3.51 H new ATOM 0 HA THR A 72 1.464 -1.123 -15.967 1.00 71.43 H new ATOM 0 HB THR A 72 2.507 0.937 -16.794 1.00 12.14 H new ATOM 0 HG1 THR A 72 4.200 -1.160 -15.863 1.00 0.25 H new ATOM 0 HG21 THR A 72 4.327 2.066 -15.552 1.00 74.23 H new ATOM 0 HG22 THR A 72 2.784 2.129 -14.667 1.00 74.23 H new ATOM 0 HG23 THR A 72 4.049 0.980 -14.170 1.00 74.23 H new ATOM 1007 N TRP A 73 2.390 -0.932 -12.891 1.00 3.02 N ATOM 1008 CA TRP A 73 2.962 -1.682 -11.763 1.00 43.04 C ATOM 1009 C TRP A 73 2.482 -3.147 -11.772 1.00 72.24 C ATOM 1010 O TRP A 73 3.235 -4.063 -11.434 1.00 74.33 O ATOM 1011 CB TRP A 73 2.601 -1.000 -10.432 1.00 63.25 C ATOM 1012 CG TRP A 73 3.155 0.397 -10.287 1.00 1.23 C ATOM 1013 CD1 TRP A 73 3.752 1.155 -11.258 1.00 10.34 C ATOM 1014 CD2 TRP A 73 3.159 1.203 -9.097 1.00 30.31 C ATOM 1015 NE1 TRP A 73 4.126 2.372 -10.747 1.00 5.21 N ATOM 1016 CE2 TRP A 73 3.775 2.427 -9.426 1.00 63.32 C ATOM 1017 CE3 TRP A 73 2.706 1.008 -7.786 1.00 42.03 C ATOM 1018 CZ2 TRP A 73 3.945 3.448 -8.495 1.00 62.41 C ATOM 1019 CZ3 TRP A 73 2.875 2.026 -6.864 1.00 73.24 C ATOM 1020 CH2 TRP A 73 3.491 3.232 -7.224 1.00 5.40 C ATOM 0 H TRP A 73 1.814 -0.136 -12.617 1.00 3.02 H new ATOM 0 HA TRP A 73 4.047 -1.686 -11.870 1.00 43.04 H new ATOM 0 HB2 TRP A 73 1.516 -0.961 -10.338 1.00 63.25 H new ATOM 0 HB3 TRP A 73 2.970 -1.613 -9.610 1.00 63.25 H new ATOM 0 HD1 TRP A 73 3.906 0.840 -12.280 1.00 10.34 H new ATOM 0 HE1 TRP A 73 4.591 3.116 -11.268 1.00 5.21 H new ATOM 0 HE3 TRP A 73 2.233 0.080 -7.500 1.00 42.03 H new ATOM 0 HZ2 TRP A 73 4.419 4.379 -8.768 1.00 62.41 H new ATOM 0 HZ3 TRP A 73 2.527 1.889 -5.851 1.00 73.24 H new ATOM 0 HH2 TRP A 73 3.610 4.007 -6.481 1.00 5.40 H new ATOM 1031 N GLY A 74 1.225 -3.353 -12.172 1.00 23.12 N ATOM 1032 CA GLY A 74 0.688 -4.702 -12.352 1.00 23.51 C ATOM 1033 C GLY A 74 0.580 -5.522 -11.067 1.00 54.10 C ATOM 1034 O GLY A 74 -0.080 -5.110 -10.110 1.00 71.21 O ATOM 0 H GLY A 74 0.563 -2.605 -12.377 1.00 23.12 H new ATOM 0 HA2 GLY A 74 -0.301 -4.627 -12.804 1.00 23.51 H new ATOM 0 HA3 GLY A 74 1.321 -5.239 -13.058 1.00 23.51 H new ATOM 1038 N ASN A 75 1.225 -6.692 -11.052 1.00 55.41 N ATOM 1039 CA ASN A 75 1.142 -7.616 -9.913 1.00 41.42 C ATOM 1040 C ASN A 75 1.662 -6.980 -8.615 1.00 33.14 C ATOM 1041 O ASN A 75 2.657 -6.255 -8.613 1.00 54.14 O ATOM 1042 CB ASN A 75 1.908 -8.911 -10.208 1.00 51.50 C ATOM 1043 CG ASN A 75 1.318 -9.674 -11.380 1.00 14.15 C ATOM 1044 OD1 ASN A 75 0.406 -10.479 -11.221 1.00 13.33 O ATOM 1045 ND2 ASN A 75 1.837 -9.435 -12.565 1.00 10.02 N ATOM 0 H ASN A 75 1.812 -7.024 -11.817 1.00 55.41 H new ATOM 0 HA ASN A 75 0.087 -7.850 -9.768 1.00 41.42 H new ATOM 0 HB2 ASN A 75 2.951 -8.674 -10.419 1.00 51.50 H new ATOM 0 HB3 ASN A 75 1.899 -9.546 -9.322 1.00 51.50 H new ATOM 0 HD21 ASN A 75 1.482 -9.925 -13.386 1.00 10.02 H new ATOM 0 HD22 ASN A 75 2.595 -8.759 -12.663 1.00 10.02 H new ATOM 1052 N ALA A 76 0.994 -7.287 -7.508 1.00 64.45 N ATOM 1053 CA ALA A 76 1.292 -6.667 -6.212 1.00 33.41 C ATOM 1054 C ALA A 76 2.742 -6.912 -5.746 1.00 40.22 C ATOM 1055 O ALA A 76 3.281 -6.148 -4.943 1.00 41.35 O ATOM 1056 CB ALA A 76 0.304 -7.171 -5.170 1.00 20.20 C ATOM 0 H ALA A 76 0.235 -7.967 -7.478 1.00 64.45 H new ATOM 0 HA ALA A 76 1.188 -5.589 -6.334 1.00 33.41 H new ATOM 0 HB1 ALA A 76 0.525 -6.711 -4.207 1.00 20.20 H new ATOM 0 HB2 ALA A 76 -0.710 -6.909 -5.473 1.00 20.20 H new ATOM 0 HB3 ALA A 76 0.388 -8.254 -5.082 1.00 20.20 H new ATOM 1062 N ASN A 77 3.375 -7.969 -6.249 1.00 65.14 N ATOM 1063 CA ASN A 77 4.770 -8.273 -5.889 1.00 34.21 C ATOM 1064 C ASN A 77 5.763 -7.308 -6.571 1.00 71.23 C ATOM 1065 O ASN A 77 6.944 -7.269 -6.224 1.00 1.34 O ATOM 1066 CB ASN A 77 5.115 -9.721 -6.253 1.00 54.40 C ATOM 1067 CG ASN A 77 4.996 -9.996 -7.741 1.00 63.24 C ATOM 1068 OD1 ASN A 77 5.924 -9.761 -8.503 1.00 72.11 O ATOM 1069 ND2 ASN A 77 3.859 -10.507 -8.165 1.00 13.12 N ATOM 0 H ASN A 77 2.954 -8.629 -6.903 1.00 65.14 H new ATOM 0 HA ASN A 77 4.862 -8.141 -4.811 1.00 34.21 H new ATOM 0 HB2 ASN A 77 6.132 -9.941 -5.927 1.00 54.40 H new ATOM 0 HB3 ASN A 77 4.454 -10.395 -5.709 1.00 54.40 H new ATOM 0 HD21 ASN A 77 3.733 -10.719 -9.155 1.00 13.12 H new ATOM 0 HD22 ASN A 77 3.105 -10.691 -7.504 1.00 13.12 H new ATOM 1076 N ASN A 78 5.274 -6.527 -7.534 1.00 55.13 N ATOM 1077 CA ASN A 78 6.124 -5.616 -8.318 1.00 41.43 C ATOM 1078 C ASN A 78 6.012 -4.149 -7.843 1.00 31.32 C ATOM 1079 O ASN A 78 6.951 -3.369 -8.004 1.00 25.13 O ATOM 1080 CB ASN A 78 5.726 -5.717 -9.797 1.00 54.04 C ATOM 1081 CG ASN A 78 6.615 -4.893 -10.710 1.00 73.52 C ATOM 1082 OD1 ASN A 78 7.803 -4.716 -10.454 1.00 13.21 O ATOM 1083 ND2 ASN A 78 6.046 -4.385 -11.781 1.00 44.14 N ATOM 0 H ASN A 78 4.288 -6.504 -7.795 1.00 55.13 H new ATOM 0 HA ASN A 78 7.162 -5.918 -8.177 1.00 41.43 H new ATOM 0 HB2 ASN A 78 5.765 -6.761 -10.107 1.00 54.04 H new ATOM 0 HB3 ASN A 78 4.693 -5.389 -9.912 1.00 54.04 H new ATOM 0 HD21 ASN A 78 6.594 -3.823 -12.432 1.00 44.14 H new ATOM 0 HD22 ASN A 78 5.056 -4.553 -11.961 1.00 44.14 H new ATOM 1090 N TRP A 79 4.871 -3.794 -7.243 1.00 32.44 N ATOM 1091 CA TRP A 79 4.553 -2.396 -6.867 1.00 12.51 C ATOM 1092 C TRP A 79 5.741 -1.607 -6.271 1.00 52.45 C ATOM 1093 O TRP A 79 6.127 -0.568 -6.813 1.00 31.43 O ATOM 1094 CB TRP A 79 3.364 -2.371 -5.895 1.00 31.44 C ATOM 1095 CG TRP A 79 2.040 -2.582 -6.571 1.00 72.13 C ATOM 1096 CD1 TRP A 79 1.765 -3.460 -7.578 1.00 30.22 C ATOM 1097 CD2 TRP A 79 0.813 -1.895 -6.291 1.00 21.12 C ATOM 1098 NE1 TRP A 79 0.446 -3.365 -7.941 1.00 42.31 N ATOM 1099 CE2 TRP A 79 -0.161 -2.410 -7.166 1.00 63.40 C ATOM 1100 CE3 TRP A 79 0.446 -0.897 -5.384 1.00 42.22 C ATOM 1101 CZ2 TRP A 79 -1.479 -1.957 -7.161 1.00 32.21 C ATOM 1102 CZ3 TRP A 79 -0.861 -0.450 -5.379 1.00 64.21 C ATOM 1103 CH2 TRP A 79 -1.811 -0.981 -6.263 1.00 13.32 C ATOM 0 H TRP A 79 4.137 -4.460 -7.001 1.00 32.44 H new ATOM 0 HA TRP A 79 4.299 -1.889 -7.798 1.00 12.51 H new ATOM 0 HB2 TRP A 79 3.505 -3.143 -5.139 1.00 31.44 H new ATOM 0 HB3 TRP A 79 3.350 -1.414 -5.374 1.00 31.44 H new ATOM 0 HD1 TRP A 79 2.482 -4.133 -8.025 1.00 30.22 H new ATOM 0 HE1 TRP A 79 -0.010 -3.915 -8.669 1.00 42.31 H new ATOM 0 HE3 TRP A 79 1.171 -0.483 -4.699 1.00 42.22 H new ATOM 0 HZ2 TRP A 79 -2.212 -2.363 -7.842 1.00 32.21 H new ATOM 0 HZ3 TRP A 79 -1.156 0.321 -4.683 1.00 64.21 H new ATOM 0 HH2 TRP A 79 -2.825 -0.612 -6.234 1.00 13.32 H new ATOM 1114 N ALA A 80 6.315 -2.084 -5.163 1.00 53.30 N ATOM 1115 CA ALA A 80 7.426 -1.371 -4.508 1.00 33.12 C ATOM 1116 C ALA A 80 8.618 -1.164 -5.458 1.00 12.13 C ATOM 1117 O ALA A 80 9.208 -0.082 -5.502 1.00 43.21 O ATOM 1118 CB ALA A 80 7.873 -2.106 -3.251 1.00 34.53 C ATOM 0 H ALA A 80 6.036 -2.950 -4.702 1.00 53.30 H new ATOM 0 HA ALA A 80 7.054 -0.386 -4.228 1.00 33.12 H new ATOM 0 HB1 ALA A 80 8.694 -1.562 -2.784 1.00 34.53 H new ATOM 0 HB2 ALA A 80 7.039 -2.174 -2.553 1.00 34.53 H new ATOM 0 HB3 ALA A 80 8.207 -3.109 -3.515 1.00 34.53 H new ATOM 1124 N SER A 81 8.959 -2.198 -6.225 1.00 22.35 N ATOM 1125 CA SER A 81 10.060 -2.116 -7.196 1.00 32.11 C ATOM 1126 C SER A 81 9.757 -1.088 -8.296 1.00 73.22 C ATOM 1127 O SER A 81 10.621 -0.296 -8.674 1.00 62.33 O ATOM 1128 CB SER A 81 10.315 -3.488 -7.830 1.00 40.41 C ATOM 1129 OG SER A 81 10.572 -4.475 -6.842 1.00 33.31 O ATOM 0 H SER A 81 8.492 -3.104 -6.196 1.00 22.35 H new ATOM 0 HA SER A 81 10.952 -1.794 -6.659 1.00 32.11 H new ATOM 0 HB2 SER A 81 9.450 -3.782 -8.424 1.00 40.41 H new ATOM 0 HB3 SER A 81 11.163 -3.424 -8.512 1.00 40.41 H new ATOM 0 HG SER A 81 10.729 -5.339 -7.276 1.00 33.31 H new ATOM 1135 N ALA A 82 8.522 -1.103 -8.796 1.00 51.44 N ATOM 1136 CA ALA A 82 8.084 -0.157 -9.830 1.00 52.32 C ATOM 1137 C ALA A 82 8.129 1.291 -9.319 1.00 40.53 C ATOM 1138 O ALA A 82 8.573 2.195 -10.022 1.00 43.15 O ATOM 1139 CB ALA A 82 6.681 -0.513 -10.307 1.00 4.22 C ATOM 0 H ALA A 82 7.801 -1.762 -8.502 1.00 51.44 H new ATOM 0 HA ALA A 82 8.773 -0.232 -10.671 1.00 52.32 H new ATOM 0 HB1 ALA A 82 6.367 0.195 -11.074 1.00 4.22 H new ATOM 0 HB2 ALA A 82 6.683 -1.521 -10.723 1.00 4.22 H new ATOM 0 HB3 ALA A 82 5.989 -0.469 -9.466 1.00 4.22 H new ATOM 1145 N ALA A 