USER MOD reduce.3.24.130724 H: found=0, std=0, add=1309, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1309 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 166 HIS : no HD1:sc= -0.176 X(o=-0.33,f=0.034) USER MOD Set 1.2: A 167 HIS : no HD1:sc= -0.158 X(o=-0.33,f=0) USER MOD Set 2.1: A 101 TYR OH : rot 39:sc= 0.173 USER MOD Set 2.2: A 119 GLN : amide:sc= -2.17! K(o=-2!,f=-0.85) USER MOD Set 3.1: A 103 GLN : amide:sc= -3.04! K(o=-4.5!,f=-0.93) USER MOD Set 3.2: A 115 ASN : amide:sc= -0.488 K(o=-4.5,f=-0.93) USER MOD Set 3.3: A 146 GLN : amide:sc= -0.938 K(o=-4.5,f=-0.93) USER MOD Set 4.1: A 96 SER OG : rot 140:sc= 0.559 USER MOD Set 4.2: A 122 ASN : amide:sc= 0.621 K(o=1.2,f=1.8) USER MOD Set 5.1: A 88 SER OG : rot 97:sc= 0.699 USER MOD Set 5.2: A 131 SER OG : rot 96:sc= -0.646 USER MOD Set 6.1: A 70 ASN : amide:sc= -0.0797 X(o=0.28,f=0.4) USER MOD Set 6.2: A 81 THR OG1 : rot -140:sc= 0.36 USER MOD Set 7.1: A 42 SER OG : rot 180:sc= 0 USER MOD Set 7.2: A 43 SER OG : rot 180:sc= 0 USER MOD Set 8.1: A 34 GLN : amide:sc= 0.771 K(o=0.77,f=-4.1!) USER MOD Set 8.2: A 53 THR OG1 : rot 180:sc= 0.0031 USER MOD Set 9.1: A 30 LYS NZ :NH3+ 141:sc= 1.13 (180deg=-0.286) USER MOD Set 9.2: A 33 GLN : amide:sc= -2.23! C(o=-1.1!,f=-14!) USER MOD Single : A 1 MET CE :methyl 161:sc= -0.111 (180deg=-0.575) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 GLN : amide:sc=-0.00122 X(o=-0.0012,f=-0.028) USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= -0.0365 X(o=-0.036,f=-0.042) USER MOD Single : A 10 MET CE :methyl -159:sc= -0.149 (180deg=-0.673) USER MOD Single : A 11 LYS NZ :NH3+ -172:sc=-0.00205 (180deg=-0.0647) USER MOD Single : A 12 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 13 SER OG : rot 33:sc= 0.277 USER MOD Single : A 15 SER OG : rot 39:sc= 0.53 USER MOD Single : A 16 THR OG1 : rot 38:sc= 0.591 USER MOD Single : A 18 ASN : amide:sc= 0.276 K(o=0.28,f=-5.8!) USER MOD Single : A 19 GLN : amide:sc= -0.697 K(o=-0.7,f=-2.7) USER MOD Single : A 21 MET CE :methyl 147:sc= -0.749 (180deg=-2.96!) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 ASN : amide:sc= 0 K(o=0,f=-0.52) USER MOD Single : A 26 GLN : amide:sc= 0.41 K(o=0.41,f=-3.8!) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot 71:sc= 0.521 USER MOD Single : A 35 ASN : amide:sc= 1.07 K(o=1.1,f=-0.041) USER MOD Single : A 38 ASN : amide:sc= -0.462 X(o=-0.46,f=-0.029) USER MOD Single : A 40 LYS NZ :NH3+ -169:sc= 1.24 (180deg=0.968) USER MOD Single : A 41 SER OG : rot -132:sc= 0.988 USER MOD Single : A 46 TYR OH : rot -30:sc= 0.876 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 SER OG : rot -44:sc= -0.987! USER MOD Single : A 60 GLN : amide:sc= -0.0243 X(o=-0.024,f=0) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 MET CE :methyl -142:sc= 0 (180deg=-0.724) USER MOD Single : A 67 SER OG : rot 87:sc= 0.237 USER MOD Single : A 72 THR OG1 : rot -67:sc= 0.187 USER MOD Single : A 78 THR OG1 : rot 84:sc= 0.636 USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 GLN : amide:sc= 0.39 X(o=0.39,f=0) USER MOD Single : A 89 ASN : amide:sc= -0.466 X(o=-0.47,f=0.024) USER MOD Single : A 98 THR OG1 : rot 125:sc= 0.259 USER MOD Single : A 105 GLN : amide:sc= -3.06! K(o=-3.1!,f=-1.2) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0.574 USER MOD Single : A 110 ASN : amide:sc= -0.856 K(o=-0.86,f=-0.32) USER MOD Single : A 112 GLN : amide:sc= -0.769 K(o=-0.77,f=0) USER MOD Single : A 117 GLN : amide:sc= -0.293 X(o=-0.29,f=-0.33) USER MOD Single : A 118 ASN : amide:sc= -0.102 X(o=-0.1,f=-0.22) USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 138 GLN : amide:sc=-0.00347 X(o=-0.0035,f=-0.099) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 153 HIS : no HE2:sc= -0.763 K(o=-0.48,f=-5.6!) USER MOD Single : A 156 GLN : amide:sc= -1.01 K(o=-1,f=-0.00048) USER MOD Single : A 159 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 160 GLN : amide:sc= -3.95! C(o=-4!,f=-1.3!) USER MOD Single : A 163 HIS : no HD1:sc= 0 X(o=0,f=-0.074) USER MOD Single : A 164 HIS : no HD1:sc= 0 X(o=0,f=-0.086) USER MOD Single : A 165 HIS : no HD1:sc= -0.186 X(o=-0.19,f=0) USER MOD Single : A 168 HIS : no HE2:sc= -0.529 K(o=-0.53,f=-2.4!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -11.734 -32.443 -41.579 1.00 1.32 N ATOM 2 CA MET A 1 -12.320 -31.889 -40.329 1.00 1.21 C ATOM 3 C MET A 1 -12.042 -32.817 -39.139 1.00 31.02 C ATOM 4 O MET A 1 -12.486 -33.965 -39.124 1.00 42.14 O ATOM 5 CB MET A 1 -13.835 -31.692 -40.505 1.00 23.24 C ATOM 6 CG MET A 1 -14.499 -30.945 -39.357 1.00 64.15 C ATOM 7 SD MET A 1 -13.851 -29.271 -39.156 1.00 1.45 S ATOM 8 CE MET A 1 -14.297 -28.529 -40.728 1.00 54.03 C ATOM 0 H1 MET A 1 -11.934 -31.799 -42.371 1.00 1.32 H new ATOM 0 H2 MET A 1 -10.705 -32.543 -41.465 1.00 1.32 H new ATOM 0 H3 MET A 1 -12.153 -33.374 -41.776 1.00 1.32 H new ATOM 0 HA MET A 1 -11.854 -30.925 -40.125 1.00 1.21 H new ATOM 0 HB2 MET A 1 -14.015 -31.147 -41.432 1.00 23.24 H new ATOM 0 HB3 MET A 1 -14.308 -32.668 -40.612 1.00 23.24 H new ATOM 0 HG2 MET A 1 -15.574 -30.897 -39.532 1.00 64.15 H new ATOM 0 HG3 MET A 1 -14.352 -31.502 -38.432 1.00 64.15 H new ATOM 0 HE1 MET A 1 -14.276 -27.443 -40.637 1.00 54.03 H new ATOM 0 HE2 MET A 1 -13.587 -28.843 -41.493 1.00 54.03 H new ATOM 0 HE3 MET A 1 -15.300 -28.850 -41.011 1.00 54.03 H new ATOM 20 N VAL A 2 -11.302 -32.320 -38.147 1.00 10.33 N ATOM 21 CA VAL A 2 -10.942 -33.121 -36.967 1.00 43.31 C ATOM 22 C VAL A 2 -11.673 -32.637 -35.703 1.00 42.31 C ATOM 23 O VAL A 2 -12.372 -31.625 -35.723 1.00 12.32 O ATOM 24 CB VAL A 2 -9.413 -33.086 -36.714 1.00 25.42 C ATOM 25 CG1 VAL A 2 -8.652 -33.646 -37.915 1.00 12.33 C ATOM 26 CG2 VAL A 2 -8.947 -31.666 -36.388 1.00 24.01 C ATOM 0 H VAL A 2 -10.938 -31.367 -38.133 1.00 10.33 H new ATOM 0 HA VAL A 2 -11.251 -34.144 -37.179 1.00 43.31 H new ATOM 0 HB VAL A 2 -9.198 -33.718 -35.852 1.00 25.42 H new ATOM 0 HG11 VAL A 2 -7.581 -33.612 -37.715 1.00 12.33 H new ATOM 0 HG12 VAL A 2 -8.956 -34.678 -38.089 1.00 12.33 H new ATOM 0 HG13 VAL A 2 -8.876 -33.048 -38.798 1.00 12.33 H new ATOM 0 HG21 VAL A 2 -7.871 -31.667 -36.214 1.00 24.01 H new ATOM 0 HG22 VAL A 2 -9.179 -31.006 -37.224 1.00 24.01 H new ATOM 0 HG23 VAL A 2 -9.458 -31.312 -35.493 1.00 24.01 H new ATOM 36 N GLN A 3 -11.509 -33.373 -34.605 1.00 41.34 N ATOM 37 CA GLN A 3 -12.138 -33.018 -33.326 1.00 72.25 C ATOM 38 C GLN A 3 -11.259 -33.447 -32.136 1.00 15.21 C ATOM 39 O GLN A 3 -11.175 -34.632 -31.800 1.00 65.20 O ATOM 40 CB GLN A 3 -13.532 -33.664 -33.227 1.00 71.45 C ATOM 41 CG GLN A 3 -14.250 -33.431 -31.897 1.00 4.30 C ATOM 42 CD GLN A 3 -14.461 -31.960 -31.568 1.00 0.32 C ATOM 43 OE1 GLN A 3 -13.640 -31.328 -30.906 1.00 74.32 O ATOM 44 NE2 GLN A 3 -15.561 -31.400 -32.028 1.00 0.14 N ATOM 0 H GLN A 3 -10.945 -34.222 -34.572 1.00 41.34 H new ATOM 0 HA GLN A 3 -12.246 -31.934 -33.287 1.00 72.25 H new ATOM 0 HB2 GLN A 3 -14.155 -33.277 -34.034 1.00 71.45 H new ATOM 0 HB3 GLN A 3 -13.433 -34.737 -33.388 1.00 71.45 H new ATOM 0 HG2 GLN A 3 -15.218 -33.931 -31.924 1.00 4.30 H new ATOM 0 HG3 GLN A 3 -13.674 -33.895 -31.096 1.00 4.30 H new ATOM 0 HE21 GLN A 3 -16.223 -31.950 -32.574 1.00 0.14 H new ATOM 0 HE22 GLN A 3 -15.750 -30.416 -31.838 1.00 0.14 H new ATOM 53 N GLN A 4 -10.592 -32.478 -31.512 1.00 70.33 N ATOM 54 CA GLN A 4 -9.730 -32.746 -30.357 1.00 13.45 C ATOM 55 C GLN A 4 -10.389 -32.281 -29.049 1.00 71.01 C ATOM 56 O GLN A 4 -10.393 -31.092 -28.731 1.00 1.40 O ATOM 57 CB GLN A 4 -8.368 -32.057 -30.536 1.00 34.23 C ATOM 58 CG GLN A 4 -7.592 -32.536 -31.759 1.00 74.45 C ATOM 59 CD GLN A 4 -6.238 -31.858 -31.899 1.00 42.31 C ATOM 60 OE1 GLN A 4 -6.108 -30.816 -32.537 1.00 1.53 O ATOM 61 NE2 GLN A 4 -5.219 -32.439 -31.303 1.00 32.22 N ATOM 0 H GLN A 4 -10.631 -31.496 -31.786 1.00 70.33 H new ATOM 0 HA GLN A 4 -9.579 -33.824 -30.296 1.00 13.45 H new ATOM 0 HB2 GLN A 4 -8.523 -30.981 -30.614 1.00 34.23 H new ATOM 0 HB3 GLN A 4 -7.765 -32.228 -29.644 1.00 34.23 H new ATOM 0 HG2 GLN A 4 -7.448 -33.614 -31.693 1.00 74.45 H new ATOM 0 HG3 GLN A 4 -8.183 -32.347 -32.656 1.00 74.45 H new ATOM 0 HE21 GLN A 4 -5.359 -33.304 -30.781 1.00 32.22 H new ATOM 0 HE22 GLN A 4 -4.289 -32.025 -31.363 1.00 32.22 H new ATOM 70 N SER A 5 -10.966 -33.221 -28.303 1.00 21.31 N ATOM 71 CA SER A 5 -11.560 -32.913 -26.997 1.00 33.23 C ATOM 72 C SER A 5 -10.528 -33.091 -25.879 1.00 63.32 C ATOM 73 O SER A 5 -10.322 -34.198 -25.382 1.00 73.23 O ATOM 74 CB SER A 5 -12.779 -33.808 -26.728 1.00 3.33 C ATOM 75 OG SER A 5 -13.791 -33.619 -27.710 1.00 23.33 O ATOM 0 H SER A 5 -11.036 -34.201 -28.577 1.00 21.31 H new ATOM 0 HA SER A 5 -11.886 -31.873 -27.014 1.00 33.23 H new ATOM 0 HB2 SER A 5 -12.470 -34.853 -26.719 1.00 3.33 H new ATOM 0 HB3 SER A 5 -13.183 -33.587 -25.740 1.00 3.33 H new ATOM 0 HG SER A 5 -14.552 -34.204 -27.512 1.00 23.33 H new ATOM 81 N GLU A 6 -9.865 -31.998 -25.498 1.00 41.42 N ATOM 82 CA GLU A 6 -8.777 -32.056 -24.513 1.00 34.54 C ATOM 83 C GLU A 6 -8.878 -30.920 -23.482 1.00 20.32 C ATOM 84 O GLU A 6 -9.167 -29.775 -23.830 1.00 65.44 O ATOM 85 CB GLU A 6 -7.422 -31.972 -25.232 1.00 4.24 C ATOM 86 CG GLU A 6 -7.244 -33.005 -26.341 1.00 54.31 C ATOM 87 CD GLU A 6 -5.918 -32.865 -27.068 1.00 32.55 C ATOM 88 OE1 GLU A 6 -5.701 -31.820 -27.713 1.00 71.13 O ATOM 89 OE2 GLU A 6 -5.086 -33.793 -26.997 1.00 75.31 O ATOM 0 H GLU A 6 -10.060 -31.062 -25.854 1.00 41.42 H new ATOM 0 HA GLU A 6 -8.863 -33.003 -23.981 1.00 34.54 H new ATOM 0 HB2 GLU A 6 -7.309 -30.975 -25.657 1.00 4.24 H new ATOM 0 HB3 GLU A 6 -6.625 -32.099 -24.500 1.00 4.24 H new ATOM 0 HG2 GLU A 6 -7.315 -34.005 -25.914 1.00 54.31 H new ATOM 0 HG3 GLU A 6 -8.059 -32.905 -27.058 1.00 54.31 H new ATOM 96 N VAL A 7 -8.639 -31.250 -22.214 1.00 34.22 N ATOM 97 CA VAL A 7 -8.610 -30.259 -21.126 1.00 74.42 C ATOM 98 C VAL A 7 -7.441 -30.546 -20.168 1.00 31.03 C ATOM 99 O VAL A 7 -7.140 -31.704 -19.878 1.00 53.34 O ATOM 100 CB VAL A 7 -9.942 -30.255 -20.319 1.00 41.15 C ATOM 101 CG1 VAL A 7 -9.859 -29.309 -19.119 1.00 13.31 C ATOM 102 CG2 VAL A 7 -11.123 -29.881 -21.214 1.00 13.24 C ATOM 0 H VAL A 7 -8.460 -32.206 -21.907 1.00 34.22 H new ATOM 0 HA VAL A 7 -8.478 -29.279 -21.585 1.00 74.42 H new ATOM 0 HB VAL A 7 -10.103 -31.266 -19.944 1.00 41.15 H new ATOM 0 HG11 VAL A 7 -10.803 -29.328 -18.575 1.00 13.31 H new ATOM 0 HG12 VAL A 7 -9.053 -29.629 -18.458 1.00 13.31 H new ATOM 0 HG13 VAL A 7 -9.661 -28.295 -19.468 1.00 13.31 H new ATOM 0 HG21 VAL A 7 -12.041 -29.886 -20.626 1.00 13.24 H new ATOM 0 HG22 VAL A 7 -10.964 -28.886 -21.630 1.00 13.24 H new ATOM 0 HG23 VAL A 7 -11.208 -30.604 -22.025 1.00 13.24 H new ATOM 112 N ARG A 8 -6.773 -29.494 -19.691 1.00 11.20 N ATOM 113 CA ARG A 8 -5.673 -29.652 -18.726 1.00 12.34 C ATOM 114 C ARG A 8 -5.995 -28.955 -17.393 1.00 20.40 C ATOM 115 O ARG A 8 -6.580 -27.871 -17.370 1.00 63.44 O ATOM 116 CB ARG A 8 -4.344 -29.117 -19.293 1.00 3.52 C ATOM 117 CG ARG A 8 -4.319 -27.615 -19.575 1.00 21.21 C ATOM 118 CD ARG A 8 -5.026 -27.258 -20.877 1.00 42.45 C ATOM 119 NE ARG A 8 -5.027 -25.818 -21.128 1.00 33.20 N ATOM 120 CZ ARG A 8 -5.162 -25.281 -22.309 1.00 41.43 C ATOM 121 NH1 ARG A 8 -5.254 -26.028 -23.360 1.00 44.41 N ATOM 122 NH2 ARG A 8 -5.188 -23.996 -22.442 1.00 35.01 N ATOM 0 H ARG A 8 -6.969 -28.528 -19.952 1.00 11.20 H new ATOM 0 HA ARG A 8 -5.562 -30.720 -18.541 1.00 12.34 H new ATOM 0 HB2 ARG A 8 -3.545 -29.352 -18.589 1.00 3.52 H new ATOM 0 HB3 ARG A 8 -4.121 -29.649 -20.218 1.00 3.52 H new ATOM 0 HG2 ARG A 8 -4.794 -27.085 -18.749 1.00 21.21 H new ATOM 0 HG3 ARG A 8 -3.285 -27.273 -19.620 1.00 21.21 H new ATOM 0 HD2 ARG A 8 -4.537 -27.769 -21.706 1.00 42.45 H new ATOM 0 HD3 ARG A 8 -6.054 -27.620 -20.841 1.00 42.45 H new ATOM 0 HE ARG A 8 -4.915 -25.194 -20.329 1.00 33.20 H new ATOM 0 HH11 ARG A 8 -5.221 -27.043 -23.268 1.00 44.41 H new ATOM 0 HH12 ARG A 8 -5.359 -25.602 -24.281 1.00 44.41 H new ATOM 0 HH21 ARG A 8 -5.103 -23.396 -21.621 1.00 35.01 H new ATOM 0 HH22 ARG A 8 -5.294 -23.581 -23.368 1.00 35.01 H new ATOM 136 N GLN A 9 -5.609 -29.590 -16.287 1.00 62.03 N ATOM 137 CA GLN A 9 -5.861 -29.046 -14.944 1.00 14.12 C ATOM 138 C GLN A 9 -4.599 -28.399 -14.344 1.00 70.52 C ATOM 139 O GLN A 9 -3.566 -29.050 -14.191 1.00 51.14 O ATOM 140 CB GLN A 9 -6.364 -30.155 -14.008 1.00 61.33 C ATOM 141 CG GLN A 9 -7.713 -30.753 -14.406 1.00 72.12 C ATOM 142 CD GLN A 9 -8.847 -29.740 -14.376 1.00 40.54 C ATOM 143 OE1 GLN A 9 -9.169 -29.108 -15.377 1.00 0.15 O ATOM 144 NE2 GLN A 9 -9.456 -29.564 -13.221 1.00 44.33 N ATOM 0 H GLN A 9 -5.119 -30.485 -16.290 1.00 62.03 H new ATOM 0 HA GLN A 9 -6.624 -28.274 -15.043 1.00 14.12 H new ATOM 0 HB2 GLN A 9 -5.622 -30.952 -13.977 1.00 61.33 H new ATOM 0 HB3 GLN A 9 -6.442 -29.753 -12.998 1.00 61.33 H new ATOM 0 HG2 GLN A 9 -7.636 -31.173 -15.409 1.00 72.12 H new ATOM 0 HG3 GLN A 9 -7.951 -31.576 -13.733 1.00 72.12 H new ATOM 0 HE21 GLN A 9 -9.167 -30.103 -12.405 1.00 44.33 H new ATOM 0 HE22 GLN A 9 -10.216 -28.888 -13.143 1.00 44.33 H new ATOM 153 N MET A 10 -4.694 -27.118 -14.000 1.00 31.00 N ATOM 154 CA MET A 10 -3.583 -26.390 -13.369 1.00 52.45 C ATOM 155 C MET A 10 -3.780 -26.298 -11.846 1.00 31.52 C ATOM 156 O MET A 10 -4.698 -25.626 -11.371 1.00 40.11 O ATOM 157 CB MET A 10 -3.472 -24.980 -13.966 1.00 51.41 C ATOM 158 CG MET A 10 -3.177 -24.965 -15.462 1.00 51.12 C ATOM 159 SD MET A 10 -1.577 -25.698 -15.864 1.00 54.55 S ATOM 160 CE MET A 10 -0.463 -24.598 -14.984 1.00 71.30 C ATOM 0 H MET A 10 -5.532 -26.555 -14.146 1.00 31.00 H new ATOM 0 HA MET A 10 -2.662 -26.939 -13.564 1.00 52.45 H new ATOM 0 HB2 MET A 10 -4.404 -24.444 -13.784 1.00 51.41 H new ATOM 0 HB3 MET A 10 -2.684 -24.436 -13.445 1.00 51.41 H new ATOM 0 HG2 MET A 10 -3.963 -25.507 -15.989 1.00 51.12 H new ATOM 0 HG3 MET A 10 -3.202 -23.937 -15.823 1.00 51.12 H new ATOM 0 HE1 MET A 10 0.536 -24.672 -15.414 1.00 71.30 H new ATOM 0 HE2 MET A 10 -0.820 -23.572 -15.071 1.00 71.30 H new ATOM 0 HE3 MET A 10 -0.428 -24.881 -13.932 1.00 71.30 H new ATOM 170 N LYS A 11 -2.922 -26.975 -11.079 1.00 21.02 N ATOM 171 CA LYS A 11 -3.049 -26.988 -9.615 1.00 61.02 C ATOM 172 C LYS A 11 -1.725 -27.336 -8.904 1.00 35.05 C ATOM 173 O LYS A 11 -1.112 -28.376 -9.162 1.00 75.04 O ATOM 174 CB LYS A 11 -4.148 -27.977 -9.194 1.00 3.14 C ATOM 175 CG LYS A 11 -4.283 -28.157 -7.683 1.00 61.24 C ATOM 176 CD LYS A 11 -4.583 -26.841 -6.965 1.00 1.13 C ATOM 177 CE LYS A 11 -4.642 -27.028 -5.453 1.00 14.52 C ATOM 178 NZ LYS A 11 -5.780 -27.891 -5.044 1.00 22.51 N ATOM 0 H LYS A 11 -2.138 -27.518 -11.441 1.00 21.02 H new ATOM 0 HA LYS A 11 -3.319 -25.978 -9.308 1.00 61.02 H new ATOM 0 HB2 LYS A 11 -5.102 -27.635 -9.595 1.00 3.14 H new ATOM 0 HB3 LYS A 11 -3.942 -28.947 -9.647 1.00 3.14 H new ATOM 0 HG2 LYS A 11 -5.079 -28.872 -7.474 1.00 61.24 H new ATOM 0 HG3 LYS A 11 -3.361 -28.582 -7.286 1.00 61.24 H new ATOM 0 HD2 LYS A 11 -3.815 -26.108 -7.212 1.00 1.13 H new ATOM 0 HD3 LYS A 11 -5.532 -26.440 -7.320 1.00 1.13 H new ATOM 0 HE2 LYS A 11 -3.708 -27.470 -5.105 1.00 14.52 H new ATOM 0 HE3 LYS A 11 -4.733 -26.055 -4.970 1.00 14.52 H new ATOM 0 HZ1 LYS A 11 -5.866 -27.883 -4.008 1.00 22.51 H new ATOM 0 HZ2 LYS A 11 -6.659 -27.530 -5.467 1.00 22.51 H new ATOM 0 HZ3 LYS A 11 -5.612 -28.864 -5.370 1.00 22.51 H new ATOM 192 N HIS A 12 -1.301 -26.445 -8.008 1.00 75.23 N ATOM 193 CA HIS A 12 -0.145 -26.686 -7.135 1.00 14.02 C ATOM 194 C HIS A 12 -0.107 -25.656 -5.995 1.00 54.41 C ATOM 195 O HIS A 12 0.353 -24.531 -6.178 1.00 21.30 O ATOM 196 CB HIS A 12 1.171 -26.644 -7.928 1.00 12.24 C ATOM 197 CG HIS A 12 2.383 -26.976 -7.105 1.00 71.43 C ATOM 198 ND1 HIS A 12 2.870 -28.258 -6.964 1.00 71.14 N ATOM 199 CD2 HIS A 12 3.208 -26.185 -6.371 1.00 63.23 C ATOM 200 CE1 HIS A 12 3.932 -28.243 -6.185 1.00 23.32 C ATOM 201 NE2 HIS A 12 4.159 -27.003 -5.814 1.00 25.44 N ATOM 0 H HIS A 12 -1.745 -25.538 -7.865 1.00 75.23 H new ATOM 0 HA HIS A 12 -0.253 -27.683 -6.708 1.00 14.02 H new ATOM 0 HB2 HIS A 12 1.105 -27.344 -8.761 1.00 12.24 H new ATOM 0 HB3 HIS A 12 1.295 -25.649 -8.357 1.00 12.24 H new ATOM 0 HD2 HIS A 12 3.130 -25.115 -6.249 1.00 63.23 H new ATOM 0 HE1 HIS A 12 4.517 -29.104 -5.899 1.00 23.32 H new ATOM 0 HE2 HIS A 12 4.921 -26.697 -5.208 1.00 25.44 H new ATOM 210 N SER A 13 -0.604 -26.046 -4.825 1.00 2.02 N ATOM 211 CA SER A 13 -0.638 -25.153 -3.656 1.00 71.10 C ATOM 212 C SER A 13 0.237 -25.682 -2.509 1.00 3.33 C ATOM 213 O SER A 13 0.009 -26.775 -1.982 1.00 44.33 O ATOM 214 CB SER A 13 -2.084 -24.965 -3.165 1.00 71.15 C ATOM 215 OG SER A 13 -2.674 -26.204 -2.788 1.00 63.02 O ATOM 0 H SER A 13 -0.991 -26.974 -4.654 1.00 2.02 H new ATOM 0 HA SER A 13 -0.235 -24.190 -3.971 1.00 71.10 H new ATOM 0 HB2 SER A 13 -2.095 -24.283 -2.315 1.00 71.15 H new ATOM 0 HB3 SER A 13 -2.679 -24.503 -3.952 1.00 71.15 H new ATOM 0 HG SER A 13 -1.985 -26.796 -2.420 1.00 63.02 H new ATOM 221 N VAL A 14 1.247 -24.903 -2.131 1.00 55.24 N ATOM 222 CA VAL A 14 2.115 -25.238 -0.999 1.00 44.33 C ATOM 223 C VAL A 14 2.262 -24.035 -0.050 1.00 10.41 C ATOM 224 O VAL A 14 2.499 -22.905 -0.487 1.00 43.53 O ATOM 225 CB VAL A 14 3.517 -25.719 -1.473 1.00 55.24 C ATOM 226 CG1 VAL A 14 4.212 -24.656 -2.324 1.00 61.40 C ATOM 227 CG2 VAL A 14 4.387 -26.122 -0.280 1.00 2.24 C ATOM 0 H VAL A 14 1.488 -24.027 -2.595 1.00 55.24 H new ATOM 0 HA VAL A 14 1.642 -26.059 -0.460 1.00 44.33 H new ATOM 0 HB VAL A 14 3.372 -26.599 -2.099 1.00 55.24 H new ATOM 0 HG11 VAL A 14 5.189 -25.023 -2.639 1.00 61.40 H new ATOM 0 HG12 VAL A 14 3.605 -24.440 -3.203 1.00 61.40 H new ATOM 0 HG13 VAL A 14 4.339 -23.746 -1.738 1.00 61.40 H new ATOM 0 HG21 VAL A 14 5.362 -26.455 -0.636 1.00 2.24 H new ATOM 0 HG22 VAL A 14 4.516 -25.266 0.382 1.00 2.24 H new ATOM 0 HG23 VAL A 14 3.904 -26.933 0.265 1.00 2.24 H new ATOM 237 N SER A 15 2.095 -24.274 1.250 1.00 31.55 N ATOM 238 CA SER A 15 2.197 -23.204 2.251 1.00 20.34 C ATOM 239 C SER A 15 3.105 -23.609 3.418 1.00 51.11 C ATOM 240 O SER A 15 2.710 -24.367 4.305 1.00 3.20 O ATOM 241 CB SER A 15 0.802 -22.812 2.769 1.00 15.14 C ATOM 242 OG SER A 15 0.123 -23.912 3.359 1.00 70.34 O ATOM 0 H SER A 15 1.889 -25.195 1.637 1.00 31.55 H new ATOM 0 HA SER A 15 2.647 -22.339 1.763 1.00 20.34 H new ATOM 0 HB2 SER A 15 0.900 -22.011 3.502 1.00 15.14 H new ATOM 0 HB3 SER A 15 0.207 -22.419 1.945 1.00 15.14 H new ATOM 0 HG SER A 15 0.761 -24.456 3.867 1.00 70.34 H new ATOM 248 N THR A 16 4.337 -23.108 3.404 1.00 3.45 N ATOM 249 CA THR A 16 5.320 -23.414 4.451 1.00 43.34 C ATOM 250 C THR A 16 5.368 -22.303 5.508 1.00 21.41 C ATOM 251 O THR A 16 5.825 -21.190 5.235 1.00 43.20 O ATOM 252 CB THR A 16 6.741 -23.607 3.861 1.00 51.33 C ATOM 253 OG1 THR A 16 7.144 -22.436 3.131 1.00 51.24 O ATOM 254 CG2 THR A 16 6.793 -24.818 2.934 1.00 3.32 C ATOM 0 H THR A 16 4.685 -22.484 2.676 1.00 3.45 H new ATOM 0 HA THR A 16 4.999 -24.346 4.917 1.00 43.34 H new ATOM 0 HB THR A 16 7.424 -23.772 4.694 1.00 51.33 H new ATOM 0 HG1 THR A 16 6.830 -21.634 3.600 1.00 51.24 H new ATOM 0 HG21 THR A 16 7.802 -24.928 2.535 1.00 3.32 H new ATOM 0 HG22 THR A 16 6.523 -25.715 3.492 1.00 3.32 H new ATOM 0 HG23 THR A 16 6.091 -24.677 2.112 1.00 3.32 H new ATOM 262 N LEU A 17 4.897 -22.611 6.714 1.00 51.43 N ATOM 263 CA LEU A 17 4.860 -21.632 7.804 1.00 33.03 C ATOM 264 C LEU A 17 6.256 -21.435 8.414 1.00 22.31 C ATOM 265 O LEU A 17 6.811 -22.344 9.038 1.00 72.42 O ATOM 266 CB LEU A 17 3.860 -22.066 8.893 1.00 31.54 C ATOM 267 CG LEU A 17 2.370 -22.055 8.491 1.00 61.55 C ATOM 268 CD1 LEU A 17 1.960 -20.683 7.960 1.00 60.42 C ATOM 269 CD2 LEU A 17 2.055 -23.153 7.473 1.00 41.14 C ATOM 0 H LEU A 17 4.535 -23.531 6.964 1.00 51.43 H new ATOM 0 HA LEU A 17 4.530 -20.681 7.387 1.00 33.03 H new ATOM 0 HB2 LEU A 17 4.121 -23.074 9.216 1.00 31.54 H new ATOM 0 HB3 LEU A 17 3.987 -21.412 9.756 1.00 31.54 H new ATOM 0 HG LEU A 17 1.785 -22.262 9.387 1.00 61.55 H new ATOM 0 HD11 LEU A 17 0.906 -20.700 7.683 1.00 60.42 H new ATOM 0 HD12 LEU A 17 2.120 -19.931 8.733 1.00 60.42 H new ATOM 0 HD13 LEU A 17 2.561 -20.437 7.085 1.00 60.42 H new ATOM 0 HD21 LEU A 17 0.997 -23.115 7.213 1.00 41.14 H new ATOM 0 HD22 LEU A 17 2.655 -23.000 6.576 1.00 41.14 H new ATOM 0 HD23 LEU A 17 2.288 -24.127 7.904 1.00 41.14 H new ATOM 281 N ASN A 18 6.813 -20.239 8.240 1.00 72.50 N ATOM 282 CA ASN A 18 8.172 -19.937 8.697 1.00 4.31 C ATOM 283 C ASN A 18 8.220 -19.624 10.202 1.00 5.44 C ATOM 284 O ASN A 18 7.322 -18.983 10.750 1.00 24.32 O ATOM 285 CB ASN A 18 8.752 -18.760 7.898 1.00 42.24 C ATOM 286 CG ASN A 18 7.891 -17.508 7.980 1.00 15.40 C ATOM 287 OD1 ASN A 18 6.671 -17.578 8.058 1.00 53.24 O ATOM 288 ND2 ASN A 18 8.522 -16.350 7.981 1.00 21.00 N ATOM 0 H ASN A 18 6.343 -19.457 7.783 1.00 72.50 H new ATOM 0 HA ASN A 18 8.777 -20.827 8.526 1.00 4.31 H new ATOM 0 HB2 ASN A 18 9.751 -18.533 8.269 1.00 42.24 H new ATOM 0 HB3 ASN A 18 8.859 -19.054 6.854 1.00 42.24 H new ATOM 0 HD21 ASN A 18 7.993 -15.481 8.048 1.00 21.00 H new ATOM 0 HD22 ASN A 18 9.540 -16.324 7.915 1.00 21.00 H new ATOM 295 N GLN A 19 9.281 -20.088 10.859 1.00 25.35 N ATOM 296 CA GLN A 19 9.499 -19.820 12.288 1.00 30.34 C ATOM 297 C GLN A 19 10.279 -18.502 12.499 1.00 61.33 C ATOM 298 O GLN A 19 10.213 -17.593 11.673 1.00 3.14 O ATOM 299 CB GLN A 19 10.258 -20.994 12.935 1.00 74.42 C ATOM 300 CG GLN A 19 9.474 -22.305 12.983 1.00 4.34 C ATOM 301 CD GLN A 19 9.263 -22.935 11.614 1.00 30.24 C ATOM 302 OE1 GLN A 19 10.087 -22.797 10.714 1.00 61.42 O ATOM 303 NE2 GLN A 19 8.158 -23.626 11.447 1.00 2.00 N ATOM 0 H GLN A 19 10.010 -20.655 10.426 1.00 25.35 H new ATOM 0 HA GLN A 19 8.525 -19.715 12.765 1.00 30.34 H new ATOM 0 HB2 GLN A 19 11.184 -21.159 12.384 1.00 74.42 H new ATOM 0 HB3 GLN A 19 10.537 -20.714 13.951 1.00 74.42 H new ATOM 0 HG2 GLN A 19 10.002 -23.012 13.622 1.00 4.34 H new ATOM 0 HG3 GLN A 19 8.503 -22.122 13.444 1.00 4.34 H new ATOM 0 HE21 GLN A 19 7.495 -23.721 12.216 1.00 2.00 H new ATOM 0 HE22 GLN A 19 7.964 -24.068 10.548 1.00 2.00 H new ATOM 312 N GLU A 20 10.987 -18.398 13.626 1.00 53.04 N ATOM 313 CA GLU A 20 11.825 -17.227 13.926 1.00 21.02 C ATOM 314 C GLU A 20 13.170 -17.275 13.172 1.00 60.32 C ATOM 315 O GLU A 20 13.712 -18.351 12.918 1.00 3.11 O ATOM 316 CB GLU A 20 12.077 -17.148 15.443 1.00 32.25 C ATOM 317 CG GLU A 20 12.825 -18.355 16.007 1.00 44.22 C ATOM 318 CD GLU A 20 12.977 -18.306 17.520 1.00 63.23 C ATOM 319 OE1 GLU A 20 13.834 -17.543 18.017 1.00 2.13 O ATOM 320 OE2 GLU A 20 12.240 -19.031 18.223 1.00 43.44 O ATOM 0 H GLU A 20 10.998 -19.114 14.352 1.00 53.04 H new ATOM 0 HA GLU A 20 11.291 -16.338 13.591 1.00 21.02 H new ATOM 0 HB2 GLU A 20 12.647 -16.245 15.661 1.00 32.25 H new ATOM 0 HB3 GLU A 20 11.120 -17.053 15.956 1.00 32.25 H new ATOM 0 HG2 GLU A 20 12.295 -19.266 15.730 1.00 44.22 H new ATOM 0 HG3 GLU A 20 13.813 -18.410 15.550 1.00 44.22 H new ATOM 327 N MET A 21 13.701 -16.099 12.823 1.00 52.10 N ATOM 328 CA MET A 21 15.008 -15.997 12.149 1.00 63.11 C ATOM 329 C MET A 21 15.930 -14.983 12.849 1.00 62.23 C ATOM 330 O MET A 21 15.525 -14.298 13.790 1.00 54.23 O ATOM 331 CB MET A 21 14.843 -15.600 10.668 1.00 61.50 C ATOM 332 CG MET A 21 14.258 -16.693 9.783 1.00 25.42 C ATOM 333 SD MET A 21 12.512 -16.990 10.105 1.00 73.20 S ATOM 334 CE MET A 21 12.229 -18.435 9.088 1.00 33.13 C ATOM 0 H MET A 21 13.249 -15.201 12.994 1.00 52.10 H new ATOM 0 HA MET A 21 15.468 -16.984 12.205 1.00 63.11 H new ATOM 0 HB2 MET A 21 14.201 -14.721 10.610 1.00 61.50 H new ATOM 0 HB3 MET A 21 15.816 -15.311 10.272 1.00 61.50 H new ATOM 0 HG2 MET A 21 14.388 -16.416 8.737 1.00 25.42 H new ATOM 0 HG3 MET A 21 14.814 -17.617 9.939 1.00 25.42 H new ATOM 0 HE1 MET A 21 11.482 -19.072 9.561 1.00 33.13 H new ATOM 0 HE2 MET A 21 11.871 -18.125 8.106 1.00 33.13 H new ATOM 0 HE3 MET A 21 13.161 -18.989 8.976 1.00 33.13 H new ATOM 344 N THR A 22 17.173 -14.902 12.379 1.00 73.33 N ATOM 345 CA THR A 22 18.159 -13.949 12.910 1.00 11.12 C ATOM 346 C THR A 22 18.028 -12.571 12.244 1.00 1.13 C ATOM 347 O THR A 22 17.492 -12.450 11.138 1.00 72.44 O ATOM 348 CB THR A 22 19.606 -14.465 12.712 1.00 44.15 C ATOM 349 OG1 THR A 22 19.855 -14.715 11.319 1.00 74.31 O ATOM 350 CG2 THR A 22 19.848 -15.741 13.515 1.00 14.20 C ATOM 0 H THR A 22 17.528 -15.489 11.624 1.00 73.33 H new ATOM 0 HA THR A 22 17.953 -13.852 13.976 1.00 11.12 H new ATOM 0 HB THR A 22 20.291 -13.696 13.071 1.00 44.15 H new ATOM 0 HG1 THR A 22 20.773 -15.039 11.204 1.00 74.31 H new ATOM 0 HG21 THR A 22 20.871 -16.081 13.358 1.00 14.20 H new ATOM 0 HG22 THR A 22 19.692 -15.539 14.575 1.00 14.20 H new ATOM 0 HG23 THR A 22 19.154 -16.515 13.187 1.00 14.20 H new ATOM 358 N GLN A 23 18.519 -11.535 12.921 1.00 24.51 N ATOM 359 CA GLN A 23 18.430 -10.162 12.407 1.00 4.45 C ATOM 360 C GLN A 23 19.483 -9.881 11.314 1.00 24.03 C ATOM 361 O GLN A 23 20.587 -9.406 11.590 1.00 54.10 O ATOM 362 CB GLN A 23 18.558 -9.146 13.560 1.00 43.40 C ATOM 363 CG GLN A 23 19.803 -9.332 14.420 1.00 21.21 C ATOM 364 CD GLN A 23 19.893 -8.330 15.559 1.00 63.12 C ATOM 365 OE1 GLN A 23 20.463 -7.254 15.413 1.00 51.33 O ATOM 366 NE2 GLN A 23 19.339 -8.676 16.703 1.00 70.53 N ATOM 0 H GLN A 23 18.983 -11.616 13.826 1.00 24.51 H new ATOM 0 HA GLN A 23 17.449 -10.050 11.944 1.00 4.45 H new ATOM 0 HB2 GLN A 23 18.565 -8.139 13.143 1.00 43.40 H new ATOM 0 HB3 GLN A 23 17.676 -9.222 14.196 1.00 43.40 H new ATOM 0 HG2 