83 7.667 1.498 -8.086 1.00 65.21 N ATOM 1146 CA ALA A 83 7.749 2.810 -7.430 1.00 22.35 C ATOM 1147 C ALA A 83 9.207 3.278 -7.316 1.00 13.33 C ATOM 1148 O ALA A 83 9.540 4.412 -7.667 1.00 65.10 O ATOM 1149 CB ALA A 83 7.101 2.744 -6.053 1.00 21.53 C ATOM 0 H ALA A 83 7.230 0.773 -7.517 1.00 65.21 H new ATOM 0 HA ALA A 83 7.211 3.535 -8.041 1.00 22.35 H new ATOM 0 HB1 ALA A 83 7.166 3.721 -5.573 1.00 21.53 H new ATOM 0 HB2 ALA A 83 6.054 2.460 -6.157 1.00 21.53 H new ATOM 0 HB3 ALA A 83 7.619 2.005 -5.442 1.00 21.53 H new ATOM 1155 N SER A 84 10.073 2.387 -6.840 1.00 65.23 N ATOM 1156 CA SER A 84 11.509 2.681 -6.705 1.00 11.30 C ATOM 1157 C SER A 84 12.151 2.993 -8.068 1.00 13.42 C ATOM 1158 O SER A 84 12.975 3.901 -8.188 1.00 65.23 O ATOM 1159 CB SER A 84 12.235 1.491 -6.056 1.00 25.50 C ATOM 1160 OG SER A 84 11.687 1.180 -4.782 1.00 4.40 O ATOM 0 H SER A 84 9.810 1.449 -6.538 1.00 65.23 H new ATOM 0 HA SER A 84 11.607 3.562 -6.070 1.00 11.30 H new ATOM 0 HB2 SER A 84 12.163 0.620 -6.707 1.00 25.50 H new ATOM 0 HB3 SER A 84 13.295 1.723 -5.951 1.00 25.50 H new ATOM 0 HG SER A 84 10.828 0.723 -4.898 1.00 4.40 H new ATOM 1166 N SER A 85 11.761 2.237 -9.090 1.00 51.31 N ATOM 1167 CA SER A 85 12.309 2.405 -10.444 1.00 62.22 C ATOM 1168 C SER A 85 11.780 3.674 -11.129 1.00 41.43 C ATOM 1169 O SER A 85 12.507 4.349 -11.861 1.00 13.22 O ATOM 1170 CB SER A 85 11.972 1.182 -11.307 1.00 74.54 C ATOM 1171 OG SER A 85 12.561 1.278 -12.596 1.00 32.22 O ATOM 0 H SER A 85 11.064 1.496 -9.011 1.00 51.31 H new ATOM 0 HA SER A 85 13.390 2.503 -10.343 1.00 62.22 H new ATOM 0 HB2 SER A 85 12.324 0.277 -10.811 1.00 74.54 H new ATOM 0 HB3 SER A 85 10.890 1.092 -11.406 1.00 74.54 H new ATOM 0 HG SER A 85 12.330 0.484 -13.121 1.00 32.22 H new ATOM 1177 N ALA A 86 10.510 3.994 -10.887 1.00 14.22 N ATOM 1178 CA ALA A 86 9.868 5.162 -11.502 1.00 64.54 C ATOM 1179 C ALA A 86 10.361 6.487 -10.891 1.00 33.31 C ATOM 1180 O ALA A 86 10.499 7.489 -11.595 1.00 75.13 O ATOM 1181 CB ALA A 86 8.350 5.054 -11.374 1.00 44.32 C ATOM 0 H ALA A 86 9.900 3.460 -10.267 1.00 14.22 H new ATOM 0 HA ALA A 86 10.145 5.169 -12.556 1.00 64.54 H new ATOM 0 HB1 ALA A 86 7.883 5.925 -11.833 1.00 44.32 H new ATOM 0 HB2 ALA A 86 8.006 4.150 -11.877 1.00 44.32 H new ATOM 0 HB3 ALA A 86 8.076 5.009 -10.320 1.00 44.32 H new ATOM 1187 N GLY A 87 10.623 6.485 -9.583 1.00 32.21 N ATOM 1188 CA GLY A 87 11.107 7.695 -8.909 1.00 1.10 C ATOM 1189 C GLY A 87 10.245 8.114 -7.718 1.00 15.54 C ATOM 1190 O GLY A 87 10.125 9.304 -7.415 1.00 24.41 O ATOM 0 H GLY A 87 10.511 5.673 -8.975 1.00 32.21 H new ATOM 0 HA2 GLY A 87 12.128 7.527 -8.567 1.00 1.10 H new ATOM 0 HA3 GLY A 87 11.142 8.513 -9.628 1.00 1.10 H new ATOM 1194 N TYR A 88 9.646 7.137 -7.039 1.00 22.23 N ATOM 1195 CA TYR A 88 8.818 7.401 -5.855 1.00 73.21 C ATOM 1196 C TYR A 88 9.591 7.121 -4.554 1.00 12.43 C ATOM 1197 O TYR A 88 10.756 6.712 -4.581 1.00 14.12 O ATOM 1198 CB TYR A 88 7.529 6.563 -5.911 1.00 70.44 C ATOM 1199 CG TYR A 88 6.574 6.991 -7.013 1.00 63.34 C ATOM 1200 CD1 TYR A 88 6.765 6.586 -8.333 1.00 31.15 C ATOM 1201 CD2 TYR A 88 5.483 7.809 -6.733 1.00 4.44 C ATOM 1202 CE1 TYR A 88 5.900 6.987 -9.335 1.00 61.10 C ATOM 1203 CE2 TYR A 88 4.616 8.214 -7.733 1.00 41.14 C ATOM 1204 CZ TYR A 88 4.829 7.799 -9.030 1.00 33.32 C ATOM 1205 OH TYR A 88 3.969 8.203 -10.031 1.00 53.31 O ATOM 0 H TYR A 88 9.717 6.150 -7.287 1.00 22.23 H new ATOM 0 HA TYR A 88 8.552 8.458 -5.858 1.00 73.21 H new ATOM 0 HB2 TYR A 88 7.792 5.515 -6.056 1.00 70.44 H new ATOM 0 HB3 TYR A 88 7.018 6.633 -4.951 1.00 70.44 H new ATOM 0 HD1 TYR A 88 7.602 5.949 -8.577 1.00 31.15 H new ATOM 0 HD2 TYR A 88 5.310 8.133 -5.717 1.00 4.44 H new ATOM 0 HE1 TYR A 88 6.063 6.665 -10.353 1.00 61.10 H new ATOM 0 HE2 TYR A 88 3.777 8.852 -7.498 1.00 41.14 H new ATOM 0 HH TYR A 88 3.648 7.419 -10.523 1.00 53.31 H new ATOM 1215 N THR A 89 8.938 7.338 -3.416 1.00 21.15 N ATOM 1216 CA THR A 89 9.597 7.208 -2.102 1.00 22.34 C ATOM 1217 C THR A 89 9.106 5.969 -1.337 1.00 14.21 C ATOM 1218 O THR A 89 8.086 6.012 -0.652 1.00 64.53 O ATOM 1219 CB THR A 89 9.369 8.468 -1.224 1.00 63.43 C ATOM 1220 OG1 THR A 89 9.850 9.646 -1.899 1.00 4.32 O ATOM 1221 CG2 THR A 89 10.075 8.345 0.125 1.00 61.02 C ATOM 0 H THR A 89 7.955 7.605 -3.368 1.00 21.15 H new ATOM 0 HA THR A 89 10.663 7.099 -2.304 1.00 22.34 H new ATOM 0 HB THR A 89 8.296 8.552 -1.052 1.00 63.43 H new ATOM 0 HG1 THR A 89 9.698 10.432 -1.334 1.00 4.32 H new ATOM 0 HG21 THR A 89 9.894 9.244 0.714 1.00 61.02 H new ATOM 0 HG22 THR A 89 9.689 7.477 0.660 1.00 61.02 H new ATOM 0 HG23 THR A 89 11.147 8.225 -0.035 1.00 61.02 H new ATOM 1229 N VAL A 90 9.834 4.861 -1.463 1.00 34.40 N ATOM 1230 CA VAL A 90 9.477 3.610 -0.780 1.00 5.55 C ATOM 1231 C VAL A 90 10.263 3.449 0.530 1.00 14.01 C ATOM 1232 O VAL A 90 11.479 3.256 0.518 1.00 43.05 O ATOM 1233 CB VAL A 90 9.736 2.376 -1.683 1.00 21.14 C ATOM 1234 CG1 VAL A 90 9.282 1.089 -0.992 1.00 14.22 C ATOM 1235 CG2 VAL A 90 9.041 2.543 -3.034 1.00 12.21 C ATOM 0 H VAL A 90 10.678 4.800 -2.033 1.00 34.40 H new ATOM 0 HA VAL A 90 8.412 3.667 -0.555 1.00 5.55 H new ATOM 0 HB VAL A 90 10.809 2.302 -1.858 1.00 21.14 H new ATOM 0 HG11 VAL A 90 9.474 0.238 -1.645 1.00 14.22 H new ATOM 0 HG12 VAL A 90 9.833 0.963 -0.060 1.00 14.22 H new ATOM 0 HG13 VAL A 90 8.215 1.148 -0.778 1.00 14.22 H new ATOM 0 HG21 VAL A 90 9.234 1.667 -3.653 1.00 12.21 H new ATOM 0 HG22 VAL A 90 7.967 2.649 -2.880 1.00 12.21 H new ATOM 0 HG23 VAL A 90 9.425 3.433 -3.533 1.00 12.21 H new ATOM 1245 N ASN A 91 9.560 3.531 1.657 1.00 31.14 N ATOM 1246 CA ASN A 91 10.188 3.429 2.984 1.00 64.31 C ATOM 1247 C ASN A 91 9.470 2.388 3.857 1.00 24.32 C ATOM 1248 O ASN A 91 8.467 1.804 3.451 1.00 23.31 O ATOM 1249 CB ASN A 91 10.155 4.791 3.700 1.00 33.03 C ATOM 1250 CG ASN A 91 10.849 5.906 2.931 1.00 75.40 C ATOM 1251 OD1 ASN A 91 10.449 7.061 3.009 1.00 74.52 O ATOM 1252 ND2 ASN A 91 11.898 5.584 2.203 1.00 63.43 N ATOM 0 H ASN A 91 8.550 3.668 1.684 1.00 31.14 H new ATOM 0 HA ASN A 91 11.222 3.116 2.835 1.00 64.31 H new ATOM 0 HB2 ASN A 91 9.117 5.074 3.875 1.00 33.03 H new ATOM 0 HB3 ASN A 91 10.626 4.689 4.678 1.00 33.03 H new ATOM 0 HD21 ASN A 91 12.400 6.305 1.685 1.00 63.43 H new ATOM 0 HD22 ASN A 91 12.208 4.613 2.157 1.00 63.43 H new ATOM 1259 N ASN A 92 9.989 2.158 5.060 1.00 10.12 N ATOM 1260 CA ASN A 92 9.295 1.327 6.052 1.00 32.21 C ATOM 1261 C ASN A 92 8.375 2.185 6.936 1.00 44.21 C ATOM 1262 O ASN A 92 7.686 1.666 7.816 1.00 20.42 O ATOM 1263 CB ASN A 92 10.301 0.562 6.921 1.00 3.25 C ATOM 1264 CG ASN A 92 11.097 -0.469 6.140 1.00 32.15 C ATOM 1265 OD1 ASN A 92 10.480 -1.095 5.153 1.00 10.53 O flip ATOM 1266 ND2 ASN A 92 12.260 -0.721 6.434 1.00 22.22 N flip ATOM 0 H ASN A 92 10.884 2.532 5.375 1.00 10.12 H new ATOM 0 HA ASN A 92 8.682 0.604 5.513 1.00 32.21 H new ATOM 0 HB2 ASN A 92 10.989 1.272 7.381 1.00 3.25 H new ATOM 0 HB3 ASN A 92 9.768 0.064 7.731 1.00 3.25 H new ATOM 0 HD21 ASN A 92 12.712 -0.222 7.201 1.00 22.22 H new ATOM 0 HD22 ASN A 92 12.776 -1.429 5.912 1.00 22.22 H new ATOM 1273 N SER A 93 8.383 3.500 6.698 1.00 12.22 N ATOM 1274 CA SER A 93 7.479 4.432 7.394 1.00 75.12 C ATOM 1275 C SER A 93 6.013 4.025 7.219 1.00 52.14 C ATOM 1276 O SER A 93 5.499 4.010 6.100 1.00 45.44 O ATOM 1277 CB SER A 93 7.667 5.864 6.875 1.00 52.30 C ATOM 1278 OG SER A 93 6.643 6.721 7.361 1.00 53.24 O ATOM 0 H SER A 93 9.007 3.948 6.027 1.00 12.22 H new ATOM 0 HA SER A 93 7.732 4.392 8.453 1.00 75.12 H new ATOM 0 HB2 SER A 93 8.641 6.242 7.186 1.00 52.30 H new ATOM 0 HB3 SER A 93 7.659 5.863 5.785 1.00 52.30 H new ATOM 0 HG SER A 93 6.785 7.628 7.018 1.00 53.24 H new ATOM 1284 N PRO A 94 5.313 3.712 8.327 1.00 63.45 N ATOM 1285 CA PRO A 94 3.936 3.199 8.286 1.00 53.10 C ATOM 1286 C PRO A 94 2.860 4.300 8.237 1.00 44.13 C ATOM 1287 O PRO A 94 1.674 4.016 8.405 1.00 22.25 O ATOM 1288 CB PRO A 94 3.854 2.427 9.603 1.00 70.52 C ATOM 1289 CG PRO A 94 4.703 3.216 10.549 1.00 20.22 C ATOM 1290 CD PRO A 94 5.807 3.834 9.718 1.00 51.34 C ATOM 0 HA PRO A 94 3.743 2.613 7.387 1.00 53.10 H new ATOM 0 HB2 PRO A 94 2.826 2.354 9.958 1.00 70.52 H