GLN A 23 19.807 -10.342 14.831 1.00 21.21 H new ATOM 0 HG3 GLN A 23 20.689 -9.240 13.792 1.00 21.21 H new ATOM 0 HE21 GLN A 23 18.872 -9.579 16.791 1.00 70.53 H new ATOM 0 HE22 GLN A 23 19.377 -8.041 17.500 1.00 70.53 H new ATOM 375 N LEU A 24 19.140 -10.203 10.070 1.00 21.42 N ATOM 376 CA LEU A 24 20.003 -9.888 8.926 1.00 53.42 C ATOM 377 C LEU A 24 19.345 -8.850 8.012 1.00 64.51 C ATOM 378 O LEU A 24 18.188 -8.999 7.627 1.00 21.30 O ATOM 379 CB LEU A 24 20.326 -11.146 8.118 1.00 63.30 C ATOM 380 CG LEU A 24 21.253 -10.910 6.911 1.00 52.40 C ATOM 381 CD1 LEU A 24 22.643 -10.465 7.366 1.00 61.51 C ATOM 382 CD2 LEU A 24 21.339 -12.155 6.039 1.00 61.45 C ATOM 0 H LEU A 24 18.273 -10.681 9.824 1.00 21.42 H new ATOM 0 HA LEU A 24 20.930 -9.475 9.323 1.00 53.42 H new ATOM 0 HB2 LEU A 24 20.791 -11.878 8.779 1.00 63.30 H new ATOM 0 HB3 LEU A 24 19.393 -11.584 7.763 1.00 63.30 H new ATOM 0 HG LEU A 24 20.824 -10.108 6.311 1.00 52.40 H new ATOM 0 HD11 LEU A 24 23.277 -10.305 6.494 1.00 61.51 H new ATOM 0 HD12 LEU A 24 22.561 -9.536 7.930 1.00 61.51 H new ATOM 0 HD13 LEU A 24 23.083 -11.236 7.999 1.00 61.51 H new ATOM 0 HD21 LEU A 24 22.000 -11.962 5.194 1.00 61.45 H new ATOM 0 HD22 LEU A 24 21.734 -12.984 6.626 1.00 61.45 H new ATOM 0 HD23 LEU A 24 20.345 -12.411 5.672 1.00 61.45 H new ATOM 394 N ASN A 25 20.115 -7.822 7.654 1.00 41.45 N ATOM 395 CA ASN A 25 19.635 -6.705 6.819 1.00 73.51 C ATOM 396 C ASN A 25 18.339 -6.072 7.366 1.00 63.44 C ATOM 397 O ASN A 25 17.268 -6.667 7.280 1.00 5.24 O ATOM 398 CB ASN A 25 19.403 -7.160 5.369 1.00 70.33 C ATOM 399 CG ASN A 25 20.649 -7.722 4.713 1.00 62.53 C ATOM 400 OD1 ASN A 25 21.769 -7.375 5.070 1.00 24.41 O ATOM 401 ND2 ASN A 25 20.461 -8.584 3.735 1.00 34.35 N ATOM 0 H ASN A 25 21.092 -7.734 7.932 1.00 41.45 H new ATOM 0 HA ASN A 25 20.419 -5.948 6.845 1.00 73.51 H new ATOM 0 HB2 ASN A 25 18.619 -7.917 5.354 1.00 70.33 H new ATOM 0 HB3 ASN A 25 19.041 -6.315 4.783 1.00 70.33 H new ATOM 0 HD21 ASN A 25 21.262 -8.986 3.248 1.00 34.35 H new ATOM 0 HD22 ASN A 25 19.514 -8.850 3.465 1.00 34.35 H new ATOM 408 N GLN A 26 18.432 -4.849 7.900 1.00 31.45 N ATOM 409 CA GLN A 26 17.245 -4.123 8.389 1.00 3.11 C ATOM 410 C GLN A 26 16.121 -4.106 7.335 1.00 31.04 C ATOM 411 O GLN A 26 14.936 -4.063 7.672 1.00 24.23 O ATOM 412 CB GLN A 26 17.618 -2.687 8.804 1.00 23.45 C ATOM 413 CG GLN A 26 18.239 -2.583 10.199 1.00 54.12 C ATOM 414 CD GLN A 26 19.525 -3.380 10.359 1.00 24.41 C ATOM 415 OE1 GLN A 26 20.294 -3.551 9.419 1.00 63.51 O ATOM 416 NE2 GLN A 26 19.754 -3.896 11.550 1.00 1.04 N ATOM 0 H GLN A 26 19.310 -4.340 8.006 1.00 31.45 H new ATOM 0 HA GLN A 26 16.872 -4.653 9.266 1.00 3.11 H new ATOM 0 HB2 GLN A 26 18.318 -2.279 8.075 1.00 23.45 H new ATOM 0 HB3 GLN A 26 16.723 -2.066 8.769 1.00 23.45 H new ATOM 0 HG2 GLN A 26 18.442 -1.535 10.419 1.00 54.12 H new ATOM 0 HG3 GLN A 26 17.514 -2.929 10.936 1.00 54.12 H new ATOM 0 HE21 GLN A 26 19.094 -3.735 12.311 1.00 1.04 H new ATOM 0 HE22 GLN A 26 20.591 -4.456 11.711 1.00 1.04 H new ATOM 425 N GLU A 27 16.505 -4.145 6.059 1.00 11.22 N ATOM 426 CA GLU A 27 15.544 -4.316 4.962 1.00 64.33 C ATOM 427 C GLU A 27 14.760 -5.632 5.124 1.00 53.13 C ATOM 428 O GLU A 27 13.533 -5.631 5.226 1.00 13.42 O ATOM 429 CB GLU A 27 16.278 -4.322 3.615 1.00 55.24 C ATOM 430 CG GLU A 27 15.361 -4.461 2.401 1.00 10.43 C ATOM 431 CD GLU A 27 16.136 -4.582 1.099 1.00 24.41 C ATOM 432 OE1 GLU A 27 16.931 -3.667 0.791 1.00 70.35 O ATOM 433 OE2 GLU A 27 15.970 -5.595 0.384 1.00 2.13 O ATOM 0 H GLU A 27 17.475 -4.061 5.756 1.00 11.22 H new ATOM 0 HA GLU A 27 14.843 -3.482 4.991 1.00 64.33 H new ATOM 0 HB2 GLU A 27 16.848 -3.398 3.521 1.00 55.24 H new ATOM 0 HB3 GLU A 27 16.996 -5.142 3.609 1.00 55.24 H new ATOM 0 HG2 GLU A 27 14.728 -5.339 2.526 1.00 10.43 H new ATOM 0 HG3 GLU A 27 14.700 -3.596 2.348 1.00 10.43 H new ATOM 440 N THR A 28 15.488 -6.753 5.163 1.00 2.23 N ATOM 441 CA THR A 28 14.883 -8.081 5.341 1.00 65.44 C ATOM 442 C THR A 28 14.104 -8.170 6.665 1.00 33.25 C ATOM 443 O THR A 28 13.089 -8.863 6.758 1.00 22.40 O ATOM 444 CB THR A 28 15.957 -9.201 5.302 1.00 72.11 C ATOM 445 OG1 THR A 28 16.679 -9.157 4.055 1.00 62.34 O ATOM 446 CG2 THR A 28 15.331 -10.583 5.476 1.00 55.24 C ATOM 0 H THR A 28 16.504 -6.768 5.073 1.00 2.23 H new ATOM 0 HA THR A 28 14.190 -8.225 4.512 1.00 65.44 H new ATOM 0 HB THR A 28 16.643 -9.026 6.131 1.00 72.11 H new ATOM 0 HG1 THR A 28 17.355 -9.867 4.043 1.00 62.34 H new ATOM 0 HG21 THR A 28 16.112 -11.343 5.444 1.00 55.24 H new ATOM 0 HG22 THR A 28 14.817 -10.631 6.436 1.00 55.24 H new ATOM 0 HG23 THR A 28 14.616 -10.763 4.673 1.00 55.24 H new ATOM 454 N VAL A 29 14.589 -7.466 7.684 1.00 53.33 N ATOM 455 CA VAL A 29 13.881 -7.354 8.964 1.00 44.44 C ATOM 456 C VAL A 29 12.503 -6.692 8.773 1.00 3.45 C ATOM 457 O VAL A 29 11.491 -7.172 9.291 1.00 11.53 O ATOM 458 CB VAL A 29 14.715 -6.549 9.994 1.00 72.11 C ATOM 459 CG1 VAL A 29 13.960 -6.381 11.309 1.00 4.41 C ATOM 460 CG2 VAL A 29 16.067 -7.221 10.231 1.00 11.55 C ATOM 0 H VAL A 29 15.474 -6.960 7.651 1.00 53.33 H new ATOM 0 HA VAL A 29 13.735 -8.363 9.348 1.00 44.44 H new ATOM 0 HB VAL A 29 14.888 -5.555 9.581 1.00 72.11 H new ATOM 0 HG11 VAL A 29 14.572 -5.813 12.010 1.00 4.41 H new ATOM 0 HG12 VAL A 29 13.027 -5.848 11.127 1.00 4.41 H new ATOM 0 HG13 VAL A 29 13.742 -7.362 11.731 1.00 4.41 H new ATOM 0 HG21 VAL A 29 16.639 -6.642 10.957 1.00 11.55 H new ATOM 0 HG22 VAL A 29 15.910 -8.229 10.614 1.00 11.55 H new ATOM 0 HG23 VAL A 29 16.618 -7.271 9.292 1.00 11.55 H new ATOM 470 N LYS A 30 12.472 -5.598 8.011 1.00 32.51 N ATOM 471 CA LYS A 30 11.213 -4.919 7.675 1.00 75.04 C ATOM 472 C LYS A 30 10.314 -5.808 6.799 1.00 2.42 C ATOM 473 O LYS A 30 9.093 -5.789 6.931 1.00 41.23 O ATOM 474 CB LYS A 30 11.490 -3.578 6.970 1.00 50.12 C ATOM 475 CG LYS A 30 11.208 -2.350 7.833 1.00 34.23 C ATOM 476 CD LYS A 30 12.002 -2.370 9.137 1.00 15.41 C ATOM 477 CE LYS A 30 11.696 -1.151 10.001 1.00 63.23 C ATOM 478 NZ LYS A 30 10.248 -1.052 10.333 1.00 64.45 N ATOM 0 H LYS A 30 13.303 -5.160 7.613 1.00 32.51 H new ATOM 0 HA LYS A 30 10.685 -4.721 8.608 1.00 75.04 H new ATOM 0 HB2 LYS A 30 12.533 -3.555 6.654 1.00 50.12 H new ATOM 0 HB3 LYS A 30 10.882 -3.522 6.067 1.00 50.12 H new ATOM 0 HG2 LYS A 30 11.455 -1.449 7.272 1.00 34.23 H new ATOM 0 HG3 LYS A 30 10.143 -2.303 8.058 1.00 34.23 H new ATOM 0 HD2 LYS A 30 11.767 -3.278 9.692 1.00 15.41 H new ATOM 0 HD3 LYS A 30 13.068 -2.400 8.914 1.00 15.41 H new ATOM 0 HE2 LYS A 30 12.276 -1.205 10.922 1.00 63.23 H new ATOM 0 HE3 LYS A 30 12.011 -0.248 9.478 1.00 63.23 H new ATOM 0 HZ1 LYS A 30 10.138 -0.729 11.316 1.00 64.45 H new ATOM 0 HZ2 LYS A 30 9.791 -0.372 9.692 1.00 64.45 H new ATOM 0 HZ3 LYS A 30 9.802 -1.985 10.223 1.00 64.45 H new ATOM 492 N ILE A 31 10.926 -6.579 5.905 1.00 13.35 N ATOM 493 CA ILE A 31 10.188 -7.539 5.075 1.00 32.21 C ATOM 494 C ILE A 31 9.506 -8.605 5.949 1.00 74.12 C ATOM 495 O ILE A 31 8.318 -8.894 5.792 1.00 42.24 O ATOM 496 CB ILE A 31 11.123 -8.226 4.048 1.00 14.52 C ATOM 497 CG1 ILE A 31 11.757 -7.174 3.119 1.00 61.11 C ATOM 498 CG2 ILE A 31 10.359 -9.274 3.237 1.00 74.44 C ATOM 499 CD1 ILE A 31 12.809 -7.732 2.179 1.00 1.02 C ATOM 0 H ILE A 31 11.931 -6.561 5.733 1.00 13.35 H new ATOM 0 HA ILE A 31 9.424 -6.983 4.532 1.00 32.21 H new ATOM 0 HB ILE A 31 11.920 -8.735 4.591 1.00 14.52 H new ATOM 0 HG12 ILE A 31 10.970 -6.705 2.529 1.00 61.11 H new ATOM 0 HG13 ILE A 31 12.208 -6.391 3.729 1.00 61.11 H new ATOM 0 HG21 ILE A 31 11.034 -9.744 2.522 1.00 74.44 H new ATOM 0 HG22 ILE A 31 9.957 -10.032 3.909 1.00 74.44 H new ATOM 0 HG23 ILE A 31 9.540 -8.794 2.701 1.00 74.44 H new ATOM 0 HD11 ILE A 31 13.206 -6.928 1.559 1.00 1.02 H new ATOM 0 HD12 ILE A 31 13.618 -8.176 2.760 1.00 1.02 H new ATOM 0 HD13 ILE A 31 12.360 -8.494 1.542 1.00 1.02 H new ATOM 511 N THR A 32 10.269 -9.180 6.874 1.00 72.25 N ATOM 512 CA THR A 32 9.728 -10.141 7.846 1.00 52.20 C ATOM 513 C THR A 32 8.601 -9.500 8.673 1.00 1.45 C ATOM 514 O THR A 32 7.563 -10.119 8.926 1.00 44.31 O ATOM 515 CB THR A 32 10.834 -10.660 8.803 1.00 64.23 C ATOM 516 OG1 THR A 32 11.900 -11.257 8.047 1.00 14.41 O ATOM 517 CG2 THR A 32 10.282 -11.688 9.791 1.00 3.04 C ATOM 0 H THR A 32 11.268 -9.000 6.976 1.00 72.25 H new ATOM 0 HA THR A 32 9.330 -10.984 7.281 1.00 52.20 H new ATOM 0 HB THR A 32 11.210 -9.806 9.366 1.00 64.23 H new ATOM 0 HG1 THR A 32 12.396 -10.558 7.572 1.00 14.41 H new ATOM 0 HG21 THR A 32 11.083 -12.030 10.446 1.00 3.04 H new ATOM 0 HG22 THR A 32 9.494 -11.231 10.390 1.00 3.04 H new ATOM 0 HG23 THR A 32 9.874 -12.537 9.243 1.00 3.04 H new ATOM 525 N GLN A 33 8.825 -8.252 9.082 1.00 63.00 N ATOM 526 CA GLN A 33 7.813 -7.452 9.780 1.00 13.31 C ATOM 527 C GLN A 33 6.524 -7.342 8.947 1.00 42.24 C ATOM 528 O GLN A 33 5.429 -7.621 9.436 1.00 54.05 O ATOM 529 CB GLN A 33 8.391 -6.055 10.079 1.00 64.11 C ATOM 530 CG GLN A 33 7.392 -5.056 10.653 1.00 33.41 C ATOM 531 CD GLN A 33 8.066 -3.807 11.198 1.00 34.02 C ATOM 532 OE1 GLN A 33 8.294 -2.838 10.481 1.00 64.15 O ATOM 533 NE2 GLN A 33 8.400 -3.823 12.472 1.00 41.14 N ATOM 0 H GLN A 33 9.710 -7.766 8.940 1.00 63.00 H new ATOM 0 HA GLN A 33 7.554 -7.944 10.717 1.00 13.31 H new ATOM 0 HB2 GLN A 33 9.219 -6.163 10.780 1.00 64.11 H new ATOM 0 HB3 GLN A 33 8.805 -5.644 9.158 1.00 64.11 H new ATOM 0 HG2 GLN A 33 6.681 -4.772 9.878 1.00 33.41 H new ATOM 0 HG3 GLN A 33 6.822 -5.534 11.449 1.00 33.41 H new ATOM 0 HE21 GLN A 33 8.197 -4.644 13.042 1.00 41.14 H new ATOM 0 HE22 GLN A 33 8.862 -3.014 12.888 1.00 41.14 H new ATOM 542 N GLN A 34 6.678 -6.966 7.678 1.00 61.22 N ATOM 543 CA GLN A 34 5.550 -6.817 6.749 1.00 52.01 C ATOM 544 C GLN A 34 4.721 -8.110 6.639 1.00 21.22 C ATOM 545 O GLN A 34 3.492 -8.084 6.753 1.00 73.24 O ATOM 546 CB GLN A 34 6.080 -6.403 5.366 1.00 71.35 C ATOM 547 CG GLN A 34 5.005 -6.272 4.292 1.00 31.10 C ATOM 548 CD GLN A 34 5.544 -5.705 2.991 1.00 4.44 C ATOM 549 OE1 GLN A 34 5.552 -4.498 2.780 1.00 53.12 O ATOM 550 NE2 GLN A 34 5.999 -6.569 2.107 1.00 1.00 N ATOM 0 H GLN A 34 7.585 -6.756 7.262 1.00 61.22 H new ATOM 0 HA GLN A 34 4.889 -6.043 7.139 1.00 52.01 H new ATOM 0 HB2 GLN A 34 6.600 -5.450 5.460 1.00 71.35 H new ATOM 0 HB3 GLN A 34 6.816 -7.137 5.038 1.00 71.35 H new ATOM 0 HG2 GLN A 34 4.565 -7.251 4.102 1.00 31.10 H new ATOM 0 HG3 GLN A 34 4.205 -5.629 4.660 1.00 31.10 H new ATOM 0 HE21 GLN A 34 5.979 -7.568 2.313 1.00 1.00 H new ATOM 0 HE22 GLN A 34 6.372 -6.239 1.217 1.00 1.00 H new ATOM 559 N ASN A 35 5.400 -9.241 6.432 1.00 0.31 N ATOM 560 CA ASN A 35 4.723 -10.541 6.318 1.00 41.25 C ATOM 561 C ASN A 35 3.959 -10.906 7.606 1.00 1.24 C ATOM 562 O ASN A 35 2.799 -11.314 7.552 1.00 55.32 O ATOM 563 CB ASN A 35 5.727 -11.650 5.966 1.00 65.21 C ATOM 564 CG ASN A 35 6.180 -11.586 4.516 1.00 23.24 C ATOM 565 OD1 ASN A 35 5.543 -12.146 3.633 1.00 15.32 O ATOM 566 ND2 ASN A 35 7.284 -10.916 4.257 1.00 43.51 N ATOM 0 H ASN A 35 6.415 -9.286 6.340 1.00 0.31 H new ATOM 0 HA ASN A 35 3.995 -10.454 5.512 1.00 41.25 H new ATOM 0 HB2 ASN A 35 6.596 -11.569 6.619 1.00 65.21 H new ATOM 0 HB3 ASN A 35 5.273 -12.622 6.159 1.00 65.21 H new ATOM 0 HD21 ASN A 35 7.630 -10.853 3.299 1.00 43.51 H new ATOM 0 HD22 ASN A 35 7.793 -10.460 5.014 1.00 43.51 H new ATOM 573 N ARG A 36 4.605 -10.750 8.763 1.00 0.52 N ATOM 574 CA ARG A 36 3.964 -11.080 10.045 1.00 51.43 C ATOM 575 C ARG A 36 2.764 -10.159 10.345 1.00 23.41 C ATOM 576 O ARG A 36 1.757 -10.601 10.907 1.00 3.30 O ATOM 577 CB ARG A 36 4.980 -11.033 11.196 1.00 40.34 C ATOM 578 CG ARG A 36 6.027 -12.143 11.131 1.00 42.50 C ATOM 579 CD ARG A 36 6.903 -12.184 12.378 1.00 72.23 C ATOM 580 NE ARG A 36 7.854 -13.293 12.336 1.00 15.41 N ATOM 581 CZ ARG A 36 8.655 -13.621 13.313 1.00 74.05 C ATOM 582 NH1 ARG A 36 8.611 -12.994 14.443 1.00 14.13 N ATOM 583 NH2 ARG A 36 9.480 -14.607 13.175 1.00 73.44 N ATOM 0 H ARG A 36 5.560 -10.402 8.843 1.00 0.52 H new ATOM 0 HA ARG A 36 3.583 -12.098 9.959 1.00 51.43 H new ATOM 0 HB2 ARG A 36 5.485 -10.067 11.185 1.00 40.34 H new ATOM 0 HB3 ARG A 36 4.446 -11.103 12.144 1.00 40.34 H new ATOM 0 HG2 ARG A 36 5.528 -13.104 11.008 1.00 42.50 H new ATOM 0 HG3 ARG A 36 6.655 -11.996 10.253 1.00 42.50 H new ATOM 0 HD2 ARG A 36 7.445 -11.243 12.472 1.00 72.23 H new ATOM 0 HD3 ARG A 36 6.273 -12.279 13.262 1.00 72.23 H new ATOM 0 HE ARG A 36 7.895 -13.850 11.483 1.00 15.41 H new ATOM 0 HH11 ARG A 36 7.945 -12.234 14.579 1.00 14.13 H new ATOM 0 HH12 ARG A 36 9.242 -13.260 15.199 1.00 14.13 H new ATOM 0 HH21 ARG A 36 9.506 -15.131 12.300 1.00 73.44 H new ATOM 0 HH22 ARG A 36 10.104 -14.860 13.941 1.00 73.44 H new ATOM 597 N LEU A 37 2.871 -8.882 9.971 1.00 