new ATOM 0 HB3 PRO A 94 4.225 1.408 9.491 1.00 70.52 H new ATOM 0 HG2 PRO A 94 4.115 3.986 11.048 1.00 20.22 H new ATOM 0 HG3 PRO A 94 5.116 2.575 11.328 1.00 20.22 H new ATOM 0 HD2 PRO A 94 5.979 4.875 9.992 1.00 51.34 H new ATOM 0 HD3 PRO A 94 6.752 3.309 9.854 1.00 51.34 H new ATOM 1298 N GLU A 95 3.274 5.545 7.994 1.00 10.52 N ATOM 1299 CA GLU A 95 2.347 6.688 8.009 1.00 73.34 C ATOM 1300 C GLU A 95 1.208 6.526 6.982 1.00 63.31 C ATOM 1301 O GLU A 95 1.412 6.008 5.877 1.00 24.34 O ATOM 1302 CB GLU A 95 3.113 7.998 7.759 1.00 74.04 C ATOM 1303 CG GLU A 95 2.249 9.256 7.853 1.00 33.44 C ATOM 1304 CD GLU A 95 1.569 9.413 9.209 1.00 23.21 C ATOM 1305 OE1 GLU A 95 2.232 9.868 10.165 1.00 3.23 O ATOM 1306 OE2 GLU A 95 0.366 9.081 9.325 1.00 22.02 O ATOM 0 H GLU A 95 4.241 5.791 7.785 1.00 10.52 H new ATOM 0 HA GLU A 95 1.888 6.723 8.997 1.00 73.34 H new ATOM 0 HB2 GLU A 95 3.926 8.074 8.481 1.00 74.04 H new ATOM 0 HB3 GLU A 95 3.568 7.957 6.770 1.00 74.04 H new ATOM 0 HG2 GLU A 95 2.870 10.131 7.661 1.00 33.44 H new ATOM 0 HG3 GLU A 95 1.488 9.227 7.073 1.00 33.44 H new ATOM 1313 N ALA A 96 0.015 6.988 7.361 1.00 11.33 N ATOM 1314 CA ALA A 96 -1.189 6.843 6.534 1.00 15.35 C ATOM 1315 C ALA A 96 -1.056 7.538 5.168 1.00 24.43 C ATOM 1316 O ALA A 96 -0.180 8.381 4.960 1.00 74.24 O ATOM 1317 CB ALA A 96 -2.403 7.374 7.288 1.00 44.12 C ATOM 0 H ALA A 96 -0.146 7.471 8.245 1.00 11.33 H new ATOM 0 HA ALA A 96 -1.320 5.780 6.333 1.00 15.35 H new ATOM 0 HB1 ALA A 96 -3.293 7.263 6.669 1.00 44.12 H new ATOM 0 HB2 ALA A 96 -2.532 6.811 8.212 1.00 44.12 H new ATOM 0 HB3 ALA A 96 -2.253 8.428 7.523 1.00 44.12 H new ATOM 1323 N GLY A 97 -1.940 7.175 4.236 1.00 2.31 N ATOM 1324 CA GLY A 97 -1.864 7.703 2.878 1.00 61.04 C ATOM 1325 C GLY A 97 -0.834 6.975 2.018 1.00 14.53 C ATOM 1326 O GLY A 97 -0.441 7.461 0.956 1.00 42.41 O ATOM 0 H GLY A 97 -2.708 6.524 4.397 1.00 2.31 H new ATOM 0 HA2 GLY A 97 -2.844 7.625 2.407 1.00 61.04 H new ATOM 0 HA3 GLY A 97 -1.613 8.763 2.918 1.00 61.04 H new ATOM 1330 N SER A 98 -0.408 5.798 2.473 1.00 11.23 N ATOM 1331 CA SER A 98 0.636 5.023 1.785 1.00 52.33 C ATOM 1332 C SER A 98 0.148 3.606 1.457 1.00 42.44 C ATOM 1333 O SER A 98 -0.868 3.155 1.980 1.00 23.11 O ATOM 1334 CB SER A 98 1.890 4.935 2.666 1.00 43.23 C ATOM 1335 OG SER A 98 2.312 6.222 3.102 1.00 33.43 O ATOM 0 H SER A 98 -0.768 5.355 3.318 1.00 11.23 H new ATOM 0 HA SER A 98 0.874 5.535 0.852 1.00 52.33 H new ATOM 0 HB2 SER A 98 1.684 4.306 3.532 1.00 43.23 H new ATOM 0 HB3 SER A 98 2.695 4.457 2.108 1.00 43.23 H new ATOM 0 HG SER A 98 3.169 6.445 2.682 1.00 33.43 H new ATOM 1341 N ILE A 99 0.875 2.901 0.592 1.00 2.10 N ATOM 1342 CA ILE A 99 0.543 1.507 0.251 1.00 72.53 C ATOM 1343 C ILE A 99 1.627 0.553 0.769 1.00 23.44 C ATOM 1344 O ILE A 99 2.805 0.762 0.505 1.00 45.24 O ATOM 1345 CB ILE A 99 0.398 1.291 -1.284 1.00 0.03 C ATOM 1346 CG1 ILE A 99 -0.615 2.279 -1.899 1.00 35.51 C ATOM 1347 CG2 ILE A 99 -0.013 -0.151 -1.585 1.00 51.22 C ATOM 1348 CD1 ILE A 99 -0.064 3.674 -2.116 1.00 52.03 C ATOM 0 H ILE A 99 1.698 3.266 0.112 1.00 2.10 H new ATOM 0 HA ILE A 99 -0.415 1.295 0.727 1.00 72.53 H new ATOM 0 HB ILE A 99 1.369 1.482 -1.740 1.00 0.03 H new ATOM 0 HG12 ILE A 99 -0.959 1.883 -2.855 1.00 35.51 H new ATOM 0 HG13 ILE A 99 -1.487 2.341 -1.248 1.00 35.51 H new ATOM 0 HG21 ILE A 99 -0.110 -0.284 -2.662 1.00 51.22 H new ATOM 0 HG22 ILE A 99 0.746 -0.833 -1.202 1.00 51.22 H new ATOM 0 HG23 ILE A 99 -0.968 -0.365 -1.106 1.00 51.22 H new ATOM 0 HD11 ILE A 99 -0.837 4.307 -2.551 1.00 52.03 H new ATOM 0 HD12 ILE A 99 0.253 4.093 -1.161 1.00 52.03 H new ATOM 0 HD13 ILE A 99 0.789 3.627 -2.793 1.00 52.03 H new ATOM 1360 N LEU A 100 1.240 -0.494 1.498 1.00 51.41 N ATOM 1361 CA LEU A 100 2.226 -1.464 2.002 1.00 70.34 C ATOM 1362 C LEU A 100 2.245 -2.738 1.143 1.00 41.34 C ATOM 1363 O LEU A 100 1.200 -3.300 0.806 1.00 1.21 O ATOM 1364 CB LEU A 100 1.984 -1.814 3.487 1.00 42.22 C ATOM 1365 CG LEU A 100 0.860 -2.823 3.800 1.00 52.54 C ATOM 1366 CD1 LEU A 100 0.821 -3.135 5.292 1.00 4.24 C ATOM 1367 CD2 LEU A 100 -0.497 -2.311 3.330 1.00 25.23 C ATOM 0 H LEU A 100 0.273 -0.695 1.752 1.00 51.41 H new ATOM 0 HA LEU A 100 3.204 -0.988 1.930 1.00 70.34 H new ATOM 0 HB2 LEU A 100 2.914 -2.207 3.897 1.00 42.22 H new ATOM 0 HB3 LEU A 100 1.766 -0.889 4.021 1.00 42.22 H new ATOM 0 HG LEU A 100 1.078 -3.741 3.254 1.00 52.54 H new ATOM 0 HD11 LEU A 100 0.022 -3.848 5.494 1.00 4.24 H new ATOM 0 HD12 LEU A 100 1.775 -3.563 5.599 1.00 4.24 H new ATOM 0 HD13 LEU A 100 0.638 -2.217 5.851 1.00 4.24 H new ATOM 0 HD21 LEU A 100 -1.265 -3.047 3.567 1.00 25.23 H new ATOM 0 HD22 LEU A 100 -0.726 -1.372 3.834 1.00 25.23 H new ATOM 0 HD23 LEU A 100 -0.471 -2.147 2.253 1.00 25.23 H new ATOM 1379 N GLN A 101 3.444 -3.180 0.782 1.00 12.14 N ATOM 1380 CA GLN A 101 3.612 -4.375 -0.044 1.00 40.20 C ATOM 1381 C GLN A 101 3.803 -5.624 0.830 1.00 53.24 C ATOM 1382 O GLN A 101 4.841 -5.791 1.472 1.00 44.15 O ATOM 1383 CB GLN A 101 4.815 -4.202 -0.981 1.00 55.24 C ATOM 1384 CG GLN A 101 4.842 -5.205 -2.127 1.00 5.12 C ATOM 1385 CD GLN A 101 6.137 -5.169 -2.916 1.00 43.33 C ATOM 1386 OE1 GLN A 101 7.204 -4.908 -2.377 1.00 23.22 O ATOM 1387 NE2 GLN A 101 6.052 -5.410 -4.207 1.00 63.10 N ATOM 0 H GLN A 101 4.319 -2.728 1.048 1.00 12.14 H new ATOM 0 HA GLN A 101 2.709 -4.508 -0.640 1.00 40.20 H new ATOM 0 HB2 GLN A 101 4.803 -3.193 -1.392 1.00 55.24 H new ATOM 0 HB3 GLN A 101 5.733 -4.299 -0.402 1.00 55.24 H new ATOM 0 HG2 GLN A 101 4.694 -6.208 -1.728 1.00 5.12 H new ATOM 0 HG3 GLN A 101 4.008 -5.003 -2.799 1.00 5.12 H new ATOM 0 HE21 GLN A 101 5.148 -5.625 -4.627 1.00 63.10 H new ATOM 0 HE22 GLN A 101 6.890 -5.382 -4.787 1.00 63.10 H new ATOM 1396 N SER A 102 2.791 -6.489 0.863 1.00 12.24 N ATOM 1397 CA SER A 102 2.841 -7.721 1.668 1.00 13.14 C ATOM 1398 C SER A 102 3.470 -8.891 0.894 1.00 74.24 C ATOM 1399 O SER A 102 4.148 -9.732 1.479 1.00 45.30 O ATOM 1400 CB SER A 102 1.429 -8.107 2.130 1.00 21.41 C ATOM 1401 OG SER A 102 0.827 -7.063 2.880 1.00 31.41 O ATOM 0 H SER A 102 1.923 -6.364 0.343 1.00 12.24 H new ATOM 0 HA SER A 102 3.471 -7.518 2.534 1.00 13.14 H new ATOM 0 HB2 SER A 102 0.811 -8.337 1.262 1.00 21.41 H new ATOM 0 HB3 SER A 102 1.477 -9.012 2.736 1.00 21.41 H new ATOM 0 HG SER A 102 -0.072 -7.337 3.159 1.00 31.41 H new ATOM 1407 N THR A 103 3.225 -8.938 -0.421 1.00 51.15 N ATOM 1408 CA THR A 103 3.742 -10.008 -1.316 1.00 24.12 C ATOM 1409 C THR A 103 3.337 -11.425 -0.861 1.00 20.22 C ATOM 1410 O THR A 103 3.905 -12.417 -1.318 1.00 41.42 O ATOM 1411 CB THR A 103 5.291 -9.971 -1.474 1.00 32.22 C ATOM 1412 OG1 THR A 103 5.944 -10.434 -0.281 1.00 1.02 O ATOM 1413 CG2 THR A 103 5.783 -8.569 -1.810 1.00 4.33 C ATOM 0 H THR A 103 2.663 -8.239 -0.906 1.00 51.15 H new ATOM 0 HA THR A 103 3.277 -9.795 -2.278 1.00 24.12 H new ATOM 0 HB THR A 103 5.543 -10.637 -2.299 1.00 32.22 H new ATOM 0 HG1 THR A 103 5.311 -10.416 0.467 1.00 1.02 H new ATOM 0 HG21 THR A 103 6.868 -8.579 -1.913 1.00 4.33 H new ATOM 0 HG22 THR A 103 5.332 -8.240 -2.746 1.00 4.33 H new ATOM 0 HG23 THR A 103 5.501 -7.883 -1.011 1.00 4.33 H new ATOM 1421 N ALA A 104 2.334 -11.519 0.010 1.00 51.22 N ATOM 1422 CA ALA A 104 1.895 -12.813 0.546 1.00 25.24 C ATOM 1423 C ALA A 104 1.095 -13.628 -0.488 1.00 1.13 C ATOM 1424 O ALA A 104 -0.135 -13.554 -0.541 1.00 71.12 O ATOM 1425 CB ALA A 104 1.079 -12.610 1.820 1.00 34.24 C ATOM 0 H ALA A 104 1.809 -10.718 0.361 1.00 51.22 H new ATOM 0 HA ALA A 104 2.789 -13.388 0.785 1.00 25.24 H new ATOM 0 HB1 ALA A 104 0.760 -13.578 2.206 1.00 34.24 H new ATOM 0 HB2 ALA A 104 1.691 -12.105 2.567 1.00 34.24 H new ATOM 0 HB3 ALA A 104 0.202 -12.002 1.598 1.00 34.24 H new ATOM 1431 N GLY A 105 1.803 -14.389 -1.318 1.00 3.01 N ATOM 1432 CA GLY A 105 1.146 -15.238 -2.311 1.00 14.52 C ATOM 1433 C GLY A 105 1.802 -15.178 -3.689 1.00 60.32 C ATOM 1434 O GLY A 105 2.777 -14.453 -3.892 1.00 23.30 O ATOM 0 H GLY A 105 2.822 -14.437 -1.325 1.00 3.01 H new ATOM 0 HA2 GLY A 105 1.153 -16.269 -1.958 1.00 14.52 H new ATOM 0 HA3 GLY A 105 0.102 -14.939 -2.400 1.00 14.52 H new ATOM 1438 N GLY A 106 1.252 -15.934 -4.643 1.00 61.31 N ATOM 1439 CA GLY A 106 1.812 -15.984 -5.994 1.00 30.01 C ATOM 1440 C GLY A 106 1.753 -14.646 -6.728 1.00 42.33 C ATOM 1441 O GLY A 106 2.747 -14.197 -7.304 1.00 72.02 O ATOM 0 H GLY A 106 0.425 -16.516 -4.506 1.00 61.31 H new ATOM 0 HA2 GLY A 106 2.850 -16.312 -5.937 1.00 30.01 H new ATOM 0 HA3 GLY A 106 1.273 -16.732 -6.575 1.00 30.01 H new ATOM 1445 N TYR A 107 0.585 -14.009 -6.711 1.00 22.31 N ATOM 1446 CA TYR A 107 0.401 -12.699 -7.351 1.00 54.14 C ATOM 1447 C TYR A 107 0.971 -11.580 -6.461 1.00 1.35 C ATOM 1448 O TYR A 107 1.269 -10.474 -6.928 1.00 21.22 O ATOM 1449 CB TYR A 107 -1.094 -12.436 -7.610 1.00 12.41 C ATOM 1450 CG TYR A 107 -1.798 -13.512 -8.428 1.00 1.33 C ATOM 1451 CD1 TYR A 107 -2.115 -14.745 -7.864 1.00 42.31 C ATOM 1452 CD2 TYR A 107 -2.160 -13.291 -9.755 1.00 2.04 C ATOM 1453 CE1 TYR A 107 -2.766 -15.722 -8.594 1.00 4.14 C ATOM 1454 CE2 TYR A 107 -2.817 -14.263 -10.489 1.00 33.11 C ATOM 1455 CZ TYR A 107 -3.115 -15.477 -9.905 1.00 71.13 C ATOM 1456 OH TYR A 107 -3.775 -16.449 -10.629 1.00 25.41 O ATOM 0 H TYR A 107 -0.254 -14.376 -6.261 1.00 22.31 H new ATOM 0 HA TYR A 107 0.935 -12.706 -8.301 1.00 54.14 H new ATOM 0 HB2 TYR A 107 -1.603 -12.337 -6.651 1.00 12.41 H new ATOM 0 HB3 TYR A 107 -1.197 -11.481 -8.126 1.00 12.41 H new ATOM 0 HD1 TYR A 107 -1.847 -14.942 -6.836 1.00 42.31 H new ATOM 0 HD2 TYR A 107 -1.924 -12.345 -10.219 1.00 2.04 H new ATOM 0 HE1 TYR A 107 -3.000 -16.673 -8.139 1.00 4.14 H new ATOM 0 HE2 TYR A 107 -3.095 -14.072 -11.515 1.00 33.11 H new ATOM 0 HH TYR A 107 -3.950 -16.120 -11.535 1.00 25.41 H new ATOM 1466 N GLY A 108 1.130 -11.889 -5.177 1.00 11.43 N ATOM 1467 CA GLY A 108 1.542 -10.898 -4.193 1.00 14.23 C ATOM 1468 C GLY A 108 0.352 -10.321 -3.430 1.00 30.54 C ATOM 1469 O GLY A 108 -0.742 -10.883 -3.466 1.00 11.04 O ATOM 0 H GLY A 108 0.979 -12.822 -4.795 1.00 11.43 H new ATOM 0 HA2 GLY A 108 2.238 -11.354 -3.489 1.00 14.23 H new ATOM 0 HA3 GLY A 108 2.078 -10.091 -4.693 1.00 14.23 H new ATOM 1473 N HIS A 109 0.560 -9.199 -2.739 1.00 23.35 N ATOM 1474 CA HIS A 109 -0.528 -8.523 -2.022 1.00 21.52 C ATOM 1475 C HIS A 109 -0.121 -7.108 -1.585 1.00 65.33 C ATOM 1476 O HIS A 109 1.023 -6.876 -1.181 1.00 65.02 O ATOM 1477 CB HIS A 109 -0.973 -9.337 -0.799 1.00 2.13 C ATOM 1478 CG HIS A 109 -2.102 -8.696 -0.056 1.00 4.43 C ATOM 1479 ND1 HIS A 109 -3.247 -8.302 -0.706 1.00 32.32 N ATOM 1480 CD2 HIS A 109 -2.204 -8.375 1.256 1.00 44.54 C ATOM 1481 CE1 HIS A 109 -4.015 -7.753 0.217 1.00 24.54 C ATOM 1482 NE2 HIS A 109 -3.425 -7.776 1.418 1.00 44.33 N ATOM 0 H HIS A 109 1.467 -8.739 -2.659 1.00 23.35 H new ATOM 0 HA HIS A 109 -1.365 -8.442 -2.715 1.00 21.52 H new ATOM 0 HB2 HIS A 109 -1.276 -10.333 -1.122 1.00 2.13 H new ATOM 0 HB3 HIS A 109 -0.126 -9.464 -0.125 1.00 2.13 H new ATOM 0 HD2 HIS A 109 -1.467 -8.556 2.024 1.00 44.54 H new ATOM 0 HE1 HIS A 109 -4.994 -7.338 0.027 1.00 24.54 H new ATOM 0 HE2 HIS A 109 -3.812 -7.415 2.290 1.00 44.33 H new ATOM 1490 N VAL A 110 -1.069 -6.174 -1.684 1.00 60.35 N ATOM 1491 CA VAL A 110 -0.870 -4.775 -1.275 1.00 3.33 C ATOM 1492 C VAL A 110 -2.173 -4.183 -0.710 1.00 44.44 C ATOM 1493 O VAL A 110 -3.268 -4.616 -1.070 1.00 44.03 O ATOM 1494 CB VAL A 110 -0.397 -3.880 -2.457 1.00 30.31 C ATOM 1495 CG1 VAL A 110 1.025 -4.232 -2.890 1.00 24.21 C ATOM 1496 CG2 VAL A 110 -1.365 -3.990 -3.634 1.00 51.32 C ATOM 0 H VAL A 110 -2.002 -6.364 -2.051 1.00 60.35 H new ATOM 0 HA VAL A 110 -0.095 -4.785 -0.509 1.00 3.33 H new ATOM 0 HB VAL A 110 -0.389 -2.847 -2.110 1.00 30.31 H new ATOM 0 HG11 VAL A 110 1.323 -3.588 -3.717 1.00 24.21 H new ATOM 0 HG12 VAL A 110 1.707 -4.086 -2.052 1.00 24.21 H new ATOM 0 HG13 VAL A 110 1.061 -5.273 -3.210 1.00 24.21 H new ATOM 0 HG21 VAL A 110 -1.018 -3.357 -4.451 1.00 51.32 H new ATOM 0 HG22 VAL A 110 -1.411 -5.025 -3.971 1.00 51.32 H new ATOM 0 HG23 VAL A 110 -2.357 -3.666 -3.320 1.00 51.32 H new ATOM 1506 N ALA A 111 -2.054 -3.192 0.169 1.00 52.25 N ATOM 1507 CA ALA A 111 -3.230 -2.527 0.746 1.00 33.23 C ATOM 1508 C ALA A 111 -2.941 -1.048 1.051 1.00 44.34 C ATOM 1509 O ALA A 111 -1.784 -0.638 1.159 1.00 35.53 O ATOM 1510 CB ALA A 111 -3.697 -3.258 2.003 1.00 51.21 C ATOM 0 H ALA A 111 -1.160 -2.829 0.500 1.00 52.25 H new ATOM 0 HA ALA A 111 -4.031 -2.563 0.008 1.00 33.23 H new ATOM 0 HB1 ALA A 111 -4.569 -2.751 2.416 1.00 51.21 H new ATOM 0 HB2 ALA A 111 -3.961 -4.285 1.750 1.00 51.21 H new ATOM 0 HB3 ALA A 111 -2.895 -3.261 2.741 1.00 51.21 H new ATOM 1516 N TYR A 112 -3.998 -0.250 1.192 1.00 13.52 N ATOM 1517 CA TYR A 112 -3.854 1.194 1.433 1.00 2.44 C ATOM 1518 C TYR A 112 -4.003 1.533 2.928 1.00 54.33 C ATOM 1519 O TYR A 112 -4.982 1.151 3.569 1.00 24.24 O ATOM 1520 CB TYR A 112 -4.891 1.964 0.603 1.00 71.40 C ATOM 1521 CG TYR A 112 -4.731 3.476 0.649 1.00 74.04 C ATOM 1522 CD1 TYR A 112 -3.733 4.113 -0.083 1.00 55.44 C ATOM 1523 CD2 TYR A 112 -5.582 4.265 1.414 1.00 63.12 C ATOM 1524 CE1 TYR A 112 -3.591 5.489 -0.052 1.00 55.22 C ATOM 1525 CE2 TYR A 112 -5.444 5.639 1.449 1.00 22.11 C ATOM 1526 CZ TYR A 112 -4.450 6.247 0.715 1.00 0.42 C ATOM 1527 OH TYR A 112 -4.318 7.621 0.745 1.00 13.12 O ATOM 0 H TYR A 112 -4.964 -0.573 1.144 1.00 13.52 H new ATOM 0 HA TYR A 112 -2.852 1.493 1.126 1.00 2.44 H new ATOM 0 HB2 TYR A 112 -4.826 1.635 -0.434 1.00 71.40 H new ATOM 0 HB3 TYR A 112 -5.888 1.705 0.958 1.00 71.40 H new ATOM 0 HD1 TYR A 112 -3.058 3.523 -0.685 1.00 55.44 H new ATOM 0 HD2 TYR A 112 -6.365 3.796 1.991 1.00 63.12 H new ATOM 0 HE1 TYR A 112 -2.811 5.967 -0.626 1.00 55.22 H new ATOM 0 HE2 TYR A 112 -6.114 6.235 2.051 1.00 22.11 H new ATOM 0 HH TYR A 112 -5.003 8.003 1.333 1.00 13.12 H new ATOM 1537 N VAL A 113 -3.028 2.258 3.470 1.00 25.24 N ATOM 1538 CA VAL A 113 -3.015 2.623 4.892 1.00 12.50 C ATOM 1539 C VAL A 113 -3.974 3.787 5.194 1.00 61.41 C ATOM 1540 O VAL A 113 -3.779 4.907 4.712 1.00 5.20 O ATOM 1541 CB VAL A 113 -1.589 3.016 5.352 1.00 45.44 C ATOM 1542 CG1 VAL A 113 -1.575 3.366 6.839 1.00 74.52 C ATOM 1543 CG2 VAL A 113 -0.591 1.900 5.044 1.00 12.22 C ATOM 0 H VAL A 113 -2.228 2.609 2.944 1.00 25.24 H new ATOM 0 HA VAL A 113 -3.348 1.742 5.441 1.00 12.50 H new ATOM 0 HB VAL A 113 -1.286 3.902 4.794 1.00 45.44 H new ATOM 0 HG11 VAL A 113 -0.563 3.639 7.139 1.00 74.52 H new ATOM 0 HG12 VAL A 113 -2.246 4.205 7.022 1.00 74.52 H new ATOM 0 HG13 VAL A 113 -1.906 2.504 7.419 1.00 74.52 H new ATOM 0 HG21 VAL A 113 0.403 2.199 5.376 1.00 12.22 H new ATOM 0 HG22 VAL A 113 -0.890 0.991 5.566 1.00 12.22 H new ATOM 0 HG23 VAL A 113 -0.574 1.713 3.970 1.00 12.22 H new ATOM 1553 N GLU A 114 -4.995 3.517 6.005 1.00 71.04 N ATOM 1554 CA GLU A 114 -5.991 4.529 6.375 1.00 61.23 C ATOM 1555 C GLU A 114 -5.567 5.332 7.616 1.00 73.41 C ATOM 1556 O GLU A 114 -5.786 6.542 7.685 1.00 35.40 O ATOM 1557 CB GLU A 114 -7.352 3.861 6.635 1.00 5.10 C ATOM 1558 CG GLU A 114 -7.991 3.236 5.396 1.00 24.52 C ATOM 1559 CD GLU A 114 -8.546 4.268 4.418 1.00 13.02 C ATOM 1560 OE1 GLU A 114 -7.775 4.814 3.609 1.00 63.03 O ATOM 1561 OE2 GLU A 114 -9.769 4.526 4.446 1.00 25.24 O ATOM 0 H GLU A 114 -5.157 2.601 6.422 1.00 71.04 H new ATOM 0 HA GLU A 114 -6.072 5.224 5.539 1.00 61.23 H new ATOM 0 HB2 GLU A 114 -7.226 3.088 7.393 1.00 5.10 H new ATOM 0 HB3 GLU A 114 -8.035 4.603 7.047 1.00 5.10 H new ATOM 0 HG2 GLU A 114 -7.250 2.622 4.884 1.00 24.52 H new ATOM 0 HG3 GLU A 114 -8.796 2.571 5.707 1.00 24.52 H new ATOM 1568 N ASN A 115 -4.958 4.663 8.600 1.00 32.45 N ATOM 1569 CA ASN A 115 -4.621 5.320 9.872 1.00 73.53 C ATOM 1570 C ASN A 115 -3.561 4.550 10.678 1.00 20.43 C ATOM 1571 O ASN A 115 -3.504 3.319 10.644 1.00 63.43 O ATOM 1572 CB ASN A 115 -5.901 5.507 10.705 1.00 52.43 C ATOM 1573 CG ASN A 115 -5.641 6.147 12.055 1.00 25.13 C ATOM 1574 OD1 ASN A 115 -5.552 7.366 12.171 1.00 61.43 O ATOM 1575 ND2 ASN A 115 -5.547 5.340 13.094 1.00 42.10 N ATOM 0 H ASN A 115 -4.690 3.680 8.545 1.00 32.45 H new ATOM 0 HA ASN A 115 -4.184 6.290 9.636 1.00 73.53 H new ATOM 0 HB2 ASN A 115 -6.605 6.124 10.146 1.00 52.43 H new ATOM 0 HB3 ASN A 115 -6.376 4.537 10.854 1.00 52.43 H new ATOM 0 HD21 ASN A 115 -5.396 5.725 14.027 1.00 42.10 H new ATOM 0 HD22 