32.30 N ATOM 598 CA LEU A 37 1.738 -7.953 10.092 1.00 65.31 C ATOM 599 C LEU A 37 0.597 -8.375 9.154 1.00 61.13 C ATOM 600 O LEU A 37 -0.581 -8.283 9.504 1.00 41.34 O ATOM 601 CB LEU A 37 2.173 -6.510 9.781 1.00 21.11 C ATOM 602 CG LEU A 37 3.193 -5.904 10.761 1.00 11.24 C ATOM 603 CD1 LEU A 37 3.562 -4.481 10.348 1.00 34.35 C ATOM 604 CD2 LEU A 37 2.652 -5.934 12.189 1.00 35.45 C ATOM 0 H LEU A 37 3.720 -8.468 9.585 1.00 32.30 H new ATOM 0 HA LEU A 37 1.381 -7.989 11.121 1.00 65.31 H new ATOM 0 HB2 LEU A 37 2.599 -6.485 8.778 1.00 21.11 H new ATOM 0 HB3 LEU A 37 1.286 -5.876 9.767 1.00 21.11 H new ATOM 0 HG LEU A 37 4.099 -6.510 10.729 1.00 11.24 H new ATOM 0 HD11 LEU A 37 4.284 -4.073 11.055 1.00 34.35 H new ATOM 0 HD12 LEU A 37 3.999 -4.494 9.350 1.00 34.35 H new ATOM 0 HD13 LEU A 37 2.667 -3.859 10.344 1.00 34.35 H new ATOM 0 HD21 LEU A 37 3.388 -5.501 12.866 1.00 35.45 H new ATOM 0 HD22 LEU A 37 1.728 -5.357 12.240 1.00 35.45 H new ATOM 0 HD23 LEU A 37 2.453 -6.965 12.481 1.00 35.45 H new ATOM 616 N ASN A 38 0.962 -8.845 7.961 1.00 42.33 N ATOM 617 CA ASN A 38 -0.012 -9.373 6.999 1.00 33.13 C ATOM 618 C ASN A 38 -0.678 -10.653 7.537 1.00 74.22 C ATOM 619 O ASN A 38 -1.850 -10.917 7.268 1.00 24.12 O ATOM 620 CB ASN A 38 0.665 -9.649 5.648 1.00 10.12 C ATOM 621 CG ASN A 38 -0.301 -10.195 4.608 1.00 21.51 C ATOM 622 OD1 ASN A 38 -0.474 -11.399 4.474 1.00 23.01 O ATOM 623 ND2 ASN A 38 -0.939 -9.316 3.860 1.00 24.31 N ATOM 0 H ASN A 38 1.928 -8.872 7.635 1.00 42.33 H new ATOM 0 HA ASN A 38 -0.788 -8.621 6.854 1.00 33.13 H new ATOM 0 HB2 ASN A 38 1.111 -8.727 5.275 1.00 10.12 H new ATOM 0 HB3 ASN A 38 1.478 -10.361 5.792 1.00 10.12 H new ATOM 0 HD21 ASN A 38 -1.596 -9.634 3.148 1.00 24.31 H new ATOM 0 HD22 ASN A 38 -0.775 -8.318 3.994 1.00 24.31 H new ATOM 630 N ALA A 39 0.081 -11.442 8.302 1.00 2.15 N ATOM 631 CA ALA A 39 -0.449 -12.657 8.944 1.00 51.53 C ATOM 632 C ALA A 39 -1.586 -12.328 9.931 1.00 20.23 C ATOM 633 O ALA A 39 -2.602 -13.028 9.985 1.00 41.11 O ATOM 634 CB ALA A 39 0.669 -13.412 9.658 1.00 40.23 C ATOM 0 H ALA A 39 1.067 -11.264 8.495 1.00 2.15 H new ATOM 0 HA ALA A 39 -0.863 -13.291 8.160 1.00 51.53 H new ATOM 0 HB1 ALA A 39 0.261 -14.307 10.127 1.00 40.23 H new ATOM 0 HB2 ALA A 39 1.434 -13.697 8.936 1.00 40.23 H new ATOM 0 HB3 ALA A 39 1.111 -12.771 10.421 1.00 40.23 H new ATOM 640 N LYS A 40 -1.402 -11.264 10.718 1.00 54.51 N ATOM 641 CA LYS A 40 -2.459 -10.775 11.618 1.00 50.52 C ATOM 642 C LYS A 40 -3.560 -10.037 10.834 1.00 3.23 C ATOM 643 O LYS A 40 -4.709 -9.965 11.270 1.00 21.22 O ATOM 644 CB LYS A 40 -1.880 -9.841 12.696 1.00 1.24 C ATOM 645 CG LYS A 40 -1.056 -10.551 13.767 1.00 2.12 C ATOM 646 CD LYS A 40 -0.685 -9.599 14.902 1.00 41.45 C ATOM 647 CE LYS A 40 0.007 -10.314 16.058 1.00 51.42 C ATOM 648 NZ LYS A 40 1.347 -10.842 15.684 1.00 3.25 N ATOM 0 H LYS A 40 -0.537 -10.725 10.753 1.00 54.51 H new ATOM 0 HA LYS A 40 -2.898 -11.647 12.104 1.00 50.52 H new ATOM 0 HB2 LYS A 40 -1.255 -9.090 12.212 1.00 1.24 H new ATOM 0 HB3 LYS A 40 -2.701 -9.310 13.178 1.00 1.24 H new ATOM 0 HG2 LYS A 40 -1.622 -11.393 14.166 1.00 2.12 H new ATOM 0 HG3 LYS A 40 -0.149 -10.959 13.320 1.00 2.12 H new ATOM 0 HD2 LYS A 40 -0.030 -8.817 14.517 1.00 41.45 H new ATOM 0 HD3 LYS A 40 -1.586 -9.108 15.269 1.00 41.45 H new ATOM 0 HE2 LYS A 40 0.113 -9.625 16.896 1.00 51.42 H new ATOM 0 HE3 LYS A 40 -0.621 -11.137 16.400 1.00 51.42 H new ATOM 0 HZ1 LYS A 40 1.693 -11.473 16.435 1.00 3.25 H new ATOM 0 HZ2 LYS A 40 1.275 -11.372 14.792 1.00 3.25 H new ATOM 0 HZ3 LYS A 40 2.011 -10.050 15.564 1.00 3.25 H new ATOM 662 N SER A 41 -3.195 -9.489 9.677 1.00 63.43 N ATOM 663 CA SER A 41 -4.140 -8.744 8.833 1.00 50.21 C ATOM 664 C SER A 41 -5.188 -9.662 8.202 1.00 62.21 C ATOM 665 O SER A 41 -4.853 -10.649 7.547 1.00 31.33 O ATOM 666 CB SER A 41 -3.401 -8.002 7.716 1.00 60.11 C ATOM 667 OG SER A 41 -4.305 -7.281 6.892 1.00 4.53 O ATOM 0 H SER A 41 -2.250 -9.545 9.298 1.00 63.43 H new ATOM 0 HA SER A 41 -4.645 -8.030 9.484 1.00 50.21 H new ATOM 0 HB2 SER A 41 -2.675 -7.315 8.151 1.00 60.11 H new ATOM 0 HB3 SER A 41 -2.842 -8.715 7.110 1.00 60.11 H new ATOM 0 HG SER A 41 -4.108 -7.466 5.950 1.00 4.53 H new ATOM 673 N SER A 42 -6.458 -9.337 8.404 1.00 2.04 N ATOM 674 CA SER A 42 -7.558 -10.085 7.779 1.00 21.45 C ATOM 675 C SER A 42 -8.381 -9.190 6.842 1.00 12.14 C ATOM 676 O SER A 42 -9.436 -9.594 6.355 1.00 51.32 O ATOM 677 CB SER A 42 -8.479 -10.672 8.857 1.00 2.02 C ATOM 678 OG SER A 42 -9.163 -9.643 9.560 1.00 43.05 O ATOM 0 H SER A 42 -6.759 -8.562 8.994 1.00 2.04 H new ATOM 0 HA SER A 42 -7.118 -10.891 7.192 1.00 21.45 H new ATOM 0 HB2 SER A 42 -9.202 -11.344 8.395 1.00 2.02 H new ATOM 0 HB3 SER A 42 -7.892 -11.267 9.557 1.00 2.02 H new ATOM 0 HG SER A 42 -9.745 -10.042 10.240 1.00 43.05 H new ATOM 684 N SER A 43 -7.893 -7.976 6.581 1.00 12.11 N ATOM 685 CA SER A 43 -8.660 -6.988 5.798 1.00 24.43 C ATOM 686 C SER A 43 -7.798 -6.269 4.748 1.00 50.12 C ATOM 687 O SER A 43 -8.045 -5.108 4.426 1.00 65.42 O ATOM 688 CB SER A 43 -9.294 -5.955 6.743 1.00 11.13 C ATOM 689 OG SER A 43 -10.180 -6.581 7.665 1.00 42.11 O ATOM 0 H SER A 43 -6.979 -7.649 6.894 1.00 12.11 H new ATOM 0 HA SER A 43 -9.436 -7.534 5.261 1.00 24.43 H new ATOM 0 HB2 SER A 43 -8.511 -5.427 7.287 1.00 11.13 H new ATOM 0 HB3 SER A 43 -9.836 -5.210 6.161 1.00 11.13 H new ATOM 0 HG SER A 43 -10.569 -5.903 8.256 1.00 42.11 H new ATOM 695 N GLY A 44 -6.803 -6.962 4.198 1.00 10.23 N ATOM 696 CA GLY A 44 -5.974 -6.377 3.144 1.00 53.35 C ATOM 697 C GLY A 44 -4.489 -6.655 3.322 1.00 33.12 C ATOM 698 O GLY A 44 -4.098 -7.525 4.102 1.00 44.44 O ATOM 0 H GLY A 44 -6.553 -7.916 4.459 1.00 10.23 H new ATOM 0 HA2 GLY A 44 -6.296 -6.768 2.179 1.00 53.35 H new ATOM 0 HA3 GLY A 44 -6.135 -5.299 3.121 1.00 53.35 H new ATOM 702 N VAL A 45 -3.654 -5.912 2.598 1.00 21.33 N ATOM 703 CA VAL A 45 -2.198 -6.101 2.659 1.00 32.24 C ATOM 704 C VAL A 45 -1.477 -4.868 3.229 1.00 64.21 C ATOM 705 O VAL A 45 -1.796 -3.731 2.886 1.00 35.54 O ATOM 706 CB VAL A 45 -1.602 -6.434 1.263 1.00 43.44 C ATOM 707 CG1 VAL A 45 -2.132 -7.773 0.753 1.00 53.14 C ATOM 708 CG2 VAL A 45 -1.900 -5.320 0.259 1.00 31.53 C ATOM 0 H VAL A 45 -3.956 -5.174 1.962 1.00 21.33 H new ATOM 0 HA VAL A 45 -2.035 -6.945 3.330 1.00 32.24 H new ATOM 0 HB VAL A 45 -0.520 -6.512 1.371 1.00 43.44 H new ATOM 0 HG11 VAL A 45 -1.702 -7.986 -0.226 1.00 53.14 H new ATOM 0 HG12 VAL A 45 -1.855 -8.563 1.451 1.00 53.14 H new ATOM 0 HG13 VAL A 45 -3.218 -7.727 0.669 1.00 53.14 H new ATOM 0 HG21 VAL A 45 -1.472 -5.579 -0.709 1.00 31.53 H new ATOM 0 HG22 VAL A 45 -2.979 -5.200 0.158 1.00 31.53 H new ATOM 0 HG23 VAL A 45 -1.462 -4.386 0.611 1.00 31.53 H new ATOM 718 N TYR A 46 -0.512 -5.106 4.118 1.00 5.24 N ATOM 719 CA TYR A 46 0.328 -4.034 4.666 1.00 44.00 C ATOM 720 C TYR A 46 1.577 -3.811 3.804 1.00 14.23 C ATOM 721 O TYR A 46 2.512 -4.605 3.845 1.00 71.14 O ATOM 722 CB TYR A 46 0.762 -4.360 6.105 1.00 32.52 C ATOM 723 CG TYR A 46 -0.314 -4.135 7.150 1.00 53.52 C ATOM 724 CD1 TYR A 46 -0.505 -2.877 7.712 1.00 44.24 C ATOM 725 CD2 TYR A 46 -1.128 -5.173 7.583 1.00 20.11 C ATOM 726 CE1 TYR A 46 -1.475 -2.661 8.668 1.00 11.51 C ATOM 727 CE2 TYR A 46 -2.102 -4.963 8.541 1.00 40.33 C ATOM 728 CZ TYR A 46 -2.271 -3.708 9.080 1.00 11.51 C ATOM 729 OH TYR A 46 -3.246 -3.491 10.026 1.00 52.34 O ATOM 0 H TYR A 46 -0.290 -6.035 4.477 1.00 5.24 H new ATOM 0 HA TYR A 46 -0.271 -3.123 4.666 1.00 44.00 H new ATOM 0 HB2 TYR A 46 1.081 -5.401 6.148 1.00 32.52 H new ATOM 0 HB3 TYR A 46 1.629 -3.750 6.357 1.00 32.52 H new ATOM 0 HD1 TYR A 46 0.118 -2.054 7.394 1.00 44.24 H new ATOM 0 HD2 TYR A 46 -0.998 -6.160 7.165 1.00 20.11 H new ATOM 0 HE1 TYR A 46 -1.610 -1.677 9.092 1.00 11.51 H new ATOM 0 HE2 TYR A 46 -2.728 -5.781 8.865 1.00 40.33 H new ATOM 0 HH TYR A 46 -2.966 -2.767 10.624 1.00 52.34 H new ATOM 739 N LEU A 47 1.579 -2.747 3.010 1.00 42.11 N ATOM 740 CA LEU A 47 2.770 -2.356 2.251 1.00 44.13 C ATOM 741 C LEU A 47 3.643 -1.389 3.066 1.00 70.11 C ATOM 742 O LEU A 47 3.326 -0.207 3.195 1.00 51.53 O ATOM 743 CB LEU A 47 2.364 -1.704 0.920 1.00 73.55 C ATOM 744 CG LEU A 47 1.617 -2.619 -0.063 1.00 13.32 C ATOM 745 CD1 LEU A 47 1.218 -1.849 -1.320 1.00 21.32 C ATOM 746 CD2 LEU A 47 2.475 -3.831 -0.422 1.00 34.53 C ATOM 0 H LEU A 47 0.773 -2.138 2.872 1.00 42.11 H new ATOM 0 HA LEU A 47 3.351 -3.254 2.043 1.00 44.13 H new ATOM 0 HB2 LEU A 47 1.735 -0.840 1.135 1.00 73.55 H new ATOM 0 HB3 LEU A 47 3.263 -1.329 0.430 1.00 73.55 H new ATOM 0 HG LEU A 47 0.707 -2.973 0.421 1.00 13.32 H new ATOM 0 HD11 LEU A 47 0.690 -2.515 -2.003 1.00 21.32 H new ATOM 0 HD12 LEU A 47 0.566 -1.019 -1.047 1.00 21.32 H new ATOM 0 HD13 LEU A 47 2.112 -1.462 -1.809 1.00 21.32 H new ATOM 0 HD21 LEU A 47 1.931 -4.468 -1.119 1.00 34.53 H new ATOM 0 HD22 LEU A 47 3.403 -3.496 -0.886 1.00 34.53 H new ATOM 0 HD23 LEU A 47 2.704 -4.395 0.482 1.00 34.53 H new ATOM 758 N LEU A 48 4.725 -1.904 3.640 1.00 72.25 N ATOM 759 CA LEU A 48 5.650 -1.079 4.425 1.00 4.44 C ATOM 760 C LEU A 48 6.647 -0.350 3.510 1.00 31.51 C ATOM 761 O LEU A 48 7.417 -0.986 2.794 1.00 31.34 O ATOM 762 CB LEU A 48 6.416 -1.943 5.449 1.00 45.52 C ATOM 763 CG LEU A 48 5.634 -2.351 6.717 1.00 41.11 C ATOM 764 CD1 LEU A 48 4.378 -3.151 6.371 1.00 74.25 C ATOM 765 CD2 LEU A 48 6.534 -3.144 7.667 1.00 63.33 C ATOM 0 H LEU A 48 4.987 -2.888 3.579 1.00 72.25 H new ATOM 0 HA LEU A 48 5.060 -0.336 4.961 1.00 4.44 H new ATOM 0 HB2 LEU A 48 6.753 -2.850 4.948 1.00 45.52 H new ATOM 0 HB3 LEU A 48 7.309 -1.399 5.757 1.00 45.52 H new ATOM 0 HG LEU A 48 5.313 -1.438 7.218 1.00 41.11 H new ATOM 0 HD11 LEU A 48 3.854 -3.420 7.288 1.00 74.25 H new ATOM 0 HD12 LEU A 48 3.723 -2.547 5.743 1.00 74.25 H new ATOM 0 HD13 LEU A 48 4.660 -4.057 5.835 1.00 74.25 H new ATOM 0 HD21 LEU A 48 5.968 -3.424 8.556 1.00 63.33 H new ATOM 0 HD22 LEU A 48 6.890 -4.044 7.165 1.00 63.33 H new ATOM 0 HD23 LEU A 48 7.386 -2.530 7.958 1.00 63.33 H new ATOM 777 N PRO A 49 6.653 0.999 3.520 1.00 75.11 N ATOM 778 CA PRO A 49 7.604 1.788 2.715 1.00 54.53 C ATOM 779 C PRO A 49 9.078 1.468 3.040 1.00 13.25 C ATOM 780 O PRO A 49 9.976 1.764 2.254 1.00 12.33 O ATOM 781 CB PRO A 49 7.269 3.247 3.071 1.00 64.43 C ATOM 782 CG PRO A 49 6.430 3.185 4.310 1.00 73.35 C ATOM 783 CD PRO A 49 5.728 1.855 4.282 1.00 41.20 C ATOM 0 HA PRO A 49 7.504 1.567 1.652 1.00 54.53 H new ATOM 0 HB2 PRO A 49 8.177 3.825 3.243 1.00 64.43 H new ATOM 0 HB3 PRO A 49 6.730 3.733 2.258 1.00 64.43 H new ATOM 0 HG2 PRO A 49 7.048 3.279 5.203 1.00 73.35 H new ATOM 0 HG3 PRO A 49 5.710 4.003 4.333 1.00 73.35 H new ATOM 0 HD2 PRO A 49 5.558 1.469 5.287 1.00 41.20 H new ATOM 0 HD3 PRO A 49 4.754 1.925 3.798 1.00 41.20 H new ATOM 791 N GLY A 50 9.314 0.866 4.208 1.00 2.33 N ATOM 792 CA GLY A 50 10.662 0.443 4.590 1.00 65.53 C ATOM 793 C GLY A 50 10.985 -0.993 4.168 1.00 34.40 C ATOM 794 O GLY A 50 12.127 -1.441 4.281 1.00 54.20 O ATOM 0 H GLY A 50 8.594 0.662 4.901 1.00 2.33 H new ATOM 0 HA2 GLY A 50 11.389 1.119 4.141 1.00 65.53 H new ATOM 0 HA3 GLY A 50 10.771 0.531 5.671 1.00 65.53 H new ATOM 798 N ALA A 51 9.977 -1.720 3.685 1.00 11.13 N ATOM 799 CA ALA A 51 10.156 -3.105 3.236 1.00 21.14 C ATOM 800 C ALA A 51 10.077 -3.205 1.707 1.00 32.10 C ATOM 801 O ALA A 51 9.002 -3.400 1.136 1.00 51.11 O ATOM 802 CB ALA A 51 9.113 -4.008 3.887 1.00 50.42 C ATOM 0 H ALA A 51 9.022 -1.372 3.594 1.00 11.13 H new ATOM 0 HA ALA A 51 11.148 -3.437 3.541 1.00 21.14 H new ATOM 0 HB1 ALA A 51 9.256 -5.033 3.546 1.00 50.42 H new ATOM 0 HB2 ALA A 51 9.222 -3.967 4.971 1.00 50.42 H new ATOM 0 HB3 ALA A 51 8.115 -3.669 3.610 1.00 50.42 H new ATOM 808 N LYS A 52 11.221 -3.055 1.046 1.00 33.03 N ATOM 809 CA LYS A 52 11.284 -3.099 -0.420 1.00 71.33 C ATOM 810 C LYS A 52 10.887 -4.496 -0.941 1.00 4.03 C ATOM 811 O LYS A 52 11.739 -5.353 -1.181 1.00 65.52 O ATOM 812 CB LYS A 52 12.701 -2.692 -0.887 1.00 61.54 C ATOM 813 CG LYS A 52 12.838 -2.374 -2.382 1.00 54.43 C ATOM 814 CD LYS A 52 13.070 -3.623 -3.232 1.00 73.12 C ATOM 815 CE LYS A 52 13.356 -3.274 -4.687 1.00 4.11 C ATOM 816 NZ LYS A 52 13.716 -4.473 -5.489 1.00 14.22 N ATOM 0 H LYS A 52 12.122 -2.901 1.499 1.00 33.03 H new ATOM 0 HA LYS A 52 10.570 -2.389 -0.836 1.00 71.33 H new ATOM 0 HB2 LYS A 52 13.015 -1.818 -0.317 1.00 61.54 H new ATOM 0 HB3 LYS A 52 13.392 -3.498 -0.640 1.00 61.54 H new ATOM 0 HG2 LYS A 52 11.936 -1.868 -2.726 1.00 54.43 H new ATOM 0 HG3 LYS A 52 13.667 -1.681 -2.527 1.00 54.43 H new ATOM 0 HD2 LYS A 52 13.906 -4.190 -2.823 1.00 73.12 H new ATOM 0 HD3 LYS A 52 12.192 -4.267 -3.179 1.00 73.12 H new ATOM 0 HE2 LYS A 52 12.479 -2.796 -5.124 1.00 4.11 H new ATOM 0 HE3 