ASN A 115 -5.625 4.331 12.965 1.00 42.10 H new ATOM 1582 N VAL A 116 -2.712 5.298 11.390 1.00 33.10 N ATOM 1583 CA VAL A 116 -1.712 4.716 12.296 1.00 53.24 C ATOM 1584 C VAL A 116 -2.156 4.870 13.763 1.00 4.23 C ATOM 1585 O VAL A 116 -2.857 5.819 14.110 1.00 35.14 O ATOM 1586 CB VAL A 116 -0.326 5.388 12.109 1.00 33.12 C ATOM 1587 CG1 VAL A 116 0.747 4.697 12.956 1.00 1.45 C ATOM 1588 CG2 VAL A 116 0.067 5.395 10.636 1.00 63.24 C ATOM 0 H VAL A 116 -2.697 6.317 11.356 1.00 33.10 H new ATOM 0 HA VAL A 116 -1.626 3.657 12.051 1.00 53.24 H new ATOM 0 HB VAL A 116 -0.402 6.420 12.452 1.00 33.12 H new ATOM 0 HG11 VAL A 116 1.706 5.192 12.802 1.00 1.45 H new ATOM 0 HG12 VAL A 116 0.473 4.756 14.009 1.00 1.45 H new ATOM 0 HG13 VAL A 116 0.827 3.651 12.660 1.00 1.45 H new ATOM 0 HG21 VAL A 116 1.042 5.870 10.522 1.00 63.24 H new ATOM 0 HG22 VAL A 116 0.117 4.370 10.268 1.00 63.24 H new ATOM 0 HG23 VAL A 116 -0.676 5.950 10.064 1.00 63.24 H new ATOM 1598 N ASN A 117 -1.741 3.936 14.617 1.00 30.31 N ATOM 1599 CA ASN A 117 -2.162 3.925 16.028 1.00 30.03 C ATOM 1600 C ASN A 117 -0.996 4.205 16.992 1.00 73.20 C ATOM 1601 O ASN A 117 0.173 4.196 16.598 1.00 22.22 O ATOM 1602 CB ASN A 117 -2.791 2.566 16.355 1.00 0.50 C ATOM 1603 CG ASN A 117 -4.084 2.345 15.599 1.00 63.44 C ATOM 1604 OD1 ASN A 117 -3.982 1.866 14.382 1.00 22.45 O flip ATOM 1605 ND2 ASN A 117 -5.168 2.613 16.101 1.00 72.01 N flip ATOM 0 H ASN A 117 -1.113 3.174 14.362 1.00 30.31 H new ATOM 0 HA ASN A 117 -2.889 4.725 16.164 1.00 30.03 H new ATOM 0 HB2 ASN A 117 -2.086 1.771 16.109 1.00 0.50 H new ATOM 0 HB3 ASN A 117 -2.982 2.503 17.426 1.00 0.50 H new ATOM 0 HD21 ASN A 117 -5.213 2.984 17.050 1.00 72.01 H new ATOM 0 HD22 ASN A 117 -6.026 2.465 15.570 1.00 72.01 H new ATOM 1612 N SER A 118 -1.327 4.444 18.265 1.00 62.32 N ATOM 1613 CA SER A 118 -0.319 4.651 19.320 1.00 63.22 C ATOM 1614 C SER A 118 0.535 3.393 19.516 1.00 34.32 C ATOM 1615 O SER A 118 1.718 3.473 19.851 1.00 11.33 O ATOM 1616 CB SER A 118 -1.001 5.036 20.643 1.00 72.43 C ATOM 1617 OG SER A 118 -0.064 5.157 21.707 1.00 4.13 O ATOM 0 H SER A 118 -2.290 4.500 18.595 1.00 62.32 H new ATOM 0 HA SER A 118 0.335 5.465 19.008 1.00 63.22 H new ATOM 0 HB2 SER A 118 -1.531 5.980 20.517 1.00 72.43 H new ATOM 0 HB3 SER A 118 -1.747 4.283 20.900 1.00 72.43 H new ATOM 0 HG SER A 118 -0.534 5.404 22.531 1.00 4.13 H new ATOM 1623 N ASP A 119 -0.078 2.228 19.293 1.00 73.13 N ATOM 1624 CA ASP A 119 0.640 0.947 19.326 1.00 41.30 C ATOM 1625 C ASP A 119 1.670 0.841 18.185 1.00 33.01 C ATOM 1626 O ASP A 119 2.515 -0.055 18.178 1.00 32.41 O ATOM 1627 CB ASP A 119 -0.351 -0.218 19.205 1.00 64.14 C ATOM 1628 CG ASP A 119 -1.418 -0.201 20.280 1.00 20.43 C ATOM 1629 OD1 ASP A 119 -2.437 0.494 20.097 1.00 43.31 O ATOM 1630 OD2 ASP A 119 -1.246 -0.891 21.305 1.00 13.04 O ATOM 0 H ASP A 119 -1.073 2.143 19.087 1.00 73.13 H new ATOM 0 HA ASP A 119 1.168 0.897 20.279 1.00 41.30 H new ATOM 0 HB2 ASP A 119 -0.829 -0.181 18.226 1.00 64.14 H new ATOM 0 HB3 ASP A 119 0.195 -1.160 19.258 1.00 64.14 H new ATOM 1635 N GLY A 120 1.586 1.759 17.222 1.00 23.04 N ATOM 1636 CA GLY A 120 2.374 1.647 15.998 1.00 54.22 C ATOM 1637 C GLY A 120 1.698 0.740 14.975 1.00 73.44 C ATOM 1638 O GLY A 120 2.205 0.532 13.873 1.00 3.11 O ATOM 0 H GLY A 120 0.985 2.582 17.266 1.00 23.04 H new ATOM 0 HA2 GLY A 120 2.520 2.637 15.567 1.00 54.22 H new ATOM 0 HA3 GLY A 120 3.363 1.254 16.236 1.00 54.22 H new ATOM 1642 N SER A 121 0.545 0.192 15.362 1.00 61.34 N ATOM 1643 CA SER A 121 -0.232 -0.705 14.504 1.00 54.21 C ATOM 1644 C SER A 121 -0.830 0.039 13.304 1.00 3.23 C ATOM 1645 O SER A 121 -1.371 1.141 13.445 1.00 33.32 O ATOM 1646 CB SER A 121 -1.353 -1.374 15.310 1.00 1.42 C ATOM 1647 OG SER A 121 -0.830 -2.043 16.445 1.00 1.23 O ATOM 0 H SER A 121 0.124 0.357 16.276 1.00 61.34 H new ATOM 0 HA SER A 121 0.448 -1.468 14.125 1.00 54.21 H new ATOM 0 HB2 SER A 121 -2.077 -0.623 15.627 1.00 1.42 H new ATOM 0 HB3 SER A 121 -1.887 -2.084 14.678 1.00 1.42 H new ATOM 0 HG SER A 121 -1.562 -2.461 16.945 1.00 1.23 H new ATOM 1653 N VAL A 122 -0.736 -0.575 12.132 1.00 73.12 N ATOM 1654 CA VAL A 122 -1.198 0.034 10.881 1.00 13.43 C ATOM 1655 C VAL A 122 -2.557 -0.530 10.437 1.00 10.42 C ATOM 1656 O VAL A 122 -2.708 -1.735 10.234 1.00 72.25 O ATOM 1657 CB VAL A 122 -0.160 -0.201 9.756 1.00 52.51 C ATOM 1658 CG1 VAL A 122 -0.593 0.463 8.453 1.00 13.34 C ATOM 1659 CG2 VAL A 122 1.217 0.295 10.191 1.00 54.33 C ATOM 0 H VAL A 122 -0.339 -1.507 12.016 1.00 73.12 H new ATOM 0 HA VAL A 122 -1.314 1.102 11.066 1.00 13.43 H new ATOM 0 HB VAL A 122 -0.098 -1.273 9.571 1.00 52.51 H new ATOM 0 HG11 VAL A 122 0.157 0.279 7.684 1.00 13.34 H new ATOM 0 HG12 VAL A 122 -1.549 0.048 8.134 1.00 13.34 H new ATOM 0 HG13 VAL A 122 -0.697 1.537 8.609 1.00 13.34 H new ATOM 0 HG21 VAL A 122 1.936 0.123 9.390 1.00 54.33 H new ATOM 0 HG22 VAL A 122 1.167 1.361 10.411 1.00 54.33 H new ATOM 0 HG23 VAL A 122 1.533 -0.245 11.084 1.00 54.33 H new ATOM 1669 N GLU A 123 -3.542 0.351 10.284 1.00 43.54 N ATOM 1670 CA GLU A 123 -4.873 -0.045 9.810 1.00 22.53 C ATOM 1671 C GLU A 123 -5.000 0.152 8.295 1.00 70.15 C ATOM 1672 O GLU A 123 -5.049 1.284 7.800 1.00 73.32 O ATOM 1673 CB GLU A 123 -5.956 0.757 10.543 1.00 54.25 C ATOM 1674 CG GLU A 123 -5.984 0.501 12.044 1.00 62.14 C ATOM 1675 CD GLU A 123 -6.946 1.419 12.776 1.00 75.42 C ATOM 1676 OE1 GLU A 123 -6.553 2.556 13.100 1.00 3.31 O ATOM 1677 OE2 GLU A 123 -8.100 1.011 13.021 1.00 61.13 O ATOM 0 H GLU A 123 -3.447 1.347 10.481 1.00 43.54 H new ATOM 0 HA GLU A 123 -5.009 -1.105 10.026 1.00 22.53 H new ATOM 0 HB2 GLU A 123 -5.793 1.820 10.366 1.00 54.25 H new ATOM 0 HB3 GLU A 123 -6.930 0.509 10.121 1.00 54.25 H new ATOM 0 HG2 GLU A 123 -6.267 -0.536 12.227 1.00 62.14 H new ATOM 0 HG3 GLU A 123 -4.981 0.634 12.450 1.00 62.14 H new ATOM 1684 N VAL A 124 -5.040 -0.958 7.561 1.00 70.33 N ATOM 1685 CA VAL A 124 -5.113 -0.919 6.099 1.00 73.42 C ATOM 1686 C VAL A 124 -6.511 -1.292 5.576 1.00 34.33 C ATOM 1687 O VAL A 124 -7.231 -2.082 6.190 1.00 1.12 O ATOM 1688 CB VAL A 124 -4.058 -1.859 5.469 1.00 43.32 C ATOM 1689 CG1 VAL A 124 -2.654 -1.457 5.913 1.00 41.44 C ATOM 1690 CG2 VAL A 124 -4.340 -3.322 5.820 1.00 21.55 C ATOM 0 H VAL A 124 -5.023 -1.899 7.955 1.00 70.33 H new ATOM 0 HA VAL A 124 -4.905 0.110 5.804 1.00 73.42 H new ATOM 0 HB VAL A 124 -4.121 -1.760 4.385 1.00 43.32 H new ATOM 0 HG11 VAL A 124 -1.923 -2.128 5.461 1.00 41.44 H new ATOM 0 HG12 VAL A 124 -2.451 -0.434 5.597 1.00 41.44 H new ATOM 0 HG13 VAL A 124 -2.583 -1.522 6.999 1.00 41.44 H new ATOM 0 HG21 VAL A 124 -3.582 -3.958 5.363 1.00 21.55 H new ATOM 0 HG22 VAL A 124 -4.315 -3.448 6.902 1.00 21.55 H new ATOM 0 HG23 VAL A 124 -5.324 -3.603 5.445 1.00 21.55 H new ATOM 1700 N SER A 125 -6.882 -0.712 4.433 1.00 63.22 N ATOM 1701 CA SER A 125 -8.193 -0.957 3.814 1.00 50.24 C ATOM 1702 C SER A 125 -8.106 -2.022 2.712 1.00 54.31 C ATOM 1703 O SER A 125 -7.524 -1.791 1.650 1.00 70.24 O ATOM 1704 CB SER A 125 -8.762 0.346 3.231 1.00 2.41 C ATOM 1705 OG SER A 125 -10.018 0.133 2.606 1.00 62.24 O ATOM 0 H SER A 125 -6.291 -0.065 3.912 1.00 63.22 H new ATOM 0 HA SER A 125 -8.859 -1.327 4.593 1.00 50.24 H new ATOM 0 HB2 SER A 125 -8.871 1.084 4.026 1.00 2.41 H new ATOM 0 HB3 SER A 125 -8.060 0.759 2.507 1.00 2.41 H new ATOM 0 HG SER A 125 -10.496 0.985 2.534 1.00 62.24 H new ATOM 1711 N GLU A 126 -8.670 -3.191 2.987 1.00 31.11 N ATOM 1712 CA GLU A 126 -8.719 -4.291 2.019 1.00 22.34 C ATOM 1713 C GLU A 126 -10.162 -4.511 1.534 1.00 61.24 C ATOM 1714 O GLU A 126 -11.099 -3.928 2.076 1.00 42.13 O ATOM 1715 CB GLU A 126 -8.174 -5.571 2.669 1.00 53.14 C ATOM 1716 CG GLU A 126 -6.807 -5.388 3.327 1.00 54.41 C ATOM 1717 CD GLU A 126 -6.336 -6.633 4.060 1.00 5.52 C ATOM 1718 OE1 GLU A 126 -7.044 -7.083 4.983 1.00 34.02 O ATOM 1719 OE2 GLU A 126 -5.247 -7.158 3.723 1.00 62.14 O ATOM 0 H GLU A 126 -9.106 -3.408 3.883 1.00 31.11 H new ATOM 0 HA GLU A 126 -8.102 -4.037 1.157 1.00 22.34 H new ATOM 0 HB2 GLU A 126 -8.885 -5.919 3.418 1.00 53.14 H new ATOM 0 HB3 GLU A 126 -8.102 -6.351 1.911 1.00 53.14 H new ATOM 0 HG2 GLU A 126 -6.075 -5.121 2.565 1.00 54.41 H new ATOM 0 HG3 GLU A 126 -6.855 -4.555 4.028 1.00 54.41 H new ATOM 1726 N MET A 127 -10.351 -5.349 0.520 1.00 4.20 N ATOM 1727 CA MET A 127 -11.701 -5.633 0.016 1.00 2.32 C ATOM 1728 C MET A 127 -12.145 -7.065 0.342 1.00 55.30 C ATOM 1729 O MET A 127 -11.477 -8.039 -0.007 1.00 34.15 O ATOM 1730 CB MET A 127 -11.788 -5.379 -1.494 1.00 63.14 C ATOM 1731 CG MET A 127 -13.109 -5.831 -2.115 1.00 55.32 C ATOM 1732 SD MET A 127 -13.406 -5.100 -3.735 1.00 44.50 S ATOM 1733 CE MET A 127 -13.817 -3.416 -3.266 1.00 40.24 C ATOM 0 H MET A 127 -9.601 -5.840 0.033 1.00 4.20 H new ATOM 0 HA MET A 127 -12.382 -4.951 0.525 1.00 2.32 H new ATOM 0 HB2 MET A 127 -11.653 -4.314 -1.683 1.00 63.14 H new ATOM 0 HB3 MET A 127 -10.967 -5.898 -1.989 1.00 63.14 H new ATOM 0 HG2 MET A 127 -13.109 -6.917 -2.206 1.00 55.32 H new ATOM 0 HG3 MET A 127 -13.929 -5.567 -1.447 1.00 55.32 H new ATOM 0 HE1 MET A 127 -13.391 -2.722 -3.991 1.00 40.24 H new ATOM 0 HE2 MET A 127 -14.900 -3.298 -3.245 1.00 40.24 H new ATOM 0 HE3 MET A 127 -13.410 -3.204 -2.278 1.00 40.24 H new ATOM 1743 N ASN A 128 -13.290 -7.177 1.008 1.00 60.41 N ATOM 1744 CA ASN A 128 -13.881 -8.471 1.342 1.00 1.41 C ATOM 1745 C ASN A 128 -14.598 -9.072 0.119 1.00 33.11 C ATOM 1746 O ASN A 128 -15.784 -8.836 -0.102 1.00 60.15 O ATOM 1747 CB ASN A 128 -14.861 -8.311 2.513 1.00 71.54 C ATOM 1748 CG ASN A 128 -15.555 -9.608 2.888 1.00 41.40 C ATOM 1749 OD1 ASN A 128 -14.982 -10.689 2.794 1.00 35.11 O ATOM 1750 ND2 ASN A 128 -16.802 -9.512 3.305 1.00 4.13 N ATOM 0 H ASN A 128 -13.834 -6.377 1.331 1.00 60.41 H new ATOM 0 HA ASN A 128 -13.084 -9.154 1.638 1.00 1.41 H new ATOM 0 HB2 ASN A 128 -14.322 -7.930 3.381 1.00 71.54 H new ATOM 0 HB3 ASN A 128 -15.612 -7.566 2.251 1.00 71.54 H new ATOM 0 HD21 ASN A 128 -17.320 -10.352 3.561 1.00 4.13 H new ATOM 0 HD22 ASN A 128 -17.249 -8.597 3.371 1.00 4.13 H new ATOM 1757 N TYR A 129 -13.860 -9.842 -0.676 1.00 64.42 N ATOM 1758 CA TYR A 129 -14.412 -10.479 -1.883 1.00 21.20 C ATOM 1759 C TYR A 129 -15.353 -11.656 -1.552 1.00 65.45 C ATOM 1760 O TYR A 129 -15.755 -12.412 -2.440 1.00 64.14 O ATOM 1761 CB TYR A 129 -13.270 -10.944 -2.805 1.00 14.11 C ATOM 1762 CG TYR A 129 -12.306 -11.934 -2.166 1.00 23.13 C ATOM 1763 CD1 TYR A 129 -11.182 -11.495 -1.473 1.00 13.13 C ATOM 1764 CD2 TYR A 129 -12.517 -13.308 -2.264 1.00 31.15 C ATOM 1765 CE1 TYR A 129 -10.301 -12.391 -0.897 1.00 73.53 C ATOM 1766 CE2 TYR A 129 -11.639 -14.210 -1.689 1.00 43.22 C ATOM 1767 CZ TYR A 129 -10.533 -13.746 -1.009 1.00 75.42 C ATOM 1768 OH TYR A 129 -9.654 -14.642 -0.437 1.00 74.32 O ATOM 0 H TYR A 129 -12.874 -10.045 -0.511 1.00 64.42 H new ATOM 0 HA TYR A 129 -15.012 -9.730 -2.399 1.00 21.20 H new ATOM 0 HB2 TYR A 129 -13.702 -11.400 -3.696 1.00 14.11 H new ATOM 0 HB3 TYR A 129 -12.708 -10.070 -3.135 1.00 14.11 H new ATOM 0 HD1 TYR A 129 -10.995 -10.435 -1.384 1.00 13.13 H new ATOM 0 HD2 TYR A 129 -13.381 -13.675 -2.798 1.00 31.15 H new ATOM 0 HE1 TYR A 129 -9.435 -12.032 -0.362 1.00 73.53 H new ATOM 0 HE2 TYR A 129 -11.819 -15.272 -1.772 1.00 43.22 H new ATOM 0 HH TYR A 129 -9.963 -15.557 -0.606 1.00 74.32 H new ATOM 1778 N ASN A 130 -15.708 -11.805 -0.276 1.00 53.41 N ATOM 1779 CA ASN A 130 -16.625 -12.860 0.158 1.00 54.42 C ATOM 1780 C ASN A 130 -18.074 -12.341 0.209 1.00 50.01 C ATOM 1781 O ASN A 130 -18.552 -11.889 1.252 1.00 71.03 O ATOM 1782 CB ASN A 130 -16.193 -13.403 1.531 1.00 24.32 C ATOM 1783 CG ASN A 130 -17.092 -14.516 2.041 1.00 14.13 C ATOM 1784 OD1 ASN A 130 -17.678 -15.266 1.267 1.00 61.03 O ATOM 1785 ND2 ASN A 130 -17.210 -14.631 3.346 1.00 51.12 N ATOM 0 H ASN A 130 -15.373 -11.206 0.478 1.00 53.41 H new ATOM 0 HA ASN A 130 -16.586 -13.673 -0.567 1.00 54.42 H new ATOM 0 HB2 ASN A 130 -15.170 -13.773 1.463 1.00 24.32 H new ATOM 0 HB3 ASN A 130 -16.190 -12.587 2.253 1.00 24.32 H new ATOM 0 HD21 ASN A 130 -17.803 -15.361 3.742 1.00 51.12 H new ATOM 0 HD22 ASN A 130 -16.709 -13.991 3.962 1.00 51.12 H new ATOM 1792 N GLY A 131 -18.754 -12.380 -0.935 1.00 1.04 N ATOM 1793 CA GLY A 131 -20.150 -11.949 -1.003 1.00 74.45 C ATOM 1794 C GLY A 131 -20.335 -10.449 -0.781 1.00 42.42 C ATOM 1795 O GLY A 131 -21.023 -10.030 0.156 1.00 15.31 O ATOM 0 H GLY A 131 -18.366 -12.703 -1.821 1.00 1.04 H new ATOM 0 HA2 GLY A 131 -20.558 -12.217 -1.978 1.00 74.45 H new ATOM 0 HA3 GLY A 131 -20.727 -12.493 -0.255 1.00 74.45 H new ATOM 1799 N GLY A 132 -19.724 -9.638 -1.641 1.00 52.24 N ATOM 1800 CA GLY A 132 -19.846 -8.186 -1.526 1.00 0.41 C ATOM 1801 C GLY A 132 -18.809 -7.421 -2.350 1.00 22.24 C ATOM 1802 O GLY A 132 -17.702 -7.169 -1.876 1.00 22.24 O ATOM 0 H GLY A 132 -19.145 -9.957 -2.418 1.00 52.24 H new ATOM 0 HA2 GLY A 132 -20.845 -7.887 -1.844 1.00 0.41 H new ATOM 0 HA3 GLY A 132 -19.747 -7.903 -0.478 1.00 0.41 H new ATOM 1806 N PRO A 133 -19.147 -7.012 -3.592 1.00 32.41 N ATOM 1807 CA PRO A 133 -18.218 -6.264 -4.469 1.00 75.34 C ATOM 1808 C PRO A 133 -17.815 -4.890 -3.903 1.00 41.42 C ATOM 1809 O PRO A 133 -16.884 -4.252 -4.401 1.00 72.44 O ATOM 1810 CB PRO A 133 -19.017 -6.087 -5.771 1.00 15.23 C ATOM 1811 CG PRO A 133 -20.446 -6.255 -5.377 1.00 44.21 C ATOM 1812 CD PRO A 133 -20.451 -7.245 -4.243 1.00 50.44 C ATOM 0 HA PRO A 133 -17.276 -6.799 -4.590 1.00 75.34 H new ATOM 0 HB2 PRO A 133 -18.842 -5.105 -6.210 1.00 15.23 H new ATOM 0 HB3 PRO A 133 -18.724 -6.826 -6.517 1.00 15.23 H new ATOM 0 HG2 PRO A 133 -20.879 -5.304 -5.067 1.00 44.21 H new ATOM 0 HG3 PRO A 133 -21.041 -6.618 -6.215 1.00 44.21 H new ATOM 0 HD2 PRO A 133 -21.281 -7.070 -3.558 1.00 50.44 H new ATOM 0 HD3 PRO A 133 -20.545 -8.270 -4.602 1.00 50.44 H new ATOM 1820 N PHE A 134 -18.530 -4.433 -2.881 1.00 31.31 N ATOM 1821 CA PHE A 134 -18.235 -3.152 -2.232 1.00 60.33 C ATOM 1822 C PHE A 134 -17.881 -3.352 -0.750 1.00 22.02 C ATOM 1823 O PHE A 134 -17.623 -2.387 -0.026 1.00 2.13 O ATOM 1824 CB PHE A 134 -19.441 -2.208 -2.363 1.00 63.01 C ATOM 1825 CG PHE A 134 -19.909 -2.019 -3.786 1.00 12.52 C ATOM 1826 CD1 PHE A 134 -19.141 -1.305 -4.693 1.00 3.25 C ATOM 1827 CD2 PHE A 134 -21.106 -2.571 -4.221 1.00 44.55 C ATOM 1828 CE1 PHE A 134 -19.562 -1.134 -5.998 1.00 63.24 C ATOM 1829 CE2 PHE A 134 -21.531 -2.403 -5.526 1.00 70.24 C ATOM 1830 CZ PHE A 134 -20.756 -1.686 -6.417 1.00 13.13 C ATOM 0 H PHE A 134 -19.324 -4.931 -2.479 1.00 31.31 H new ATOM 0 HA PHE A 134 -17.373 -2.707 -2.730 1.00 60.33 H new ATOM 0 HB2 PHE A 134 -20.265 -2.600 -1.767 1.00 63.01 H new ATOM 0 HB3 PHE A 134 -19.179 -1.237 -1.944 1.00 63.01 H new ATOM 0 HD1 PHE A 134 -18.202 -0.877 -4.376 1.00 3.25 H new ATOM 0 HD2 PHE A 134 -21.713 -3.139 -3.531 1.00 44.55 H new ATOM 0 HE1 PHE A 134 -18.957 -0.568 -6.691 1.00 63.24 H new ATOM 0 HE2 PHE A 134 -22.468 -2.832 -5.849 1.00 70.24 H new ATOM 0 HZ PHE A 134 -21.083 -1.558 -7.438 1.00 13.13 H new ATOM 1840 N SER A 135 -17.864 -4.611 -0.308 1.00 72.45 N ATOM 1841 CA SER A 135 -17.558 -4.942 1.090 1.00 24.41 C ATOM 1842 C SER A 135 -16.077 -4.690 1.408 1.00 53.22 C ATOM 1843 O SER A 135 -15.184 -5.226 0.752 1.00 34.02 O ATOM 1844 CB SER A 135 -17.916 -6.405 1.395 1.00 34.22 C ATOM 1845 OG SER A 135 -17.679 -6.727 2.763 1.00 34.54 O ATOM 0 H SER A 135 -18.058 -5.421 -0.897 1.00 72.45 H new ATOM 0 HA SER A 135 -18.163 -4.291 1.722 1.00 24.41 H new ATOM 0 HB2 SER A 135 -18.964 -6.582 1.155 1.00 34.22 H new ATOM 0 HB3 SER A 135 -17.328 -7.065 0.758 1.00 34.22 H new ATOM 0 HG SER A 135 -18.518 -7.010 3.183 1.00 34.54 H new ATOM 1851 N VAL A 136 -15.821 -3.867 2.419 1.00 13.03 N ATOM 1852 CA VAL A 136 -14.456 -3.505 2.803 1.00 65.11 C ATOM 1853 C VAL A 136 -14.054 -4.167 4.131 1.00 63.41 C ATOM 1854 O VAL A 136 -14.893 -4.386 5.007 1.00 2.42 O ATOM 1855 CB VAL A 136 -14.322 -1.966 2.924 1.00 1.01 C ATOM 1856 CG1 VAL A 136 -12.889 -1.553 3.260 1.00 2.14 C ATOM 1857 CG2 VAL A 136 -14.800 -1.293 1.639 1.00 52.52 C ATOM 0 H VAL A 136 -16.545 -3.434 2.993 1.00 13.03 H new ATOM 0 HA VAL A 136 -13.785 -3.867 2.024 1.00 65.11 H new ATOM 0 HB VAL A 136 -14.955 -1.634 3.747 1.00 1.01 H new ATOM 0 HG11 VAL A 136 -12.832 -0.467 3.337 1.00 2.14 H new ATOM 0 HG12 VAL A 136 -12.595 -2.000 4.209 1.00 2.14 H new