LYS A 52 14.170 -2.550 -4.733 1.00 4.11 H new ATOM 0 HZ1 LYS A 52 13.902 -4.190 -6.472 1.00 14.22 H new ATOM 0 HZ2 LYS A 52 14.568 -4.915 -5.089 1.00 14.22 H new ATOM 0 HZ3 LYS A 52 12.930 -5.154 -5.468 1.00 14.22 H new ATOM 830 N THR A 53 9.575 -4.719 -1.073 1.00 4.23 N ATOM 831 CA THR A 53 9.026 -6.007 -1.530 1.00 4.50 C ATOM 832 C THR A 53 7.603 -5.857 -2.091 1.00 73.50 C ATOM 833 O THR A 53 6.875 -4.933 -1.730 1.00 52.04 O ATOM 834 CB THR A 53 8.981 -7.066 -0.389 1.00 73.33 C ATOM 835 OG1 THR A 53 8.708 -6.440 0.876 1.00 55.45 O ATOM 836 CG2 THR A 53 10.276 -7.863 -0.310 1.00 32.21 C ATOM 0 H THR A 53 8.864 -4.017 -0.868 1.00 4.23 H new ATOM 0 HA THR A 53 9.701 -6.346 -2.316 1.00 4.50 H new ATOM 0 HB THR A 53 8.173 -7.760 -0.622 1.00 73.33 H new ATOM 0 HG1 THR A 53 8.682 -7.122 1.580 1.00 55.45 H new ATOM 0 HG21 THR A 53 10.206 -8.592 0.498 1.00 32.21 H new ATOM 0 HG22 THR A 53 10.442 -8.382 -1.254 1.00 32.21 H new ATOM 0 HG23 THR A 53 11.109 -7.186 -0.117 1.00 32.21 H new ATOM 844 N PRO A 54 7.204 -6.760 -3.006 1.00 73.32 N ATOM 845 CA PRO A 54 5.823 -6.839 -3.506 1.00 44.31 C ATOM 846 C PRO A 54 4.920 -7.748 -2.641 1.00 11.53 C ATOM 847 O PRO A 54 5.375 -8.755 -2.098 1.00 4.33 O ATOM 848 CB PRO A 54 6.027 -7.442 -4.897 1.00 2.12 C ATOM 849 CG PRO A 54 7.196 -8.364 -4.734 1.00 44.34 C ATOM 850 CD PRO A 54 8.076 -7.758 -3.664 1.00 31.41 C ATOM 0 HA PRO A 54 5.316 -5.874 -3.496 1.00 44.31 H new ATOM 0 HB2 PRO A 54 5.140 -7.980 -5.231 1.00 2.12 H new ATOM 0 HB3 PRO A 54 6.230 -6.670 -5.639 1.00 2.12 H new ATOM 0 HG2 PRO A 54 6.866 -9.362 -4.445 1.00 44.34 H new ATOM 0 HG3 PRO A 54 7.742 -8.468 -5.672 1.00 44.34 H new ATOM 0 HD2 PRO A 54 8.423 -8.512 -2.958 1.00 31.41 H new ATOM 0 HD3 PRO A 54 8.963 -7.292 -4.093 1.00 31.41 H new ATOM 858 N ALA A 55 3.639 -7.395 -2.526 1.00 20.42 N ATOM 859 CA ALA A 55 2.676 -8.195 -1.753 1.00 72.22 C ATOM 860 C ALA A 55 1.466 -8.602 -2.610 1.00 35.53 C ATOM 861 O ALA A 55 0.926 -7.791 -3.365 1.00 14.23 O ATOM 862 CB ALA A 55 2.219 -7.424 -0.518 1.00 42.33 C ATOM 0 H ALA A 55 3.240 -6.561 -2.957 1.00 20.42 H new ATOM 0 HA ALA A 55 3.179 -9.108 -1.435 1.00 72.22 H new ATOM 0 HB1 ALA A 55 1.507 -8.027 0.045 1.00 42.33 H new ATOM 0 HB2 ALA A 55 3.081 -7.200 0.110 1.00 42.33 H new ATOM 0 HB3 ALA A 55 1.742 -6.493 -0.826 1.00 42.33 H new ATOM 868 N ARG A 56 1.052 -9.864 -2.495 1.00 72.33 N ATOM 869 CA ARG A 56 -0.100 -10.379 -3.246 1.00 3.01 C ATOM 870 C ARG A 56 -1.420 -10.120 -2.496 1.00 53.31 C ATOM 871 O ARG A 56 -1.562 -10.474 -1.326 1.00 54.13 O ATOM 872 CB ARG A 56 0.066 -11.886 -3.504 1.00 51.12 C ATOM 873 CG ARG A 56 -1.063 -12.495 -4.330 1.00 23.43 C ATOM 874 CD ARG A 56 -0.867 -13.991 -4.571 1.00 64.43 C ATOM 875 NE ARG A 56 -0.924 -14.769 -3.332 1.00 40.44 N ATOM 876 CZ ARG A 56 -1.732 -15.776 -3.126 1.00 24.25 C ATOM 877 NH1 ARG A 56 -2.605 -16.127 -4.017 1.00 43.55 N ATOM 878 NH2 ARG A 56 -1.661 -16.443 -2.023 1.00 53.44 N ATOM 0 H ARG A 56 1.497 -10.553 -1.888 1.00 72.33 H new ATOM 0 HA ARG A 56 -0.141 -9.850 -4.198 1.00 3.01 H new ATOM 0 HB2 ARG A 56 1.012 -12.056 -4.018 1.00 51.12 H new ATOM 0 HB3 ARG A 56 0.125 -12.405 -2.547 1.00 51.12 H new ATOM 0 HG2 ARG A 56 -2.012 -12.333 -3.818 1.00 23.43 H new ATOM 0 HG3 ARG A 56 -1.126 -11.981 -5.289 1.00 23.43 H new ATOM 0 HD2 ARG A 56 -1.635 -14.349 -5.257 1.00 64.43 H new ATOM 0 HD3 ARG A 56 0.095 -14.155 -5.056 1.00 64.43 H new ATOM 0 HE ARG A 56 -0.290 -14.507 -2.577 1.00 40.44 H new ATOM 0 HH11 ARG A 56 -2.670 -15.615 -4.897 1.00 43.55 H new ATOM 0 HH12 ARG A 56 -3.227 -16.915 -3.839 1.00 43.55 H new ATOM 0 HH21 ARG A 56 -0.975 -16.184 -1.314 1.00 53.44 H new ATOM 0 HH22 ARG A 56 -2.291 -17.229 -1.861 1.00 53.44 H new ATOM 892 N LEU A 57 -2.382 -9.502 -3.182 1.00 5.12 N ATOM 893 CA LEU A 57 -3.698 -9.218 -2.604 1.00 25.33 C ATOM 894 C LEU A 57 -4.820 -9.883 -3.420 1.00 62.45 C ATOM 895 O LEU A 57 -5.006 -9.588 -4.601 1.00 40.35 O ATOM 896 CB LEU A 57 -3.919 -7.699 -2.531 1.00 42.11 C ATOM 897 CG LEU A 57 -5.322 -7.244 -2.080 1.00 53.14 C ATOM 898 CD1 LEU A 57 -5.649 -7.762 -0.682 1.00 11.13 C ATOM 899 CD2 LEU A 57 -5.430 -5.721 -2.133 1.00 4.10 C ATOM 0 H LEU A 57 -2.274 -9.186 -4.146 1.00 5.12 H new ATOM 0 HA LEU A 57 -3.727 -9.634 -1.597 1.00 25.33 H new ATOM 0 HB2 LEU A 57 -3.184 -7.277 -1.846 1.00 42.11 H new ATOM 0 HB3 LEU A 57 -3.719 -7.274 -3.515 1.00 42.11 H new ATOM 0 HG LEU A 57 -6.053 -7.668 -2.769 1.00 53.14 H new ATOM 0 HD11 LEU A 57 -6.644 -7.425 -0.393 1.00 11.13 H new ATOM 0 HD12 LEU A 57 -5.621 -8.852 -0.682 1.00 11.13 H new ATOM 0 HD13 LEU A 57 -4.916 -7.380 0.028 1.00 11.13 H new ATOM 0 HD21 LEU A 57 -6.426 -5.415 -1.812 1.00 4.10 H new ATOM 0 HD22 LEU A 57 -4.684 -5.280 -1.472 1.00 4.10 H new ATOM 0 HD23 LEU A 57 -5.257 -5.379 -3.154 1.00 4.10 H new ATOM 911 N GLU A 58 -5.562 -10.787 -2.783 1.00 23.32 N ATOM 912 CA GLU A 58 -6.683 -11.467 -3.439 1.00 2.11 C ATOM 913 C GLU A 58 -7.976 -10.646 -3.282 1.00 34.02 C ATOM 914 O GLU A 58 -8.629 -10.676 -2.235 1.00 41.40 O ATOM 915 CB GLU A 58 -6.858 -12.879 -2.858 1.00 4.34 C ATOM 916 CG GLU A 58 -7.897 -13.725 -3.589 1.00 45.45 C ATOM 917 CD GLU A 58 -8.009 -15.131 -3.022 1.00 63.23 C ATOM 918 OE1 GLU A 58 -8.820 -15.342 -2.095 1.00 0.40 O ATOM 919 OE2 GLU A 58 -7.283 -16.029 -3.497 1.00 0.10 O ATOM 0 H GLU A 58 -5.409 -11.067 -1.814 1.00 23.32 H new ATOM 0 HA GLU A 58 -6.466 -11.557 -4.503 1.00 2.11 H new ATOM 0 HB2 GLU A 58 -5.898 -13.395 -2.887 1.00 4.34 H new ATOM 0 HB3 GLU A 58 -7.144 -12.797 -1.809 1.00 4.34 H new ATOM 0 HG2 GLU A 58 -8.868 -13.234 -3.528 1.00 45.45 H new ATOM 0 HG3 GLU A 58 -7.635 -13.783 -4.645 1.00 45.45 H new ATOM 926 N SER A 59 -8.330 -9.912 -4.332 1.00 63.41 N ATOM 927 CA SER A 59 -9.429 -8.934 -4.274 1.00 54.33 C ATOM 928 C SER A 59 -10.738 -9.485 -4.859 1.00 72.14 C ATOM 929 O SER A 59 -10.872 -10.685 -5.112 1.00 20.22 O ATOM 930 CB SER A 59 -9.038 -7.674 -5.049 1.00 13.01 C ATOM 931 OG SER A 59 -9.010 -7.924 -6.444 1.00 52.32 O ATOM 0 H SER A 59 -7.873 -9.971 -5.242 1.00 63.41 H new ATOM 0 HA SER A 59 -9.599 -8.707 -3.221 1.00 54.33 H new ATOM 0 HB2 SER A 59 -9.748 -6.875 -4.833 1.00 13.01 H new ATOM 0 HB3 SER A 59 -8.059 -7.328 -4.718 1.00 13.01 H new ATOM 0 HG SER A 59 -8.566 -8.781 -6.614 1.00 52.32 H new ATOM 937 N GLN A 60 -11.703 -8.587 -5.071 1.00 23.45 N ATOM 938 CA GLN A 60 -13.004 -8.948 -5.646 1.00 43.03 C ATOM 939 C GLN A 60 -12.910 -9.184 -7.165 1.00 62.11 C ATOM 940 O GLN A 60 -13.720 -9.911 -7.737 1.00 11.15 O ATOM 941 CB GLN A 60 -14.027 -7.842 -5.353 1.00 74.04 C ATOM 942 CG GLN A 60 -14.231 -7.575 -3.865 1.00 34.52 C ATOM 943 CD GLN A 60 -15.186 -6.423 -3.600 1.00 72.53 C ATOM 944 OE1 GLN A 60 -16.391 -6.613 -3.483 1.00 44.23 O ATOM 945 NE2 GLN A 60 -14.655 -5.221 -3.509 1.00 10.31 N ATOM 0 H GLN A 60 -11.607 -7.596 -4.851 1.00 23.45 H new ATOM 0 HA GLN A 60 -13.326 -9.881 -5.183 1.00 43.03 H new ATOM 0 HB2 GLN A 60 -13.702 -6.921 -5.837 1.00 74.04 H new ATOM 0 HB3 GLN A 60 -14.983 -8.116 -5.798 1.00 74.04 H new ATOM 0 HG2 GLN A 60 -14.615 -8.477 -3.388 1.00 34.52 H new ATOM 0 HG3 GLN A 60 -13.268 -7.356 -3.404 1.00 34.52 H new ATOM 0 HE21 GLN A 60 -13.647 -5.099 -3.612 1.00 10.31 H new ATOM 0 HE22 GLN A 60 -15.251 -4.412 -3.336 1.00 10.31 H new ATOM 954 N ILE A 61 -11.928 -8.555 -7.812 1.00 52.24 N ATOM 955 CA ILE A 61 -11.713 -8.740 -9.254 1.00 63.21 C ATOM 956 C ILE A 61 -10.851 -9.982 -9.530 1.00 31.02 C ATOM 957 O ILE A 61 -10.917 -10.578 -10.608 1.00 54.45 O ATOM 958 CB ILE A 61 -11.032 -7.503 -9.902 1.00 1.53 C ATOM 959 CG1 ILE A 61 -9.605 -7.310 -9.353 1.00 5.21 C ATOM 960 CG2 ILE A 61 -11.873 -6.249 -9.667 1.00 73.03 C ATOM 961 CD1 ILE A 61 -8.849 -6.165 -9.994 1.00 51.43 C ATOM 0 H ILE A 61 -11.270 -7.915 -7.366 1.00 52.24 H new ATOM 0 HA ILE A 61 -12.699 -8.872 -9.699 1.00 63.21 H new ATOM 0 HB ILE A 61 -10.959 -7.676 -10.976 1.00 1.53 H new ATOM 0 HG12 ILE A 61 -9.660 -7.139 -8.278 1.00 5.21 H new ATOM 0 HG13 ILE A 61 -9.042 -8.232 -9.501 1.00 5.21 H new ATOM 0 HG21 ILE A 61 -11.383 -5.391 -10.127 1.00 73.03 H new ATOM 0 HG22 ILE A 61 -12.860 -6.384 -10.110 1.00 73.03 H new ATOM 0 HG23 ILE A 61 -11.977 -6.076 -8.596 1.00 73.03 H new ATOM 0 HD11 ILE A 61 -7.854 -6.094 -9.554 1.00 51.43 H new ATOM 0 HD12 ILE A 61 -8.760 -6.342 -11.066 1.00 51.43 H new ATOM 0 HD13 ILE A 61 -9.388 -5.233 -9.824 1.00 51.43 H new ATOM 973 N GLY A 62 -10.047 -10.360 -8.541 1.00 43.33 N ATOM 974 CA GLY A 62 -9.136 -11.484 -8.690 1.00 0.11 C ATOM 975 C GLY A 62 -7.846 -11.293 -7.900 1.00 24.12 C ATOM 976 O GLY A 62 -7.772 -10.434 -7.017 1.00 73.13 O ATOM 0 H GLY A 62 -10.010 -9.903 -7.630 1.00 43.33 H new ATOM 0 HA2 GLY A 62 -9.631 -12.396 -8.358 1.00 0.11 H new ATOM 0 HA3 GLY A 62 -8.897 -11.617 -9.745 1.00 0.11 H new ATOM 980 N THR A 63 -6.829 -12.087 -8.211 1.00 41.20 N ATOM 981 CA THR A 63 -5.535 -12.003 -7.518 1.00 64.12 C ATOM 982 C THR A 63 -4.562 -11.050 -8.231 1.00 73.34 C ATOM 983 O THR A 63 -4.278 -11.213 -9.418 1.00 5.14 O ATOM 984 CB THR A 63 -4.873 -13.399 -7.403 1.00 54.14 C ATOM 985 OG1 THR A 63 -5.711 -14.285 -6.644 1.00 4.24 O ATOM 986 CG2 THR A 63 -3.507 -13.315 -6.738 1.00 55.45 C ATOM 0 H THR A 63 -6.869 -12.800 -8.939 1.00 41.20 H new ATOM 0 HA THR A 63 -5.743 -11.612 -6.522 1.00 64.12 H new ATOM 0 HB THR A 63 -4.745 -13.784 -8.415 1.00 54.14 H new ATOM 0 HG1 THR A 63 -5.283 -15.164 -6.579 1.00 4.24 H new ATOM 0 HG21 THR A 63 -3.072 -14.312 -6.674 1.00 55.45 H new ATOM 0 HG22 THR A 63 -2.854 -12.671 -7.328 1.00 55.45 H new ATOM 0 HG23 THR A 63 -3.615 -12.901 -5.735 1.00 55.45 H new ATOM 994 N LEU A 64 -4.048 -10.062 -7.497 1.00 71.42 N ATOM 995 CA LEU A 64 -3.050 -9.127 -8.039 1.00 41.21 C ATOM 996 C LEU A 64 -1.896 -8.888 -7.047 1.00 30.12 C ATOM 997 O LEU A 64 -1.925 -9.368 -5.914 1.00 10.02 O ATOM 998 CB LEU A 64 -3.698 -7.787 -8.490 1.00 43.21 C ATOM 999 CG LEU A 64 -4.612 -7.029 -7.489 1.00 2.14 C ATOM 1000 CD1 LEU A 64 -5.872 -7.825 -7.166 1.00 42.41 C ATOM 1001 CD2 LEU A 64 -3.868 -6.651 -6.208 1.00 61.25 C ATOM 0 H LEU A 64 -4.304 -9.885 -6.525 1.00 71.42 H new ATOM 0 HA LEU A 64 -2.625 -9.595 -8.927 1.00 41.21 H new ATOM 0 HB2 LEU A 64 -2.893 -7.111 -8.780 1.00 43.21 H new ATOM 0 HB3 LEU A 64 -4.284 -7.988 -9.387 1.00 43.21 H new ATOM 0 HG LEU A 64 -4.914 -6.104 -7.980 1.00 2.14 H new ATOM 0 HD11 LEU A 64 -6.487 -7.263 -6.463 1.00 42.41 H new ATOM 0 HD12 LEU A 64 -6.436 -8.000 -8.082 1.00 42.41 H new ATOM 0 HD13 LEU A 64 -5.595 -8.781 -6.722 1.00 42.41 H new ATOM 0 HD21 LEU A 64 -4.545 -6.123 -5.537 1.00 61.25 H new ATOM 0 HD22 LEU A 64 -3.503 -7.554 -5.719 1.00 61.25 H new ATOM 0 HD23 LEU A 64 -3.024 -6.006 -6.454 1.00 61.25 H new ATOM 1013 N ARG A 65 -0.892 -8.129 -7.477 1.00 72.24 N ATOM 1014 CA ARG A 65 0.316 -7.896 -6.674 1.00 24.52 C ATOM 1015 C ARG A 65 0.669 -6.400 -6.617 1.00 33.34 C ATOM 1016 O ARG A 65 0.940 -5.784 -7.643 1.00 10.11 O ATOM 1017 CB ARG A 65 1.482 -8.683 -7.287 1.00 41.00 C ATOM 1018 CG ARG A 65 2.767 -8.644 -6.465 1.00 70.01 C ATOM 1019 CD ARG A 65 3.919 -9.326 -7.197 1.00 54.23 C ATOM 1020 NE ARG A 65 3.558 -10.659 -7.668 1.00 14.30 N ATOM 1021 CZ ARG A 65 4.376 -11.480 -8.265 1.00 63.24 C ATOM 1022 NH1 ARG A 65 5.623 -11.165 -8.438 1.00 44.11 N ATOM 1023 NH2 ARG A 65 3.934 -12.624 -8.674 1.00 4.30 N ATOM 0 H ARG A 65 -0.887 -7.660 -8.383 1.00 72.24 H new ATOM 0 HA ARG A 65 0.129 -8.234 -5.655 1.00 24.52 H new ATOM 0 HB2 ARG A 65 1.177 -9.722 -7.414 1.00 41.00 H new ATOM 0 HB3 ARG A 65 1.689 -8.288 -8.282 1.00 41.00 H new ATOM 0 HG2 ARG A 65 3.032 -7.609 -6.251 1.00 70.01 H new ATOM 0 HG3 ARG A 65 2.602 -9.135 -5.506 1.00 70.01 H new ATOM 0 HD2 ARG A 65 4.223 -8.712 -8.045 1.00 54.23 H new ATOM 0 HD3 ARG A 65 4.779 -9.398 -6.531 1.00 54.23 H new ATOM 0 HE ARG A 65 2.598 -10.970 -7.520 1.00 14.30 H new ATOM 0 HH11 ARG A 65 5.973 -10.267 -8.105 1.00 44.11 H new ATOM 0 HH12 ARG A 65 6.253 -11.816 -8.907 1.00 44.11 H new ATOM 0 HH21 ARG A 65 2.956 -12.875 -8.528 1.00 4.30 H new ATOM 0 HH22 ARG A 65 4.563 -13.276 -9.143 1.00 4.30 H new ATOM 1037 N MET A 66 0.684 -5.821 -5.419 1.00 64.43 N ATOM 1038 CA MET A 66 0.966 -4.384 -5.260 1.00 4.32 C ATOM 1039 C MET A 66 2.307 -4.127 -4.554 1.00 61.20 C ATOM 1040 O MET A 66 2.805 -4.973 -3.810 1.00 54.41 O ATOM 1041 CB MET A 66 -0.173 -3.702 -4.490 1.00 11.44 C ATOM 1042 CG MET A 66 -1.508 -3.729 -5.221 1.00 73.54 C ATOM 1043 SD MET A 66 -2.814 -2.884 -4.307 1.00 73.12 S ATOM 1044 CE MET A 66 -4.177 -2.999 -5.465 1.00 33.15 C ATOM 0 H MET A 66 0.506 -6.315 -4.545 1.00 64.43 H new ATOM 0 HA MET A 66 1.038 -3.957 -6.260 1.00 4.32 H new ATOM 0 HB2 MET A 66 -0.289 -4.190 -3.522 1.00 11.44 H new ATOM 0 HB3 MET A 66 0.103 -2.666 -4.293 1.00 11.44 H new