ATOM 0 HG13 VAL A 136 -12.217 -1.897 2.473 1.00 2.14 H new ATOM 0 HG21 VAL A 136 -14.701 -0.212 1.736 1.00 52.52 H new ATOM 0 HG22 VAL A 136 -14.196 -1.639 0.801 1.00 52.52 H new ATOM 0 HG23 VAL A 136 -15.845 -1.547 1.462 1.00 52.52 H new ATOM 1867 N SER A 137 -12.771 -4.492 4.270 1.00 2.23 N ATOM 1868 CA SER A 137 -12.245 -5.089 5.503 1.00 50.22 C ATOM 1869 C SER A 137 -10.989 -4.356 5.971 1.00 62.13 C ATOM 1870 O SER A 137 -9.990 -4.285 5.255 1.00 44.44 O ATOM 1871 CB SER A 137 -11.924 -6.571 5.301 1.00 71.53 C ATOM 1872 OG SER A 137 -11.409 -7.159 6.488 1.00 44.04 O ATOM 0 H SER A 137 -12.070 -4.352 3.542 1.00 2.23 H new ATOM 0 HA SER A 137 -13.017 -4.995 6.266 1.00 50.22 H new ATOM 0 HB2 SER A 137 -12.825 -7.101 4.993 1.00 71.53 H new ATOM 0 HB3 SER A 137 -11.198 -6.681 4.495 1.00 71.53 H new ATOM 0 HG SER A 137 -11.216 -8.106 6.327 1.00 44.04 H new ATOM 1878 N GLU A 138 -11.053 -3.810 7.172 1.00 60.23 N ATOM 1879 CA GLU A 138 -9.934 -3.061 7.744 1.00 55.22 C ATOM 1880 C GLU A 138 -9.038 -3.979 8.590 1.00 41.21 C ATOM 1881 O GLU A 138 -9.454 -4.485 9.633 1.00 2.25 O ATOM 1882 CB GLU A 138 -10.440 -1.891 8.604 1.00 22.21 C ATOM 1883 CG GLU A 138 -11.446 -0.967 7.906 1.00 15.34 C ATOM 1884 CD GLU A 138 -12.895 -1.409 8.088 1.00 23.34 C ATOM 1885 OE1 GLU A 138 -13.330 -2.363 7.411 1.00 20.20 O ATOM 1886 OE2 GLU A 138 -13.602 -0.816 8.928 1.00 25.22 O ATOM 0 H GLU A 138 -11.871 -3.869 7.778 1.00 60.23 H new ATOM 0 HA GLU A 138 -9.347 -2.660 6.918 1.00 55.22 H new ATOM 0 HB2 GLU A 138 -10.903 -2.294 9.505 1.00 22.21 H new ATOM 0 HB3 GLU A 138 -9.584 -1.297 8.924 1.00 22.21 H new ATOM 0 HG2 GLU A 138 -11.330 0.045 8.294 1.00 15.34 H new ATOM 0 HG3 GLU A 138 -11.216 -0.928 6.841 1.00 15.34 H new ATOM 1893 N ARG A 139 -7.811 -4.195 8.132 1.00 43.25 N ATOM 1894 CA ARG A 139 -6.858 -5.063 8.834 1.00 42.13 C ATOM 1895 C ARG A 139 -5.858 -4.245 9.669 1.00 20.23 C ATOM 1896 O ARG A 139 -5.100 -3.431 9.137 1.00 22.14 O ATOM 1897 CB ARG A 139 -6.125 -5.956 7.819 1.00 72.45 C ATOM 1898 CG ARG A 139 -4.914 -6.696 8.382 1.00 21.32 C ATOM 1899 CD ARG A 139 -4.409 -7.773 7.422 1.00 2.32 C ATOM 1900 NE ARG A 139 -5.232 -8.985 7.470 1.00 4.44 N ATOM 1901 CZ ARG A 139 -5.503 -9.738 6.435 1.00 72.41 C ATOM 1902 NH1 ARG A 139 -5.190 -9.363 5.239 1.00 31.44 N ATOM 1903 NH2 ARG A 139 -6.153 -10.842 6.594 1.00 52.31 N ATOM 0 H ARG A 139 -7.446 -3.781 7.274 1.00 43.25 H new ATOM 0 HA ARG A 139 -7.414 -5.694 9.527 1.00 42.13 H new ATOM 0 HB2 ARG A 139 -6.829 -6.687 7.423 1.00 72.45 H new ATOM 0 HB3 ARG A 139 -5.800 -5.340 6.981 1.00 72.45 H new ATOM 0 HG2 ARG A 139 -4.114 -5.984 8.582 1.00 21.32 H new ATOM 0 HG3 ARG A 139 -5.179 -7.154 9.335 1.00 21.32 H new ATOM 0 HD2 ARG A 139 -4.404 -7.379 6.406 1.00 2.32 H new ATOM 0 HD3 ARG A 139 -3.378 -8.025 7.671 1.00 2.32 H new ATOM 0 HE ARG A 139 -5.620 -9.260 8.372 1.00 4.44 H new ATOM 0 HH11 ARG A 139 -4.724 -8.468 5.091 1.00 31.44 H new ATOM 0 HH12 ARG A 139 -5.409 -9.962 4.443 1.00 31.44 H new ATOM 0 HH21 ARG A 139 -6.455 -11.126 7.526 1.00 52.31 H new ATOM 0 HH22 ARG A 139 -6.365 -11.430 5.788 1.00 52.31 H new ATOM 1917 N THR A 140 -5.860 -4.474 10.982 1.00 0.15 N ATOM 1918 CA THR A 140 -4.973 -3.750 11.903 1.00 71.24 C ATOM 1919 C THR A 140 -3.697 -4.559 12.179 1.00 70.22 C ATOM 1920 O THR A 140 -3.675 -5.433 13.050 1.00 51.10 O ATOM 1921 CB THR A 140 -5.678 -3.450 13.252 1.00 0.05 C ATOM 1922 OG1 THR A 140 -6.953 -2.830 13.016 1.00 1.20 O ATOM 1923 CG2 THR A 140 -4.824 -2.542 14.132 1.00 45.45 C ATOM 0 H THR A 140 -6.467 -5.157 11.436 1.00 0.15 H new ATOM 0 HA THR A 140 -4.714 -2.807 11.421 1.00 71.24 H new ATOM 0 HB THR A 140 -5.822 -4.397 13.772 1.00 0.05 H new ATOM 0 HG1 THR A 140 -7.391 -2.646 13.873 1.00 1.20 H new ATOM 0 HG21 THR A 140 -5.345 -2.350 15.070 1.00 45.45 H new ATOM 0 HG22 THR A 140 -3.871 -3.028 14.339 1.00 45.45 H new ATOM 0 HG23 THR A 140 -4.646 -1.598 13.616 1.00 45.45 H new ATOM 1931 N ILE A 141 -2.645 -4.285 11.420 1.00 53.12 N ATOM 1932 CA ILE A 141 -1.379 -5.014 11.553 1.00 52.20 C ATOM 1933 C ILE A 141 -0.518 -4.436 12.688 1.00 31.54 C ATOM 1934 O ILE A 141 -0.331 -3.224 12.776 1.00 72.42 O ATOM 1935 CB ILE A 141 -0.579 -4.973 10.227 1.00 32.31 C ATOM 1936 CG1 ILE A 141 -1.449 -5.486 9.064 1.00 21.12 C ATOM 1937 CG2 ILE A 141 0.704 -5.795 10.345 1.00 25.43 C ATOM 1938 CD1 ILE A 141 -0.762 -5.458 7.714 1.00 31.23 C ATOM 0 H ILE A 141 -2.638 -3.561 10.701 1.00 53.12 H new ATOM 0 HA ILE A 141 -1.624 -6.049 11.793 1.00 52.20 H new ATOM 0 HB ILE A 141 -0.301 -3.939 10.022 1.00 32.31 H new ATOM 0 HG12 ILE A 141 -1.758 -6.509 9.280 1.00 21.12 H new ATOM 0 HG13 ILE A 141 -2.356 -4.883 9.010 1.00 21.12 H new ATOM 0 HG21 ILE A 141 1.251 -5.753 9.403 1.00 25.43 H new ATOM 0 HG22 ILE A 141 1.325 -5.388 11.143 1.00 25.43 H new ATOM 0 HG23 ILE A 141 0.453 -6.831 10.573 1.00 25.43 H new ATOM 0 HD11 ILE A 141 -1.443 -5.835 6.951 1.00 31.23 H new ATOM 0 HD12 ILE A 141 -0.477 -4.434 7.472 1.00 31.23 H new ATOM 0 HD13 ILE A 141 0.129 -6.085 7.746 1.00 31.23 H new ATOM 1950 N SER A 142 -0.001 -5.306 13.554 1.00 4.20 N ATOM 1951 CA SER A 142 0.851 -4.875 14.679 1.00 32.35 C ATOM 1952 C SER A 142 2.141 -4.204 14.183 1.00 60.13 C ATOM 1953 O SER A 142 2.645 -4.537 13.114 1.00 54.13 O ATOM 1954 CB SER A 142 1.200 -6.075 15.571 1.00 41.23 C ATOM 1955 OG SER A 142 0.028 -6.759 15.989 1.00 34.03 O ATOM 0 H SER A 142 -0.152 -6.313 13.505 1.00 4.20 H new ATOM 0 HA SER A 142 0.288 -4.143 15.259 1.00 32.35 H new ATOM 0 HB2 SER A 142 1.850 -6.760 15.027 1.00 41.23 H new ATOM 0 HB3 SER A 142 1.756 -5.734 16.444 1.00 41.23 H new ATOM 0 HG SER A 142 0.277 -7.520 16.554 1.00 34.03 H new ATOM 1961 N ALA A 143 2.672 -3.266 14.974 1.00 60.34 N ATOM 1962 CA ALA A 143 3.865 -2.491 14.589 1.00 74.20 C ATOM 1963 C ALA A 143 5.021 -3.383 14.095 1.00 62.14 C ATOM 1964 O ALA A 143 5.582 -3.152 13.017 1.00 21.40 O ATOM 1965 CB ALA A 143 4.331 -1.629 15.761 1.00 21.02 C ATOM 0 H ALA A 143 2.295 -3.021 15.890 1.00 60.34 H new ATOM 0 HA ALA A 143 3.575 -1.854 13.754 1.00 74.20 H new ATOM 0 HB1 ALA A 143 5.213 -1.060 15.466 1.00 21.02 H new ATOM 0 HB2 ALA A 143 3.535 -0.942 16.046 1.00 21.02 H new ATOM 0 HB3 ALA A 143 4.578 -2.269 16.608 1.00 21.02 H new ATOM 1971 N GLY A 144 5.363 -4.400 14.888 1.00 45.03 N ATOM 1972 CA GLY A 144 6.447 -5.317 14.532 1.00 61.10 C ATOM 1973 C GLY A 144 6.245 -6.005 13.181 1.00 73.00 C ATOM 1974 O GLY A 144 7.147 -6.020 12.337 1.00 70.13 O ATOM 0 H GLY A 144 4.908 -4.609 15.777 1.00 45.03 H new ATOM 0 HA2 GLY A 144 7.387 -4.766 14.513 1.00 61.10 H new ATOM 0 HA3 GLY A 144 6.539 -6.077 15.308 1.00 61.10 H new ATOM 1978 N GLU A 145 5.059 -6.574 12.981 1.00 71.10 N ATOM 1979 CA GLU A 145 4.719 -7.266 11.733 1.00 23.32 C ATOM 1980 C GLU A 145 4.613 -6.278 10.558 1.00 72.30 C ATOM 1981 O GLU A 145 5.050 -6.566 9.442 1.00 61.23 O ATOM 1982 CB GLU A 145 3.397 -8.032 11.914 1.00 74.54 C ATOM 1983 CG GLU A 145 2.989 -8.881 10.713 1.00 70.33 C ATOM 1984 CD GLU A 145 1.732 -9.698 10.976 1.00 32.20 C ATOM 1985 OE1 GLU A 145 1.847 -10.835 11.484 1.00 54.23 O ATOM 1986 OE2 GLU A 145 0.621 -9.213 10.681 1.00 54.05 O ATOM 0 H GLU A 145 4.309 -6.571 13.672 1.00 71.10 H new ATOM 0 HA GLU A 145 5.516 -7.971 11.498 1.00 23.32 H new ATOM 0 HB2 GLU A 145 3.483 -8.678 12.788 1.00 74.54 H new ATOM 0 HB3 GLU A 145 2.602 -7.316 12.124 1.00 74.54 H new ATOM 0 HG2 GLU A 145 2.823 -8.232 9.853 1.00 70.33 H new ATOM 0 HG3 GLU A 145 3.807 -9.553 10.452 1.00 70.33 H new ATOM 1993 N ALA A 146 4.056 -5.101 10.832 1.00 75.02 N ATOM 1994 CA ALA A 146 3.879 -4.057 9.815 1.00 43.45 C ATOM 1995 C ALA A 146 5.221 -3.545 9.270 1.00 51.31 C ATOM 1996 O ALA A 146 5.363 -3.291 8.073 1.00 23.42 O ATOM 1997 CB ALA A 146 3.075 -2.901 10.397 1.00 15.23 C ATOM 0 H ALA A 146 3.715 -4.841 11.758 1.00 75.02 H new ATOM 0 HA ALA A 146 3.337 -4.499 8.979 1.00 43.45 H new ATOM 0 HB1 ALA A 146 2.946 -2.129 9.638 1.00 15.23 H new ATOM 0 HB2 ALA A 146 2.097 -3.262 10.716 1.00 15.23 H new ATOM 0 HB3 ALA A 146 3.605 -2.484 11.253 1.00 15.23 H new ATOM 2003 N SER A 147 6.210 -3.414 10.155 1.00 75.14 N ATOM 2004 CA SER A 147 7.546 -2.917 9.777 1.00 64.11 C ATOM 