ATOM 0 HG2 MET A 66 -1.393 -3.261 -6.199 1.00 73.54 H new ATOM 0 HG3 MET A 66 -1.802 -4.764 -5.395 1.00 73.54 H new ATOM 0 HE1 MET A 66 -4.756 -2.076 -5.439 1.00 33.15 H new ATOM 0 HE2 MET A 66 -3.788 -3.155 -6.471 1.00 33.15 H new ATOM 0 HE3 MET A 66 -4.818 -3.837 -5.190 1.00 33.15 H new ATOM 1054 N SER A 67 2.891 -2.956 -4.810 1.00 35.34 N ATOM 1055 CA SER A 67 4.142 -2.541 -4.152 1.00 74.33 C ATOM 1056 C SER A 67 4.343 -1.020 -4.247 1.00 4.35 C ATOM 1057 O SER A 67 3.629 -0.335 -4.989 1.00 3.11 O ATOM 1058 CB SER A 67 5.348 -3.265 -4.765 1.00 25.34 C ATOM 1059 OG SER A 67 6.541 -2.979 -4.046 1.00 73.11 O ATOM 0 H SER A 67 2.520 -2.272 -5.470 1.00 35.34 H new ATOM 0 HA SER A 67 4.064 -2.814 -3.100 1.00 74.33 H new ATOM 0 HB2 SER A 67 5.169 -4.340 -4.764 1.00 25.34 H new ATOM 0 HB3 SER A 67 5.466 -2.963 -5.806 1.00 25.34 H new ATOM 0 HG SER A 67 6.636 -3.612 -3.304 1.00 73.11 H new ATOM 1065 N LEU A 68 5.325 -0.499 -3.512 1.00 2.02 N ATOM 1066 CA LEU A 68 5.554 0.953 -3.418 1.00 52.41 C ATOM 1067 C LEU A 68 6.900 1.372 -4.037 1.00 51.42 C ATOM 1068 O LEU A 68 7.957 0.868 -3.658 1.00 52.32 O ATOM 1069 CB LEU A 68 5.511 1.397 -1.945 1.00 74.24 C ATOM 1070 CG LEU A 68 4.179 1.150 -1.216 1.00 51.31 C ATOM 1071 CD1 LEU A 68 4.282 1.553 0.254 1.00 72.54 C ATOM 1072 CD2 LEU A 68 3.043 1.902 -1.901 1.00 44.42 C ATOM 0 H LEU A 68 5.981 -1.060 -2.968 1.00 2.02 H new ATOM 0 HA LEU A 68 4.760 1.442 -3.983 1.00 52.41 H new ATOM 0 HB2 LEU A 68 6.302 0.878 -1.404 1.00 74.24 H new ATOM 0 HB3 LEU A 68 5.738 2.462 -1.898 1.00 74.24 H new ATOM 0 HG LEU A 68 3.960 0.083 -1.262 1.00 51.31 H new ATOM 0 HD11 LEU A 68 3.328 1.370 0.749 1.00 72.54 H new ATOM 0 HD12 LEU A 68 5.062 0.965 0.739 1.00 72.54 H new ATOM 0 HD13 LEU A 68 4.529 2.612 0.324 1.00 72.54 H new ATOM 0 HD21 LEU A 68 2.110 1.714 -1.370 1.00 44.42 H new ATOM 0 HD22 LEU A 68 3.257 2.971 -1.892 1.00 44.42 H new ATOM 0 HD23 LEU A 68 2.949 1.560 -2.932 1.00 44.42 H new ATOM 1084 N VAL A 69 6.850 2.303 -4.993 1.00 64.53 N ATOM 1085 CA VAL A 69 8.063 2.890 -5.590 1.00 34.21 C ATOM 1086 C VAL A 69 7.959 4.421 -5.661 1.00 64.41 C ATOM 1087 O VAL A 69 6.874 4.982 -5.510 1.00 23.13 O ATOM 1088 CB VAL A 69 8.323 2.355 -7.026 1.00 72.31 C ATOM 1089 CG1 VAL A 69 8.624 0.864 -7.021 1.00 51.04 C ATOM 1090 CG2 VAL A 69 7.140 2.652 -7.942 1.00 33.22 C ATOM 0 H VAL A 69 5.979 2.672 -5.375 1.00 64.53 H new ATOM 0 HA VAL A 69 8.891 2.599 -4.943 1.00 34.21 H new ATOM 0 HB VAL A 69 9.200 2.875 -7.411 1.00 72.31 H new ATOM 0 HG11 VAL A 69 8.800 0.525 -8.042 1.00 51.04 H new ATOM 0 HG12 VAL A 69 9.511 0.674 -6.417 1.00 51.04 H new ATOM 0 HG13 VAL A 69 7.776 0.323 -6.601 1.00 51.04 H new ATOM 0 HG21 VAL A 69 7.347 2.267 -8.941 1.00 33.22 H new ATOM 0 HG22 VAL A 69 6.245 2.172 -7.547 1.00 33.22 H new ATOM 0 HG23 VAL A 69 6.981 3.729 -7.994 1.00 33.22 H new ATOM 1100 N ASN A 70 9.097 5.090 -5.879 1.00 63.33 N ATOM 1101 CA ASN A 70 9.121 6.540 -6.147 1.00 31.42 C ATOM 1102 C ASN A 70 8.582 7.368 -4.965 1.00 23.24 C ATOM 1103 O ASN A 70 8.084 8.482 -5.144 1.00 10.34 O ATOM 1104 CB ASN A 70 8.318 6.823 -7.424 1.00 54.02 C ATOM 1105 CG ASN A 70 8.912 6.118 -8.632 1.00 23.32 C ATOM 1106 OD1 ASN A 70 10.126 6.068 -8.806 1.00 71.32 O ATOM 1107 ND2 ASN A 70 8.067 5.518 -9.446 1.00 11.15 N ATOM 0 H ASN A 70 10.018 4.652 -5.876 1.00 63.33 H new ATOM 0 HA ASN A 70 10.159 6.845 -6.283 1.00 31.42 H new ATOM 0 HB2 ASN A 70 7.287 6.498 -7.284 1.00 54.02 H new ATOM 0 HB3 ASN A 70 8.292 7.897 -7.606 1.00 54.02 H new ATOM 0 HD21 ASN A 70 8.417 4.993 -10.248 1.00 11.15 H new ATOM 0 HD22 ASN A 70 7.063 5.578 -9.274 1.00 11.15 H new ATOM 1114 N ILE A 71 8.727 6.832 -3.754 1.00 60.35 N ATOM 1115 CA ILE A 71 8.220 7.491 -2.545 1.00 32.14 C ATOM 1116 C ILE A 71 9.000 8.784 -2.240 1.00 24.04 C ATOM 1117 O ILE A 71 10.133 8.744 -1.755 1.00 51.43 O ATOM 1118 CB ILE A 71 8.300 6.548 -1.316 1.00 74.12 C ATOM 1119 CG1 ILE A 71 7.684 5.175 -1.645 1.00 62.03 C ATOM 1120 CG2 ILE A 71 7.597 7.176 -0.113 1.00 53.41 C ATOM 1121 CD1 ILE A 71 7.751 4.180 -0.503 1.00 14.13 C ATOM 0 H ILE A 71 9.192 5.941 -3.581 1.00 60.35 H new ATOM 0 HA ILE A 71 7.177 7.742 -2.737 1.00 32.14 H new ATOM 0 HB ILE A 71 9.350 6.401 -1.064 1.00 74.12 H new ATOM 0 HG12 ILE A 71 6.641 5.315 -1.931 1.00 62.03 H new ATOM 0 HG13 ILE A 71 8.198 4.755 -2.510 1.00 62.03 H new ATOM 0 HG21 ILE A 71 7.663 6.501 0.740 1.00 53.41 H new ATOM 0 HG22 ILE A 71 8.077 8.123 0.135 1.00 53.41 H new ATOM 0 HG23 ILE A 71 6.549 7.353 -0.356 1.00 53.41 H new ATOM 0 HD11 ILE A 71 7.297 3.239 -0.813 1.00 14.13 H new ATOM 0 HD12 ILE A 71 8.792 4.008 -0.231 1.00 14.13 H new ATOM 0 HD13 ILE A 71 7.212 4.577 0.357 1.00 14.13 H new ATOM 1133 N THR A 72 8.382 9.931 -2.523 1.00 35.04 N ATOM 1134 CA THR A 72 9.030 11.239 -2.332 1.00 21.51 C ATOM 1135 C THR A 72 8.070 12.285 -1.744 1.00 63.43 C ATOM 1136 O THR A 72 6.854 12.205 -1.933 1.00 22.51 O ATOM 1137 CB THR A 72 9.616 11.782 -3.662 1.00 43.54 C ATOM 1138 OG1 THR A 72 8.728 11.493 -4.758 1.00 60.10 O ATOM 1139 CG2 THR A 72 10.996 11.194 -3.938 1.00 15.14 C ATOM 0 H THR A 72 7.431 9.986 -2.887 1.00 35.04 H new ATOM 0 HA THR A 72 9.839 11.072 -1.621 1.00 21.51 H new ATOM 0 HB THR A 72 9.719 12.863 -3.564 1.00 43.54 H new ATOM 0 HG1 THR A 72 8.691 10.524 -4.902 1.00 60.10 H new ATOM 0 HG21 THR A 72 11.381 11.593 -4.877 1.00 15.14 H new ATOM 0 HG22 THR A 72 11.673 11.459 -3.126 1.00 15.14 H new ATOM 0 HG23 THR A 72 10.922 10.109 -4.009 1.00 15.14 H new ATOM 1147 N PRO A 73 8.621 13.285 -1.015 1.00 73.31 N ATOM 1148 CA PRO A 73 7.825 14.345 -0.356 1.00 24.52 C ATOM 1149 C PRO A 73 6.879 15.101 -1.312 1.00 52.24 C ATOM 1150 O PRO A 73 7.071 15.108 -2.532 1.00 41.14 O ATOM 1151 CB PRO A 73 8.895 15.294 0.205 1.00 60.40 C ATOM 1152 CG PRO A 73 10.114 14.447 0.358 1.00 74.22 C ATOM 1153 CD PRO A 73 10.069 13.456 -0.768 1.00 23.10 C ATOM 0 HA PRO A 73 7.158 13.924 0.396 1.00 24.52 H new ATOM 0 HB2 PRO A 73 9.076 16.130 -0.471 1.00 60.40 H new ATOM 0 HB3 PRO A 73 8.586 15.718 1.160 1.00 60.40 H new ATOM 0 HG2 PRO A 73 11.019 15.052 0.310 1.00 74.22 H new ATOM 0 HG3 PRO A 73 10.120 13.941 1.324 1.00 74.22 H new ATOM 0 HD2 PRO A 73 10.586 13.828 -1.652 1.00 23.10 H new ATOM 0 HD3 PRO A 73 10.544 12.514 -0.494 1.00 23.10 H new ATOM 1161 N ASP A 74 5.868 15.750 -0.738 1.00 72.05 N ATOM 1162 CA ASP A 74 4.834 16.447 -1.509 1.00 30.30 C ATOM 1163 C ASP A 74 4.274 17.653 -0.726 1.00 54.34 C ATOM 1164 O ASP A 74 4.406 17.723 0.497 1.00 3.23 O ATOM 1165 CB ASP A 74 3.719 15.445 -1.849 1.00 4.13 C ATOM 1166 CG ASP A 74 2.488 16.088 -2.458 1.00 20.14 C ATOM 1167 OD1 ASP A 74 2.486 16.351 -3.678 1.00 24.41 O ATOM 1168 OD2 ASP A 74 1.518 16.327 -1.718 1.00 61.10 O ATOM 0 H ASP A 74 5.740 15.809 0.272 1.00 72.05 H new ATOM 0 HA ASP A 74 5.268 16.839 -2.429 1.00 30.30 H new ATOM 0 HB2 ASP A 74 4.110 14.701 -2.543 1.00 4.13 H new ATOM 0 HB3 ASP A 74 3.430 14.914 -0.942 1.00 4.13 H new ATOM 1173 N ALA A 75 3.644 18.594 -1.437 1.00 75.23 N ATOM 1174 CA ALA A 75 3.075 19.799 -0.815 1.00 21.42 C ATOM 1175 C ALA A 75 2.010 19.457 0.241 1.00 52.33 C ATOM 1176 O ALA A 75 2.012 20.013 1.344 1.00 13.20 O ATOM 1177 CB ALA A 75 2.485 20.714 -1.883 1.00 13.43 C ATOM 0 H ALA A 75 3.514 18.546 -2.448 1.00 75.23 H new ATOM 0 HA ALA A 75 3.886 20.317 -0.303 1.00 21.42 H new ATOM 0 HB1 ALA A 75 2.067 21.603 -1.410 1.00 13.43 H new ATOM 0 HB2 ALA A 75 3.268 21.009 -2.582 1.00 13.43 H new ATOM 0 HB3 ALA A 75 1.698 20.185 -2.421 1.00 13.43 H new ATOM 1183 N ASP A 76 1.101 18.546 -0.096 1.00 51.22 N ATOM 1184 CA ASP A 76 0.064 18.104 0.840 1.00 42.11 C ATOM 1185 C ASP A 76 0.591 17.020 1.797 1.00 21.30 C ATOM 1186 O ASP A 76 0.146 16.920 2.945 1.00 15.43 O ATOM 1187 CB ASP A 76 -1.162 17.592 0.072 1.00 2.45 C ATOM 1188 CG ASP A 76 -1.937 18.723 -0.584 1.00 71.13 C ATOM 1189 OD1 ASP A 76 -1.612 19.100 -1.730 1.00 62.44 O ATOM 1190 OD2 ASP A 76 -2.869 19.257 0.055 1.00 35.22 O ATOM 0 H ASP A 76 1.059 18.097 -1.011 1.00 51.22 H new ATOM 0 HA ASP A 76 -0.229 18.963 1.444 1.00 42.11 H new ATOM 0 HB2 ASP A 76 -0.841 16.882 -0.691 1.00 2.45 H new ATOM 0 HB3 ASP A 76 -1.818 17.052 0.755 1.00 2.45 H new ATOM 1195 N GLY A 77 1.535 16.211 1.328 1.00 23.32 N ATOM 1196 CA GLY A 77 2.139 15.192 2.186 1.00 50.45 C ATOM 1197 C GLY A 77 3.292 14.441 1.526 1.00 52.25 C ATOM 1198 O GLY A 77 4.429 14.919 1.518 1.00 40.43 O ATOM 0 H GLY A 77 1.896 16.237 0.374 1.00 23.32 H new ATOM 0 HA2 GLY A 77 2.500 15.666 3.099 1.00 50.45 H new ATOM 0 HA3 GLY A 77 1.372 14.476 2.481 1.00 50.45 H new ATOM 1202 N THR A 78 3.005 13.258 0.982 1.00 12.31 N ATOM 1203 CA THR A 78 4.027 12.425 0.328 1.00 44.51 C ATOM 1204 C THR A 78 3.446 11.668 -0.876 1.00 10.31 C ATOM 1205 O THR A 78 2.445 10.961 -0.756 1.00 14.24 O ATOM 1206 CB THR A 78 4.647 11.397 1.314 1.00 30.51 C ATOM 1207 OG1 THR A 78 5.294 12.077 2.399 1.00 54.12 O ATOM 1208 CG2 THR A 78 5.659 10.490 0.614 1.00 23.01 C ATOM 0 H THR A 78 2.070 12.850 0.979 1.00 12.31 H new ATOM 0 HA THR A 78 4.806 13.106 -0.014 1.00 44.51 H new ATOM 0 HB THR A 78 3.834 10.780 1.697 1.00 30.51 H new ATOM 0 HG1 THR A 78 4.632 12.299 3.087 1.00 54.12 H new ATOM 0 HG21 THR A 78 6.073 9.783 1.333 1.00 23.01 H new ATOM 0 HG22 THR A 78 5.164 9.943 -0.188 1.00 23.01 H new ATOM 0 HG23 THR A 78 6.463 11.096 0.197 1.00 23.01 H new ATOM 1216 N THR A 79 4.076 11.822 -2.039 1.00 1.21 N ATOM 1217 CA THR A 79 3.640 11.123 -3.260 1.00 44.11 C ATOM 1218 C THR A 79 4.440 9.842 -3.498 1.00 12.45 C ATOM 1219 O THR A 79 5.664 9.824 -3.354 1.00 5.24 O ATOM 1220 CB THR A 79 3.792 12.009 -4.519 1.00 51.44 C ATOM 1221 OG1 THR A 79 5.148 12.479 -4.637 1.00 71.10 O ATOM 1222 CG2 THR A 79 2.832 13.192 -4.482 1.00 53.34 C ATOM 0 H THR A 79 4.890 12.423 -2.168 1.00 1.21 H new ATOM 0 HA THR A 79 2.589 10.883 -3.099 1.00 44.11 H new ATOM 0 HB THR A 79 3.546 11.400 -5.389 1.00 51.44 H new ATOM 0 HG1 THR A 79 5.232 13.037 -5.438 1.00 71.10 H new ATOM 0 HG21 THR A 79 2.963 13.795 -5.380 1.00 53.34 H new ATOM 0 HG22 THR A 79 1.806 12.827 -4.437 1.00 53.34 H new ATOM 0 HG23 THR A 79 3.039 13.801 -3.602 1.00 53.34 H new ATOM 1230 N LEU A 80 3.748 8.776 -3.882 1.00 30.53 N ATOM 1231 CA LEU A 80 4.403 7.519 -4.247 1.00 32.12 C ATOM 1232 C LEU A 80 3.651 6.814 -5.383 1.00 33.25 C ATOM 1233 O LEU A 80 2.456 7.037 -5.588 1.00 44.31 O ATOM 1234 CB LEU A 80 4.552 6.602 -3.012 1.00 1.55 C ATOM 1235 CG LEU A 80 3.281 6.357 -2.166 1.00 74.04 C ATOM 1236 CD1 LEU A 80 2.317 5.394 -2.858 1.00 3.32 C ATOM 1237 CD2 LEU A 80 3.658 5.832 -0.779 1.00 35.21 C ATOM 0 H LEU A 80 2.730 8.754 -3.950 1.00 30.53 H new ATOM 0 HA LEU A 80 5.403 7.750 -4.613 1.00 32.12 H new ATOM 0 HB2 LEU A 80 4.926 5.636 -3.350 1.00 1.55 H new ATOM 0 HB3 LEU A 80 5.315 7.030 -2.362 1.00 1.55 H new ATOM 0 HG LEU A 80 2.768 7.312 -2.056 1.00 74.04 H new ATOM 0 HD11 LEU A 80 1.437 5.248 -2.232 1.00 3.32 H new ATOM 0 HD12 LEU A 80 2.014 5.810 -3.819 1.00 3.32 H new ATOM 0 HD13 LEU A 80 2.812 4.436 -3.018 1.00 3.32 H new ATOM 0 HD21 LEU A 80 2.753 5.664 -0.195 1.00 35.21 H new ATOM 0 HD22 LEU A 80 4.203 4.894 -0.881 1.00 35.21 H new ATOM 0 HD23 LEU A 80 4.287 6.564 -0.272 1.00 35.21 H new ATOM 1249 N THR A 81 4.361 5.979 -6.134 1.00 3.14 N ATOM 1250 CA THR A 81 3.758 5.234 -7.245 1.00 23.34 C ATOM 1251 C THR A 81 3.337 3.828 -6.803 1.00 13.34 C ATOM 1252 O THR A 81 4.180 2.977 -6.503 1.00 60.10 O ATOM 1253 CB THR A 81 4.727 5.107 -8.447 1.00 3.01 C ATOM 1254 OG1 THR A 81 5.244 6.395 -8.819 1.00 23.41 O ATOM 1255 CG2 THR A 81 4.035 4.475 -9.651 1.00 52.25 C ATOM 0 H THR A 81 5.355 5.798 -5.997 1.00 3.14 H new ATOM 0 HA THR A 81 2.880 5.800 -7.556 1.00 23.34 H new ATOM 0 HB THR A 81 5.549 4.462 -8.136 1.00 3.01 H new ATOM 0 HG1 THR A 81 5.286 6.461 -9.796 1.00 23.41 H new ATOM 0 HG21 THR A 81 4.741 4.399 -10.478 1.00 52.25 H new ATOM 0 HG22 THR A 81 3.680 3.479 -9.385 1.00 52.25 H new ATOM 0 HG23 THR A 81 3.189 5.094 -9.951 1.00 52.25 H new ATOM 1263 N LEU A 82 2.031 3.592 -6.762 1.00 53.30 N ATOM 1264 CA LEU A 82 1.485 2.277 -6.413 1.00 35.32 C ATOM 1265 C LEU A 82 1.437 1.389 -7.670 1.00 54.05 C ATOM 1266 O LEU A 82 0.653 1.641 -8.587 1.00 20.23 O ATOM 1267 CB LEU A 82 0.080 2.448 -5.793 1.00 72.21 C ATOM 1268 CG LEU A 82 -0.511 1.232 -5.038 1.00 5.34 C ATOM 1269 CD1 LEU A 82 -0.932 0.119 -5.992 1.00 0.41 C ATOM 1270 CD2 LEU A 82 0.476 0.706 -4.001 1.00 43.32 C ATOM 0 H LEU A 82 1.323 4.297 -6.967 1.00 53.30 H new ATOM 0 HA LEU A 82 2.125 1.791 -5.677 1.00 35.32 H new ATOM 0 HB2 LEU A 82 0.115 3.290 -5.102 1.00 72.21 H new ATOM 0 HB3 LEU A 82 -0.611 2.719 -6.591 1.00 72.21 H new ATOM 0 HG LEU A 82 -1.407 1.577 -4.522 1.00 5.34 H new ATOM 0 HD11 LEU A 82 -1.341 -0.714 -5.421 1.00 0.41 H new