2005 C SER A 147 8.236 -3.823 8.743 1.00 42.13 C ATOM 2006 O SER A 147 9.256 -3.447 8.159 1.00 14.11 O ATOM 2007 CB SER A 147 8.434 -2.790 11.026 1.00 33.35 C ATOM 2008 OG SER A 147 9.749 -2.347 10.700 1.00 10.42 O ATOM 0 H SER A 147 6.116 -3.645 11.144 1.00 75.14 H new ATOM 0 HA SER A 147 7.407 -1.939 9.317 1.00 64.11 H new ATOM 0 HB2 SER A 147 7.978 -2.090 11.726 1.00 33.35 H new ATOM 0 HB3 SER A 147 8.490 -3.754 11.531 1.00 33.35 H new ATOM 0 HG SER A 147 9.931 -2.530 9.754 1.00 10.42 H new ATOM 2014 N SER A 148 7.688 -5.016 8.522 1.00 14.32 N ATOM 2015 CA SER A 148 8.247 -5.957 7.539 1.00 45.14 C ATOM 2016 C SER A 148 7.787 -5.629 6.110 1.00 21.33 C ATOM 2017 O SER A 148 8.347 -6.137 5.135 1.00 12.13 O ATOM 2018 CB SER A 148 7.841 -7.396 7.888 1.00 4.00 C ATOM 2019 OG SER A 148 8.355 -8.333 6.947 1.00 35.41 O ATOM 0 H SER A 148 6.859 -5.359 9.007 1.00 14.32 H new ATOM 0 HA SER A 148 9.332 -5.860 7.579 1.00 45.14 H new ATOM 0 HB2 SER A 148 8.205 -7.645 8.885 1.00 4.00 H new ATOM 0 HB3 SER A 148 6.754 -7.470 7.918 1.00 4.00 H new ATOM 0 HG SER A 148 8.633 -7.861 6.134 1.00 35.41 H new ATOM 2025 N TYR A 149 6.771 -4.780 5.989 1.00 72.14 N ATOM 2026 CA TYR A 149 6.177 -4.458 4.685 1.00 34.11 C ATOM 2027 C TYR A 149 6.744 -3.152 4.100 1.00 31.35 C ATOM 2028 O TYR A 149 7.157 -2.251 4.831 1.00 64.50 O ATOM 2029 CB TYR A 149 4.652 -4.366 4.815 1.00 25.40 C ATOM 2030 CG TYR A 149 4.020 -5.619 5.408 1.00 22.14 C ATOM 2031 CD1 TYR A 149 4.196 -6.862 4.807 1.00 25.31 C ATOM 2032 CD2 TYR A 149 3.254 -5.558 6.569 1.00 15.41 C ATOM 2033 CE1 TYR A 149 3.624 -8.003 5.340 1.00 53.43 C ATOM 2034 CE2 TYR A 149 2.681 -6.696 7.107 1.00 44.53 C ATOM 2035 CZ TYR A 149 2.871 -7.916 6.491 1.00 40.14 C ATOM 2036 OH TYR A 149 2.299 -9.052 7.023 1.00 35.34 O ATOM 0 H TYR A 149 6.337 -4.299 6.777 1.00 72.14 H new ATOM 0 HA TYR A 149 6.435 -5.261 3.995 1.00 34.11 H new ATOM 0 HB2 TYR A 149 4.399 -3.509 5.440 1.00 25.40 H new ATOM 0 HB3 TYR A 149 4.221 -4.181 3.831 1.00 25.40 H new ATOM 0 HD1 TYR A 149 4.790 -6.937 3.908 1.00 25.31 H new ATOM 0 HD2 TYR A 149 3.105 -4.606 7.058 1.00 15.41 H new ATOM 0 HE1 TYR A 149 3.767 -8.958 4.856 1.00 53.43 H new ATOM 0 HE2 TYR A 149 2.087 -6.630 8.006 1.00 44.53 H new ATOM 0 HH TYR A 149 1.802 -8.819 7.835 1.00 35.34 H new ATOM 2046 N ASN A 150 6.761 -3.062 2.770 1.00 0.11 N ATOM 2047 CA ASN A 150 7.291 -1.881 2.071 1.00 50.14 C ATOM 2048 C ASN A 150 6.193 -0.832 1.833 1.00 74.13 C ATOM 2049 O ASN A 150 5.244 -1.081 1.091 1.00 64.43 O ATOM 2050 CB ASN A 150 7.898 -2.303 0.728 1.00 64.15 C ATOM 2051 CG ASN A 150 8.974 -3.360 0.880 1.00 61.34 C ATOM 2052 OD1 ASN A 150 9.689 -3.398 1.875 1.00 54.41 O ATOM 2053 ND2 ASN A 150 9.088 -4.234 -0.098 1.00 0.01 N ATOM 0 H ASN A 150 6.414 -3.793 2.149 1.00 0.11 H new ATOM 0 HA ASN A 150 8.060 -1.433 2.701 1.00 50.14 H new ATOM 0 HB2 ASN A 150 7.108 -2.684 0.081 1.00 64.15 H new ATOM 0 HB3 ASN A 150 8.321 -1.428 0.234 1.00 64.15 H new ATOM 0 HD21 ASN A 150 9.789 -4.973 -0.042 1.00 0.01 H new ATOM 0 HD22 ASN A 150 8.476 -4.172 -0.911 1.00 0.01 H new ATOM 2060 N TYR A 151 6.332 0.338 2.451 1.00 51.02 N ATOM 2061 CA TYR A 151 5.339 1.410 2.310 1.00 54.33 C ATOM 2062 C TYR A 151 5.726 2.407 1.206 1.00 64.52 C ATOM 2063 O TYR A 151 6.703 3.150 1.335 1.00 2.51 O ATOM 2064 CB TYR A 151 5.161 2.154 3.641 1.00 31.23 C ATOM 2065 CG TYR A 151 4.577 1.297 4.749 1.00 0.42 C ATOM 2066 CD1 TYR A 151 5.397 0.535 5.575 1.00 33.21 C ATOM 2067 CD2 TYR A 151 3.204 1.248 4.964 1.00 32.41 C ATOM 2068 CE1 TYR A 151 4.865 -0.248 6.583 1.00 24.15 C ATOM 2069 CE2 TYR A 151 2.667 0.469 5.970 1.00 11.11 C ATOM 2070 CZ TYR A 151 3.499 -0.279 6.775 1.00 31.04 C ATOM 2071 OH TYR A 151 2.962 -1.054 7.775 1.00 72.54 O ATOM 0 H TYR A 151 7.120 0.572 3.055 1.00 51.02 H new ATOM 0 HA TYR A 151 4.396 0.942 2.026 1.00 54.33 H new ATOM 0 HB2 TYR A 151 6.129 2.539 3.964 1.00 31.23 H new ATOM 0 HB3 TYR A 151 4.513 3.016 3.481 1.00 31.23 H new ATOM 0 HD1 TYR A 151 6.467 0.555 5.427 1.00 33.21 H new ATOM 0 HD2 TYR A 151 2.547 1.829 4.334 1.00 32.41 H new ATOM 0 HE1 TYR A 151 5.515 -0.832 7.217 1.00 24.15 H new ATOM 0 HE2 TYR A 151 1.598 0.446 6.125 1.00 11.11 H new ATOM 0 HH TYR A 151 2.142 -1.482 7.452 1.00 72.54 H new ATOM 2081 N ILE A 152 4.952 2.417 0.125 1.00 5.42 N ATOM 2082 CA ILE A 152 5.148 3.375 -0.964 1.00 14.21 C ATOM 2083 C ILE A 152 4.547 4.742 -0.600 1.00 72.44 C ATOM 2084 O ILE A 152 3.352 4.854 -0.321 1.00 1.53 O ATOM 2085 CB ILE A 152 4.517 2.886 -2.303 1.00 61.34 C ATOM 2086 CG1 ILE A 152 5.146 1.555 -2.769 1.00 64.23 C ATOM 2087 CG2 ILE A 152 4.660 3.955 -3.392 1.00 21.22 C ATOM 2088 CD1 ILE A 152 4.647 0.333 -2.022 1.00 5.24 C ATOM 0 H ILE A 152 4.178 1.769 -0.023 1.00 5.42 H new ATOM 0 HA ILE A 152 6.225 3.466 -1.105 1.00 14.21 H new ATOM 0 HB ILE A 152 3.456 2.711 -2.123 1.00 61.34 H new ATOM 0 HG12 ILE A 152 4.944 1.424 -3.832 1.00 64.23 H new ATOM 0 HG13 ILE A 152 6.228 1.619 -2.656 1.00 64.23 H new ATOM 0 HG21 ILE A 152 4.213 3.593 -4.318 1.00 21.22 H new ATOM 0 HG22 ILE A 152 4.152 4.866 -3.076 1.00 21.22 H new ATOM 0 HG23 ILE A 152 5.716 4.167 -3.558 1.00 21.22 H new ATOM 0 HD11 ILE A 152 5.139 -0.558 -2.412 1.00 5.24 H new ATOM 0 HD12 ILE A 152 4.873 0.438 -0.961 1.00 5.24 H new ATOM 0 HD13 ILE A 152 3.569 0.240 -2.156 1.00 5.24 H new ATOM 2100 N HIS A 153 5.389 5.771 -0.600 1.00 74.15 N ATOM 2101 CA HIS A 153 4.958 7.146 -0.318 1.00 23.41 C ATOM 2102 C HIS A 153 5.090 8.007 -1.583 1.00 65.50 C ATOM 2103 O HIS A 153 6.094 7.933 -2.295 1.00 31.40 O ATOM 2104 CB HIS A 153 5.795 7.757 0.820 1.00 32.34 C ATOM 2105 CG HIS A 153 5.715 7.002 2.114 1.00 4.33 C ATOM 2106 ND1 HIS A 153 4.875 7.358 3.149 1.00 61.53 N ATOM 2107 CD2 HIS A 153 6.393 5.912 2.547 1.00 14.51 C ATOM 2108 CE1 HIS A 153 5.042 6.526 4.158 1.00 33.44 C ATOM 2109 NE2 HIS A 153 5.954 5.637 3.821 1.00 12.52 N ATOM 0 H HIS A 153 6.386 5.681 -0.794 1.00 74.15 H new ATOM 0 HA HIS A 153 3.914 7.122 -0.006 1.00 23.41 H new ATOM 0 HB2 HIS A 153 6.837 7.806 0.504 1.00 32.34 H new ATOM 0 HB3 HIS A 153 5.465 8.782 0.989 1.00 32.34 H new ATOM 0 HD2 HIS A 153 7.140 5.361 1.994 1.00 14.51 H new ATOM 0 HE1 HIS A 153 4.519 6.566 5.102 1.00 33.44 H new ATOM 0 HE2 HIS A 153 6.281 4.870 4.409 1.00 12.52 H new ATOM 2118 N LEU A 154 4.079 8.821 -1.857 1.00 23.42 N ATOM 2119 CA LEU A 154 4.044 9.624 -3.084 1.00 0.10 C ATOM 2120 C LEU A 154 4.790 10.958 -2.912 1.00 60.25 C ATOM 2121 O LEU A 154 4.542 11.701 -1.963 1.00 72.11 O ATOM 2122 CB LEU A 154 2.591 9.877 -3.492 1.00 11.23 C ATOM 2123 CG LEU A 154 1.709 8.617 -3.575 1.00 71.32 C ATOM 2124 CD1 LEU A 154 0.303 8.968 -4.056 1.00 12.01 C ATOM 2125 CD2 LEU A 154 2.348 7.558 -4.478 1.00 14.44 C ATOM 0 H LEU A 154 3.269 8.946 -1.249 1.00 23.42 H new ATOM 0 HA LEU A 154 4.552 9.065 -3.870 1.00 0.10 H new ATOM 0 HB2 LEU A 154 2.144 10.569 -2.778 1.00 11.23 H new ATOM 0 HB3 LEU A 154 2.583 10.372 -4.463 1.00 11.23 H new ATOM 0 HG LEU A 154 1.628 8.197 -2.572 1.00 71.32 H new ATOM 0 HD11 LEU A 154 -0.301 8.062 -4.107 1.00 12.01 H new ATOM 0 HD12 LEU A 154 -0.155 9.671 -3.360 1.00 12.01 H new ATOM 0 HD13 LEU A 154 0.360 9.422 -5.045 1.00 12.01 H new ATOM 0 HD21 LEU A 154 1.705 6.679 -4.519 1.00 14.44 H new ATOM 0 HD22 LEU A 154 2.473 7.963 -5.482 1.00 14.44 H new ATOM 0 HD23 LEU A 154 3.322 7.277 -4.076 1.00 14.44 H new ATOM 2137 N ASN A 155 5.693 11.258 -3.844 1.00 3.03 N ATOM 2138 CA ASN A 155 6.473 12.504 -3.810 1.00 43.14 C ATOM 2139 C ASN A 155 6.080 13.439 -4.970 1.00 34.24 C ATOM 2140 O ASN A 155 6.924 14.116 -5.557 1.00 71.11 O ATOM 2141 CB ASN A 155 7.977 12.182 -3.856 1.00 35.44 C ATOM 2142 CG ASN A 155 8.353 11.246 -4.994 1.00 43.04 C ATOM 2143 OD1 ASN A 155 7.695 11.190 -6.022 1.00 32.00 O ATOM 2144 ND2 ASN A 155 9.423 10.499 -4.815 1.00 71.42 N ATOM 0 H ASN A 155 5.907 10.654 -4.638 1.00 3.03 H new ATOM 0 HA ASN A 155 6.251 13.024 -2.878 1.00 43.14 H new ATOM 0 HB2 ASN A 155 8.538 13.111 -3.957 1.00 35.44 H new ATOM 0 HB3 ASN A 155 8.275 11.731 -2.909 1.00 35.44 H new ATOM 0 HD21 ASN A 155 9.722 9.853 -5.545 1.00 71.42 H new ATOM 0 HD22 ASN A 155 9.953 10.567 -3.946 1.00 71.42 H new TER 2151 ASN A 155