ATOM 0 HD12 LEU A 82 -1.691 0.496 -6.678 1.00 0.41 H new ATOM 0 HD13 LEU A 82 -0.066 -0.221 -6.560 1.00 0.41 H new ATOM 0 HD21 LEU A 82 0.039 -0.148 -3.483 1.00 43.32 H new ATOM 0 HD22 LEU A 82 1.396 0.397 -4.498 1.00 43.32 H new ATOM 0 HD23 LEU A 82 0.699 1.492 -3.280 1.00 43.32 H new ATOM 1282 N ARG A 83 2.293 0.371 -7.723 1.00 4.54 N ATOM 1283 CA ARG A 83 2.345 -0.534 -8.881 1.00 14.21 C ATOM 1284 C ARG A 83 1.538 -1.814 -8.641 1.00 51.13 C ATOM 1285 O ARG A 83 1.729 -2.501 -7.638 1.00 34.52 O ATOM 1286 CB ARG A 83 3.798 -0.891 -9.230 1.00 71.11 C ATOM 1287 CG ARG A 83 4.616 0.298 -9.724 1.00 11.54 C ATOM 1288 CD ARG A 83 5.931 -0.141 -10.368 1.00 51.52 C ATOM 1289 NE ARG A 83 6.607 0.968 -11.040 1.00 73.22 N ATOM 1290 CZ ARG A 83 6.288 1.408 -12.228 1.00 2.23 C ATOM 1291 NH1 ARG A 83 5.344 0.845 -12.912 1.00 72.34 N ATOM 1292 NH2 ARG A 83 6.918 2.413 -12.733 1.00 62.34 N ATOM 0 H ARG A 83 2.960 0.148 -6.984 1.00 4.54 H new ATOM 0 HA ARG A 83 1.896 -0.004 -9.721 1.00 14.21 H new ATOM 0 HB2 ARG A 83 4.281 -1.313 -8.349 1.00 71.11 H new ATOM 0 HB3 ARG A 83 3.799 -1.666 -9.997 1.00 71.11 H new ATOM 0 HG2 ARG A 83 4.030 0.866 -10.447 1.00 11.54 H new ATOM 0 HG3 ARG A 83 4.826 0.966 -8.889 1.00 11.54 H new ATOM 0 HD2 ARG A 83 6.588 -0.557 -9.604 1.00 51.52 H new ATOM 0 HD3 ARG A 83 5.735 -0.936 -11.087 1.00 51.52 H new ATOM 0 HE ARG A 83 7.376 1.427 -10.551 1.00 73.22 H new ATOM 0 HH11 ARG A 83 4.839 0.048 -12.524 1.00 72.34 H new ATOM 0 HH12 ARG A 83 5.105 1.199 -13.838 1.00 72.34 H new ATOM 0 HH21 ARG A 83 7.665 2.864 -12.205 1.00 62.34 H new ATOM 0 HH22 ARG A 83 6.669 2.757 -13.661 1.00 62.34 H new ATOM 1306 N ILE A 84 0.637 -2.129 -9.576 1.00 11.44 N ATOM 1307 CA ILE A 84 -0.214 -3.321 -9.475 1.00 42.34 C ATOM 1308 C ILE A 84 0.114 -4.343 -10.575 1.00 24.34 C ATOM 1309 O ILE A 84 -0.334 -4.207 -11.716 1.00 63.02 O ATOM 1310 CB ILE A 84 -1.731 -2.982 -9.579 1.00 14.10 C ATOM 1311 CG1 ILE A 84 -2.110 -1.768 -8.706 1.00 25.14 C ATOM 1312 CG2 ILE A 84 -2.568 -4.200 -9.192 1.00 50.43 C ATOM 1313 CD1 ILE A 84 -1.788 -0.425 -9.338 1.00 13.34 C ATOM 0 H ILE A 84 0.477 -1.573 -10.416 1.00 11.44 H new ATOM 0 HA ILE A 84 -0.005 -3.742 -8.492 1.00 42.34 H new ATOM 0 HB ILE A 84 -1.942 -2.716 -10.615 1.00 14.10 H new ATOM 0 HG12 ILE A 84 -3.177 -1.809 -8.489 1.00 25.14 H new ATOM 0 HG13 ILE A 84 -1.588 -1.843 -7.752 1.00 25.14 H new ATOM 0 HG21 ILE A 84 -3.627 -3.953 -9.268 1.00 50.43 H new ATOM 0 HG22 ILE A 84 -2.339 -5.027 -9.864 1.00 50.43 H new ATOM 0 HG23 ILE A 84 -2.336 -4.490 -8.167 1.00 50.43 H new ATOM 0 HD11 ILE A 84 -2.085 0.376 -8.661 1.00 13.34 H new ATOM 0 HD12 ILE A 84 -0.717 -0.360 -9.529 1.00 13.34 H new ATOM 0 HD13 ILE A 84 -2.331 -0.326 -10.278 1.00 13.34 H new ATOM 1325 N GLN A 85 0.911 -5.347 -10.241 1.00 54.02 N ATOM 1326 CA GLN A 85 1.142 -6.483 -11.141 1.00 45.01 C ATOM 1327 C GLN A 85 0.042 -7.540 -10.945 1.00 21.13 C ATOM 1328 O GLN A 85 -0.878 -7.343 -10.150 1.00 64.12 O ATOM 1329 CB GLN A 85 2.523 -7.101 -10.878 1.00 2.23 C ATOM 1330 CG GLN A 85 3.685 -6.132 -11.083 1.00 22.23 C ATOM 1331 CD GLN A 85 5.040 -6.813 -10.971 1.00 73.02 C ATOM 1332 OE1 GLN A 85 5.631 -6.892 -9.897 1.00 71.34 O ATOM 1333 NE2 GLN A 85 5.546 -7.311 -12.082 1.00 25.31 N ATOM 0 H GLN A 85 1.412 -5.404 -9.354 1.00 54.02 H new ATOM 0 HA GLN A 85 1.112 -6.127 -12.171 1.00 45.01 H new ATOM 0 HB2 GLN A 85 2.553 -7.477 -9.855 1.00 2.23 H new ATOM 0 HB3 GLN A 85 2.658 -7.959 -11.537 1.00 2.23 H new ATOM 0 HG2 GLN A 85 3.596 -5.666 -12.065 1.00 22.23 H new ATOM 0 HG3 GLN A 85 3.622 -5.333 -10.344 1.00 22.23 H new ATOM 0 HE21 GLN A 85 5.031 -7.229 -12.958 1.00 25.31 H new ATOM 0 HE22 GLN A 85 6.453 -7.778 -12.065 1.00 25.31 H new ATOM 1342 N GLY A 86 0.124 -8.652 -11.670 1.00 64.21 N ATOM 1343 CA GLY A 86 -0.865 -9.715 -11.500 1.00 71.31 C ATOM 1344 C GLY A 86 -0.298 -11.121 -11.665 1.00 65.12 C ATOM 1345 O GLY A 86 0.470 -11.387 -12.592 1.00 55.40 O ATOM 0 H GLY A 86 0.846 -8.840 -12.365 1.00 64.21 H new ATOM 0 HA2 GLY A 86 -1.310 -9.628 -10.509 1.00 71.31 H new ATOM 0 HA3 GLY A 86 -1.667 -9.570 -12.224 1.00 71.31 H new ATOM 1349 N GLU A 87 -0.677 -12.023 -10.756 1.00 40.13 N ATOM 1350 CA GLU A 87 -0.337 -13.452 -10.869 1.00 31.42 C ATOM 1351 C GLU A 87 -0.887 -14.063 -12.170 1.00 14.22 C ATOM 1352 O GLU A 87 -0.384 -15.080 -12.654 1.00 70.02 O ATOM 1353 CB GLU A 87 -0.896 -14.234 -9.665 1.00 34.01 C ATOM 1354 CG GLU A 87 -0.059 -14.132 -8.390 1.00 63.43 C ATOM 1355 CD GLU A 87 0.237 -12.705 -7.956 1.00 51.15 C ATOM 1356 OE1 GLU A 87 -0.692 -11.874 -7.945 1.00 54.03 O ATOM 1357 OE2 GLU A 87 1.406 -12.419 -7.626 1.00 52.41 O ATOM 0 H GLU A 87 -1.223 -11.791 -9.927 1.00 40.13 H new ATOM 0 HA GLU A 87 0.750 -13.527 -10.884 1.00 31.42 H new ATOM 0 HB2 GLU A 87 -1.903 -13.874 -9.452 1.00 34.01 H new ATOM 0 HB3 GLU A 87 -0.985 -15.285 -9.942 1.00 34.01 H new ATOM 0 HG2 GLU A 87 -0.582 -14.645 -7.583 1.00 63.43 H new ATOM 0 HG3 GLU A 87 0.884 -14.657 -8.544 1.00 63.43 H new ATOM 1364 N SER A 88 -1.931 -13.447 -12.717 1.00 22.42 N ATOM 1365 CA SER A 88 -2.575 -13.940 -13.937 1.00 61.52 C ATOM 1366 C SER A 88 -1.841 -13.462 -15.196 1.00 2.14 C ATOM 1367 O SER A 88 -1.451 -12.297 -15.307 1.00 44.33 O ATOM 1368 CB SER A 88 -4.036 -13.474 -13.998 1.00 12.25 C ATOM 1369 OG SER A 88 -4.125 -12.056 -14.043 1.00 32.42 O ATOM 0 H SER A 88 -2.353 -12.601 -12.334 1.00 22.42 H new ATOM 0 HA SER A 88 -2.536 -15.029 -13.905 1.00 61.52 H new ATOM 0 HB2 SER A 88 -4.519 -13.899 -14.878 1.00 12.25 H new ATOM 0 HB3 SER A 88 -4.575 -13.847 -13.127 1.00 12.25 H new ATOM 0 HG SER A 88 -4.232 -11.764 -14.972 1.00 32.42 H new ATOM 1375 N ASN A 89 -1.656 -14.373 -16.149 1.00 24.11 N ATOM 1376 CA ASN A 89 -1.079 -14.027 -17.451 1.00 35.24 C ATOM 1377 C ASN A 89 -2.069 -13.161 -18.236 1.00 15.21 C ATOM 1378 O ASN A 89 -1.689 -12.222 -18.935 1.00 33.11 O ATOM 1379 CB ASN A 89 -0.756 -15.300 -18.242 1.00 51.45 C ATOM 1380 CG ASN A 89 0.053 -16.288 -17.427 1.00 70.54 C ATOM 1381 OD1 ASN A 89 1.280 -16.263 -17.429 1.00 52.02 O ATOM 1382 ND2 ASN A 89 -0.627 -17.170 -16.720 1.00 3.13 N ATOM 0 H ASN A 89 -1.897 -15.359 -16.046 1.00 24.11 H new ATOM 0 HA ASN A 89 -0.156 -13.469 -17.295 1.00 35.24 H new ATOM 0 HB2 ASN A 89 -1.684 -15.771 -18.564 1.00 51.45 H new ATOM 0 HB3 ASN A 89 -0.203 -15.036 -19.143 1.00 51.45 H new ATOM 0 HD21 ASN A 89 -0.133 -17.859 -16.153 1.00 3.13 H new ATOM 0 HD22 ASN A 89 -1.647 -17.163 -16.741 1.00 3.13 H new ATOM 1389 N ASP A 90 -3.348 -13.496 -18.094 1.00 75.31 N ATOM 1390 CA ASP A 90 -4.431 -12.743 -18.717 1.00 50.25 C ATOM 1391 C ASP A 90 -4.617 -11.373 -18.037 1.00 74.11 C ATOM 1392 O ASP A 90 -4.400 -11.233 -16.829 1.00 60.05 O ATOM 1393 CB ASP A 90 -5.727 -13.557 -18.637 1.00 45.44 C ATOM 1394 CG ASP A 90 -5.585 -14.917 -19.294 1.00 24.11 C ATOM 1395 OD1 ASP A 90 -5.674 -14.989 -20.536 1.00 64.42 O ATOM 1396 OD2 ASP A 90 -5.360 -15.918 -18.577 1.00 10.14 O ATOM 0 H ASP A 90 -3.662 -14.296 -17.545 1.00 75.31 H new ATOM 0 HA ASP A 90 -4.177 -12.564 -19.762 1.00 50.25 H new ATOM 0 HB2 ASP A 90 -6.010 -13.687 -17.592 1.00 45.44 H new ATOM 0 HB3 ASP A 90 -6.533 -13.004 -19.119 1.00 45.44 H new ATOM 1401 N PRO A 91 -5.033 -10.345 -18.801 1.00 70.34 N ATOM 1402 CA PRO A 91 -5.191 -8.976 -18.269 1.00 20.14 C ATOM 1403 C PRO A 91 -6.339 -8.842 -17.251 1.00 73.44 C ATOM 1404 O PRO A 91 -7.221 -9.701 -17.161 1.00 64.42 O ATOM 1405 CB PRO A 91 -5.478 -8.144 -19.526 1.00 41.22 C ATOM 1406 CG PRO A 91 -6.075 -9.112 -20.493 1.00 4.43 C ATOM 1407 CD PRO A 91 -5.386 -10.425 -20.234 1.00 21.55 C ATOM 0 HA PRO A 91 -4.308 -8.658 -17.715 1.00 20.14 H new ATOM 0 HB2 PRO A 91 -6.164 -7.325 -19.311 1.00 41.22 H new ATOM 0 HB3 PRO A 91 -4.566 -7.699 -19.923 1.00 41.22 H new ATOM 0 HG2 PRO A 91 -7.151 -9.199 -20.345 1.00 4.43 H new ATOM 0 HG3 PRO A 91 -5.920 -8.785 -21.521 1.00 4.43 H new ATOM 0 HD2 PRO A 91 -6.041 -11.271 -20.440 1.00 21.55 H new ATOM 0 HD3 PRO A 91 -4.502 -10.546 -20.860 1.00 21.55 H new ATOM 1415 N LEU A 92 -6.311 -7.755 -16.480 1.00 30.13 N ATOM 1416 CA LEU A 92 -7.344 -7.477 -15.473 1.00 33.42 C ATOM 1417 C LEU A 92 -8.077 -6.155 -15.778 1.00 43.34 C ATOM 1418 O LEU A 92 -7.475 -5.206 -16.290 1.00 44.20 O ATOM 1419 CB LEU A 92 -6.711 -7.416 -14.073 1.00 63.41 C ATOM 1420 CG LEU A 92 -6.026 -8.714 -13.597 1.00 1.11 C ATOM 1421 CD1 LEU A 92 -5.381 -8.516 -12.226 1.00 55.33 C ATOM 1422 CD2 LEU A 92 -7.026 -9.871 -13.560 1.00 14.15 C ATOM 0 H LEU A 92 -5.580 -7.046 -16.532 1.00 30.13 H new ATOM 0 HA LEU A 92 -8.074 -8.285 -15.504 1.00 33.42 H new ATOM 0 HB2 LEU A 92 -5.975 -6.612 -14.061 1.00 63.41 H new ATOM 0 HB3 LEU A 92 -7.486 -7.150 -13.354 1.00 63.41 H new ATOM 0 HG LEU A 92 -5.240 -8.963 -14.310 1.00 1.11 H new ATOM 0 HD11 LEU A 92 -4.904 -9.444 -11.911 1.00 55.33 H new ATOM 0 HD12 LEU A 92 -4.632 -7.726 -12.287 1.00 55.33 H new ATOM 0 HD13 LEU A 92 -6.146 -8.236 -11.501 1.00 55.33 H new ATOM 0 HD21 LEU A 92 -6.522 -10.777 -13.222 1.00 14.15 H new ATOM 0 HD22 LEU A 92 -7.837 -9.629 -12.873 1.00 14.15 H new ATOM 0 HD23 LEU A 92 -7.432 -10.033 -14.559 1.00 14.15 H new ATOM 1434 N PRO A 93 -9.391 -6.077 -15.470 1.00 54.45 N ATOM 1435 CA PRO A 93 -10.192 -4.858 -15.698 1.00 43.44 C ATOM 1436 C PRO A 93 -9.855 -3.722 -14.710 1.00 31.32 C ATOM 1437 O PRO A 93 -8.999 -3.876 -13.836 1.00 44.23 O ATOM 1438 CB PRO A 93 -11.632 -5.348 -15.491 1.00 1.34 C ATOM 1439 CG PRO A 93 -11.503 -6.480 -14.531 1.00 44.15 C ATOM 1440 CD PRO A 93 -10.205 -7.166 -14.882 1.00 41.21 C ATOM 0 HA PRO A 93 -10.005 -4.426 -16.681 1.00 43.44 H new ATOM 0 HB2 PRO A 93 -12.267 -4.558 -15.091 1.00 1.34 H new ATOM 0 HB3 PRO A 93 -12.080 -5.672 -16.430 1.00 1.34 H new ATOM 0 HG2 PRO A 93 -11.491 -6.121 -13.502 1.00 44.15 H new ATOM 0 HG3 PRO A 93 -12.345 -7.166 -14.619 1.00 44.15 H new ATOM 0 HD2 PRO A 93 -9.726 -7.595 -14.002 1.00 41.21 H new ATOM 0 HD3 PRO A 93 -10.359 -7.980 -15.590 1.00 41.21 H new ATOM 1448 N ALA A 94 -10.536 -2.584 -14.852 1.00 73.51 N ATOM 1449 CA ALA A 94 -10.291 -1.422 -13.991 1.00 12.41 C ATOM 1450 C ALA A 94 -10.845 -1.640 -12.575 1.00 65.41 C ATOM 1451 O ALA A 94 -11.805 -2.393 -12.373 1.00 11.23 O ATOM 1452 CB ALA A 94 -10.895 -0.167 -14.614 1.00 73.10 C ATOM 0 H ALA A 94 -11.262 -2.440 -15.554 1.00 73.51 H new ATOM 0 HA ALA A 94 -9.212 -1.292 -13.905 1.00 12.41 H new ATOM 0 HB1 ALA A 94 -10.706 0.688 -13.965 1.00 73.10 H new ATOM 0 HB2 ALA A 94 -10.441 0.010 -15.589 1.00 73.10 H new ATOM 0 HB3 ALA A 94 -11.970 -0.301 -14.734 1.00 73.10 H new ATOM 1458 N PHE A 95 -10.254 -0.958 -11.597 1.00 12.03 N ATOM 1459 CA PHE A 95 -10.613 -1.156 -10.188 1.00 53.52 C ATOM 1460 C PHE A 95 -10.247 0.067 -9.333 1.00 65.51 C ATOM 1461 O PHE A 95 -9.490 0.941 -9.760 1.00 11.25 O ATOM 1462 CB PHE A 95 -9.928 -2.414 -9.629 1.00 53.43 C ATOM 1463 CG PHE A 95 -8.417 -2.378 -9.696 1.00 14.00 C ATOM 1464 CD1 PHE A 95 -7.751 -2.733 -10.860 1.00 1.31 C ATOM 1465 CD2 PHE A 95 -7.663 -1.993 -8.594 1.00 71.51 C ATOM 1466 CE1 PHE A 95 -6.371 -2.705 -10.926 1.00 31.14 C ATOM 1467 CE2 PHE A 95 -6.283 -1.964 -8.655 1.00 25.11 C ATOM 1468 CZ PHE A 95 -5.636 -2.320 -9.823 1.00 54.04 C ATOM 0 H PHE A 95 -9.524 -0.262 -11.750 1.00 12.03 H new ATOM 0 HA PHE A 95 -11.694 -1.287 -10.141 1.00 53.52 H new ATOM 0 HB2 PHE A 95 -10.232 -2.549 -8.591 1.00 53.43 H new ATOM 0 HB3 PHE A 95 -10.285 -3.284 -10.181 1.00 53.43 H new ATOM 0 HD1 PHE A 95 -8.319 -3.036 -11.727 1.00 1.31 H new ATOM 0 HD2 PHE A 95 -8.162 -1.713 -7.678 1.00 71.51 H new ATOM 0 HE1 PHE A 95 -5.868 -2.984 -11.840 1.00 31.14 H new ATOM 0 HE2 PHE A 95 -5.710 -1.663 -7.790 1.00 25.11 H new ATOM 0 HZ PHE A 95 -4.557 -2.297 -9.873 1.00 54.04 H new ATOM 1478 N SER A 96 -10.799 0.124 -8.125 1.00 4.10 N ATOM 1479 CA SER A 96 -10.525 1.217 -7.180 1.00 23.24 C ATOM 1480 C SER A 96 -10.656 0.719 -5.735 1.00 3.21 C ATOM 1481 O SER A 96 -11.348 -0.264 -5.476 1.00 23.42 O ATOM 1482 CB SER A 96 -11.489 2.392 -7.415 1.00 2.22 C ATOM 1483 OG SER A 96 -11.328 2.954 -8.715 1.00 20.45 O ATOM 0 H SER A 96 -11.446 -0.579 -7.769 1.00 4.10 H new ATOM 0 HA SER A 96 -9.505 1.562 -7.346 1.00 23.24 H new ATOM 0 HB2 SER A 96 -12.517 2.050 -7.291 1.00 2.22 H new ATOM 0 HB3 SER A 96 -11.316 3.161 -6.662 1.00 2.22 H new ATOM 0 HG SER A 96 -12.207 3.176 -9.086 1.00 20.45 H new ATOM 1489 N GLY A 97 -9.994 1.390 -4.794 1.00 10.23 N ATOM 1490 CA GLY A 97 -10.049 0.952 -3.399 1.00 32.14 C ATOM 1491 C GLY A 97 -9.551 1.995 -2.404 1.00 74.34 C ATOM 1492 O GLY A 97 -9.117 3.083 -2.791 1.00 74.02 O ATOM 0 H GLY A 97 -9.426 2.220 -4.964 1.00 10.23 H new ATOM 0 HA2 GLY A 97 -11.077 0.690 -3.151 1.00 32.14 H new ATOM 0 HA3 GLY A 97 -9.453 0.046 -3.289 1.00 32.14 H new ATOM 1496 N THR A 98 -9.602 1.653 -1.118 1.00 32.10 N ATOM 1497 CA THR A 98 -9.183 2.565 -0.041 1.00 63.11 C ATOM 1498 C THR A 98 -7.815 2.161 0.523 1.00 63.33 C ATOM 1499 O THR A 98 -7.558 0.981 0.778 1.00 41.42 O ATOM 1500 CB THR A 98 -10.207 2.575 1.129 1.00 24.02 C ATOM 1501 OG1 THR A 98 -11.520 2.917 0.658 1.00 20.44 O ATOM 1502 CG2 THR A 98 -9.793 3.556 2.225 1.00 24.30 C ATOM 0 H THR A 98 -9.931 0.745 -0.789 1.00 32.10 H new ATOM 0 HA THR A 98 -9.125 3.560 -0.482 1.00 63.11 H new ATOM 0 HB THR A 98 -10.225 1.569 1.547 1.00 24.02 H new ATOM 0 HG1 THR A 98 -12.155 2.218 0.922 1.00 20.44 H new ATOM 0 HG21 THR A 98 -10.531 3.538 3.027 1.00 24.30 H new ATOM 0 HG22 THR A 98 -8.819 3.269 2.621 1.00 24.30 H new ATOM 0 HG23 THR A 98 -9.734 4.562 1.809 1.00 24.30 H new ATOM 1510 N VAL A 99 -6.937 3.141 0.725 1.00 52.03 N ATOM 1511 CA VAL A 99 -5.615 2.891 1.309 1.00 52.31 C ATOM 1512 C VAL A 99 -5.501 3.481 2.726 1.00 13.34 C ATOM 1513 O VAL A 99 -5.919 4.614 2.977 1.00 2.32 O ATOM 1514 CB VAL A 99 -4.483 3.461 0.413 1.00 23.11 C ATOM 1515 CG1 VAL A 99 -4.548 2.843 -0.979 1.00 1.21 C ATOM 1516 CG2 VAL A 99 -4.556 4.986 0.328 1.00 40.50 C ATOM 0 H VAL A 99 -7.115 4.118 0.493 1.00 52.03 H new ATOM 0 HA VAL A 99 -5.500 1.809 1.373 1.00 52.31 H new ATOM 0 HB VAL A 99 -3.528 3.199 0.869 1.00 23.11 H new ATOM 0 HG11 VAL A 99 -3.748 3.252 -1.596 1.00 1.21 H new ATOM 0 HG12 VAL A 99 -4.431 1.762 -0.903 1.00 1.21 H new ATOM 0 HG13 VAL A 99 -5.511 3.072 -1.434 1.00 1.21 H new ATOM 0 HG21 VAL A 99 -3.750 5.354 -0.307 1.00 40.50 H new ATOM 0 HG22 VAL A 99 -5.516 5.281 -0.096 1.00 40.50 H new ATOM 0 HG23 VAL A 99 -4.455 5.411 1.326 1.00 40.50 H new ATOM 1526 N GLU A 100 -4.949 2.690 3.644 1.00 50.42 N ATOM 1527 CA GLU A 100 -4.720 3.120 5.032 1.00 2.51 C ATOM 1528 C GLU A 100 -3.234 3.441 5.248 1.00 51.32 C ATOM 1529 O GLU A 100 -2.385 2.570 5.081 1.00 13.35 O ATOM 1530 CB GLU A 100 -5.122 1.998 6.005 1.00 42.41 C ATOM 1531 CG GLU A 100 -6.497 1.390 5.752 1.00 53.11 C ATOM 1532 CD GLU A 100 -7.643 2.195 6.344 1.00 2.41 C ATOM 1533 OE1 GLU A 100 -7.840 2.125 7.577 1.00 32.02 O ATOM 1534 OE2 GLU A 100 -8.368 2.861 5.578 1.00 35.05 O ATOM 0 H GLU A 100 -4.647 1.735 3.453 1.00 50.42 H new ATOM 0 HA GLU A 100 -5.323 4.009 5.219 1.00 2.51 H new ATOM 0 HB2 GLU A 100 -4.375 1.206 5.951 1.00 42.41 H new ATOM 0 HB3 GLU A 100 -5.096 2.392 7.021 1.00 42.41 H new ATOM 0 HG2 GLU A 100 -6.650 1.295 4.677 1.00 53.11 H new ATOM 0 HG3 GLU A 100 -6.520 0.383 6.168 1.00 53.11 H new ATOM 1541 N TYR A 101 -2.914 4.672 5.625 1.00 74.03 N ATOM 1542 CA TYR A 101 -1.511 5.056 5.842 1.00 24.12 C ATOM 1543 C TYR A 101 -1.320 5.833 7.150 1.00 52.22 C ATOM 1544 O TYR A 101 -2.038 6.794 7.434 1.00 44.43 O ATOM 1545 CB TYR A 101 -0.978 5.860 4.645 1.00 45.23 C ATOM 1546 CG TYR A 101 -1.859 7.022 4.217 1.00 52.34 C ATOM 1547 CD1 TYR A 101 -3.030 6.802 3.496 1.00 41.02 C ATOM 1548 CD2 TYR A 101 -1.514 8.338 4.514 1.00 1.10 C ATOM 1549 CE1 TYR A 101 -3.825 7.852 3.087 1.00 23.12 C ATOM 1550 CE2 TYR A 101 -2.302 9.394 4.103 1.00 11.54 C ATOM 1551 CZ TYR A 101 -3.459 9.146 3.389 1.00 43.15 C ATOM 1552 OH TYR A 101 -4.249 10.195 2.967 1.00 21.01 O ATOM 0 H TYR A 101 -3.591 5.418 5.787 1.00 74.03 H new ATOM 0 HA TYR A 101 -0.933 4.136 5.930 1.00 24.12 H new ATOM 0 HB2 TYR A 101 0.011 6.244 4.894 1.00 45.23 H new ATOM 0 HB3 TYR A 101 -0.853 5.185 3.798 1.00 45.23 H new ATOM 0 HD1 TYR A 101 -3.321 5.791 3.253 1.00 41.02 H new ATOM 0 HD2 TYR A 101 -0.613 8.536 5.076 1.00 1.10 H new ATOM 0 HE1 TYR A 101 -4.731 7.661 2.532 1.00 23.12 H new ATOM 0 HE2 TYR A 101 -2.016 10.409 4.338 1.00 11.54 H new ATOM 0 HH TYR A 101 -5.194 9.950 3.056 1.00 21.01 H new ATOM 1562 N GLY A 102 -0.341 5.394 7.941 1.00 14.10 N ATOM 1563 CA GLY A 102 -0.052 6.024 9.223 1.00 21.42 C ATOM 1564 C GLY A 102 1.219 5.480 9.872 1.00 60.44 C ATOM 1565 O GLY A 102 2.093 4.941 9.185 1.00 72.12 O ATOM 0 H GLY A 102 0.264 4.604 7.714 1.00 14.10 H new ATOM 0 HA2 GLY A 102 0.049 7.100 9.080 1.00 21.42 H new ATOM 0 HA3 GLY A 102 -0.894 5.870 9.897 1.00 21.42 H new ATOM 1569 N GLN A 103 1.318 5.604 11.196 1.00 2.40 N ATOM 1570 CA GLN A 103 2.509 5.165 11.939 1.00 74.22 C ATOM 1571 C GLN A 103 2.205 3.936 12.819 1.00 24.53 C ATOM 1572 O GLN A 103 1.079 3.755 13.280 1.00 3.42 O ATOM 1573 CB GLN A 103 3.019 6.304 12.836 1.00 44.13 C ATOM 1574 CG GLN A 103 3.099 7.661 12.150 1.00 33.41 C ATOM 1575 CD GLN A 103 3.574 8.763 13.085 1.00 45.34 C ATOM 1576 OE1 GLN A 103 3.381 8.696 14.295 1.00 53.24 O ATOM 1577 NE2 GLN A 103 4.186 9.790 12.534 1.00 22.13 N ATOM 0 H GLN A 103 0.586 6.006 11.782 1.00 2.40 H new ATOM 0 HA GLN A 103 3.270 4.892 11.208 1.00 74.22 H new ATOM 0 HB2 GLN A 103 2.364 6.388 13.703 1.00 44.13 H new ATOM 0 HB3 GLN A 103 4.009 6.041 13.209 1.00 44.13 H new ATOM 0 HG2 GLN A 103 3.777 7.594 11.299 1.00 33.41 H new ATOM 0 HG3 GLN A 103 2.117 7.923 11.755 1.00 33.41 H new ATOM 0 HE21 GLN A 103 4.331 9.816 11.525 1.00 22.13 H new ATOM 0 HE22 GLN A 103 4.515 10.560 13.116 1.00 22.13 H new ATOM 1586 N ILE A 104 3.221 3.106 13.060 1.00 22.10 N ATOM 1587 CA ILE A 104 3.091 1.951 13.962 1.00 1.21 C ATOM 1588 C ILE A 104 3.985 2.123 15.204 1.00 31.34 C ATOM 1589 O ILE A 104 5.206 2.010 15.122 1.00 55.22 O ATOM 1590 CB ILE A 104 3.467 0.626 13.245 1.00 60.11 C ATOM 1591 CG1 ILE A 104 2.576 0.405 12.009 1.00 55.42 C ATOM 1592 CG2 ILE A 104 3.357 -0.559 14.209 1.00 4.21 C ATOM 1593 CD1 ILE A 104 2.921 -0.843 11.219 1.00 1.35 C ATOM 0 H ILE A 104 4.147 3.209 12.644 1.00 22.10 H new ATOM 0 HA ILE A 104 2.046 1.901 14.270 1.00 1.21 H new ATOM 0 HB ILE A 104 4.502 0.700 12.911 1.00 60.11 H new ATOM 0 HG12 ILE A 104 1.536 0.345 12.329 1.00 55.42 H new ATOM 0 HG13 ILE A 104 2.658 1.272 11.354 1.00 55.42 H new ATOM 0 HG21 ILE A 104 3.624 -1.478 13.688 1.00 4.21 H new ATOM 0 HG22 ILE A 104 4.034 -0.408 15.050 1.00 4.21 H new ATOM 0 HG23 ILE A 104 2.334 -0.635 14.577 1.00 4.21 H new ATOM 0 HD11 ILE A 104 2.250 -0.930 10.364 1.00 1.35 H new ATOM 0 HD12 ILE A 104 3.951 -0.778 10.867 1.00 1.35 H new ATOM 0 HD13 ILE A 104 2.811 -1.720 11.857 1.00 1.35 H new ATOM 1605 N GLN A 105 3.373 2.408 16.356 1.00 71.13 N ATOM 1606 CA GLN A 105 4.134 2.641 17.596 1.00 22.23 C ATOM 1607 C GLN A 105 4.278 1.372 18.456 1.00 20.52 C ATOM 1608 O GLN A 105 4.995 1.376 19.461 1.00 71.14 O ATOM 1609 CB GLN A 105 3.471 3.745 18.431 1.00 1.01 C ATOM 1610 CG GLN A 105 2.021 3.457 18.814 1.00 34.44 C ATOM 1611 CD GLN A 105 1.487 4.401 19.885 1.00 62.12 C ATOM 1612 OE1 GLN A 105 0.606 4.042 20.658 1.00 22.23 O ATOM 1613 NE2 GLN A 105 2.020 5.607 19.948 1.00 34.43 N ATOM 0 H GLN A 105 2.361 2.484 16.461 1.00 71.13 H new ATOM 0 HA GLN A 105 5.134 2.949 17.291 1.00 22.23 H new ATOM 0 HB2 GLN A 105 4.052 3.895 19.341 1.00 1.01 H new ATOM 0 HB3 GLN A 105 3.508 4.680 17.871 1.00 1.01 H new ATOM 0 HG2 GLN A 105 1.395 3.534 17.925 1.00 34.44 H new ATOM 0 HG3 GLN A 105 1.943 2.430 19.171 1.00 34.44 H new ATOM 0 HE21 GLN A 105 2.752 5.876 19.290 1.00 34.43 H new ATOM 0 HE22 GLN A 105 1.700 6.270 20.654 1.00 34.43 H new ATOM 1622 N GLY A 106 3.605 0.292 18.066 1.00 23.31 N ATOM 1623 CA GLY A 106 3.615 -0.932 18.869 1.00 23.13 C ATOM 1624 C GLY A 106 4.544 -2.013 18.320 1.00 20.53 C ATOM 1625 O GLY A 106 5.338 -1.762 17.412 1.00 75.24 O ATOM 0 H GLY A 106 3.052 0.237 17.211 1.00 23.31 H new ATOM 0 HA2 GLY A 106 3.918 -0.687 19.887 1.00 23.13 H new ATOM 0 HA3 GLY A 106 2.601 -1.329 18.925 1.00 23.13 H new ATOM 1629 N THR A 107 4.445 -3.216 18.882 1.00 70.14 N ATOM 1630 CA THR A 107 5.258 -4.358 18.438 1.00 15.44 C ATOM 1631 C THR A 107 4.484 -5.230 17.444 1.00 30.12 C ATOM 1632 O THR A 107 3.295 -5.023 17.218 1.00 35.00 O ATOM 1633 CB THR A 107 5.692 -5.255 19.627 1.00 71.34 C ATOM 1634 OG1 THR A 107 4.555 -5.947 20.167 1.00 62.30 O ATOM 1635 CG2 THR A 107 6.359 -4.430 20.724 1.00 50.53 C ATOM 0 H THR A 107 3.808 -3.431 19.649 1.00 70.14 H new ATOM 0 HA THR A 107 6.143 -3.937 17.961 1.00 15.44 H new ATOM 0 HB THR A 107 6.414 -5.981 19.253 1.00 71.34 H new ATOM 0 HG1 THR A 107 4.841 -6.511 20.916 1.00 62.30 H new ATOM 0 HG21 THR A 107 6.653 -5.085 21.544 1.00 50.53 H new ATOM 0 HG22 THR A 107 7.243 -3.935 20.321 1.00 50.53 H new ATOM 0 HG23 THR A 107 5.659 -3.680 21.092 1.00 50.53 H new ATOM 1643 N ILE A 108 5.158 -6.218 16.862 1.00 15.24 N ATOM 1644 CA ILE A 108 4.501 -7.151 15.936 1.00 74.21 C ATOM 1645 C ILE A 108 3.418 -7.972 16.656 1.00 23.42 C ATOM 1646 O ILE A 108 2.455 -8.437 16.040 1.00 32.43 O ATOM 1647 CB ILE A 108 5.525 -8.118 15.287 1.00 51.13 C ATOM 1648 CG1 ILE A 108 6.723 -7.336 14.727 1.00 42.54 C ATOM 1649 CG2 ILE A 108 4.866 -8.950 14.185 1.00 4.22 C ATOM 1650 CD1 ILE A 108 6.341 -6.271 13.725 1.00 2.34 C ATOM 0 H ILE A 108 6.151 -6.397 17.010 1.00 15.24 H new ATOM 0 HA ILE A 108 4.037 -6.550 15.154 1.00 74.21 H new ATOM 0 HB ILE A 108 5.885 -8.799 16.058 1.00 51.13 H new ATOM 0 HG12 ILE A 108 7.259 -6.869 15.553 1.00 42.54 H new ATOM 0 HG13 ILE A 108 7.413 -8.035 14.255 1.00 42.54 H new ATOM 0 HG21 ILE A 108 5.604 -9.621 13.745 1.00 4.22 H new ATOM 0 HG22 ILE A 108 4.051 -9.536 14.610 1.00 4.22 H new ATOM 0 HG23 ILE A 108 4.473 -8.287 13.414 1.00 4.22 H new ATOM 0 HD11 ILE A 108 7.239 -5.762 13.375 1.00 2.34 H new ATOM 0 HD12 ILE A 108 5.832 -6.733 12.879 1.00 2.34 H new ATOM 0 HD13 ILE A 108 5.676 -5.549 14.198 1.00 2.34 H new ATOM 1662 N ASP A 109 3.591 -8.136 17.967 1.00 35.11 N ATOM 1663 CA ASP A 109 2.642 -8.873 18.801 1.00 74.55 C ATOM 1664 C ASP A 109 1.461 -7.967 19.206 1.00 42.01 C ATOM 1665 O ASP A 109 0.302 -8.387 19.189 1.00 11.33 O ATOM 1666 CB ASP A 109 3.369 -9.410 20.043 1.00 1.11 C ATOM 1667 CG ASP A 109 2.577 -10.475 20.780 1.00 33.34 C ATOM 1668 OD1 ASP A 109 2.674 -11.661 20.401 1.00 62.30 O ATOM 1669 OD2 ASP A 109 1.862 -10.137 21.745 1.00 34.13 O ATOM 0 H ASP A 109 4.390 -7.763 18.480 1.00 35.11 H new ATOM 0 HA ASP A 109 2.239 -9.712 18.234 1.00 74.55 H new ATOM 0 HB2 ASP A 109 4.332 -9.824 19.743 1.00 1.11 H new ATOM 0 HB3 ASP A 109 3.575 -8.583 20.722 1.00 1.11 H new ATOM 1674 N ASN A 110 1.769 -6.717 19.555 1.00 55.01 N ATOM 1675 CA ASN A 110 0.744 -5.730 19.919 1.00 71.24 C ATOM 1676 C ASN A 110 1.064 -4.340 19.334 1.00 23.30 C ATOM 1677 O ASN A 110 1.860 -3.582 19.890 1.00 55.35 O ATOM 1678 CB ASN A 110 0.587 -5.656 21.449 1.00 31.34 C ATOM 1679 CG ASN A 110 1.910 -5.483 22.184 1.00 55.42 C ATOM 1680 OD1 ASN A 110 2.567 -6.453 22.549 1.00 63.03 O ATOM 1681 ND2 ASN A 110 2.311 -4.250 22.414 1.00 34.14 N ATOM 0 H ASN A 110 2.724 -6.360 19.594 1.00 55.01 H new ATOM 0 HA ASN A 110 -0.202 -6.057 19.488 1.00 71.24 H new ATOM 0 HB2 ASN A 110 -0.071 -4.824 21.700 1.00 31.34 H new ATOM 0 HB3 ASN A 110 0.100 -6.565 21.801 1.00 31.34 H new ATOM 0 HD21 ASN A 110 3.188 -4.083 22.907 1.00 34.14 H new ATOM 0 HD22 ASN A 110 1.745 -3.462 22.099 1.00 34.14 H new ATOM 1688 N PHE A 111 0.445 -4.008 18.199 1.00 15.12 N ATOM 1689 CA PHE A 111 0.708 -2.729 17.524 1.00 34.42 C ATOM 1690 C PHE A 111 -0.530 -1.821 17.479 1.00 11.22 C ATOM 1691 O PHE A 111 -1.669 -2.291 17.476 1.00 35.12 O ATOM 1692 CB PHE A 111 1.243 -2.967 16.099 1.00 32.14 C ATOM 1693 CG PHE A 111 0.354 -3.828 15.232 1.00 63.22 C ATOM 1694 CD1 PHE A 111 0.484 -5.212 15.240 1.00 44.12 C ATOM 1695 CD2 PHE A 111 -0.608 -3.257 14.407 1.00 43.11 C ATOM 1696 CE1 PHE A 111 -0.324 -6.002 14.447 1.00 12.43 C ATOM 1697 CE2 PHE A 111 -1.419 -4.048 13.613 1.00 1.44 C ATOM 1698 CZ PHE A 111 -1.277 -5.422 13.632 1.00 21.55 C ATOM 0 H PHE A 111 -0.238 -4.601 17.728 1.00 15.12 H new ATOM 0 HA PHE A 111 1.467 -2.213 18.113 1.00 34.42 H new ATOM 0 HB2 PHE A 111 1.381 -2.002 15.611 1.00 32.14 H new ATOM 0 HB3 PHE A 111 2.226 -3.434 16.167 1.00 32.14 H new ATOM 0 HD1 PHE A 111 1.226 -5.675 15.874 1.00 44.12 H new ATOM 0 HD2 PHE A 111 -0.724 -2.183 14.386 1.00 43.11 H new ATOM 0 HE1 PHE A 111 -0.211 -7.076 14.464 1.00 12.43 H new ATOM 0 HE2 PHE A 111 -2.164 -3.591 12.978 1.00 1.44 H new ATOM 0 HZ PHE A 111 -1.909 -6.041 13.012 1.00 21.55 H new ATOM 1708 N GLN A 112 -0.287 -0.512 17.460 1.00 21.10 N ATOM 1709 CA GLN A 112 -1.353 0.488 17.329 1.00 3.15 C ATOM 1710 C GLN A 112 -1.041 1.457 16.182 1.00 4.03 C ATOM 1711 O GLN A 112 0.000 2.123 16.188 1.00 63.20 O ATOM 1712 CB GLN A 112 -1.521 1.278 18.638 1.00 73.14 C ATOM 1713 CG GLN A 112 -1.919 0.422 19.836 1.00 14.54 C ATOM 1714 CD GLN A 112 -2.110 1.226 21.115 1.00 72.52 C ATOM 1715 OE1 GLN A 112 -1.879 0.728 22.212 1.00 11.12 O ATOM 1716 NE2 GLN A 112 -2.556 2.464 20.997 1.00 41.00 N ATOM 0 H GLN A 112 0.649 -0.113 17.534 1.00 21.10 H new ATOM 0 HA GLN A 112 -2.283 -0.038 17.111 1.00 3.15 H new ATOM 0 HB2 GLN A 112 -0.585 1.788 18.865 1.00 73.14 H new ATOM 0 HB3 GLN A 112 -2.276 2.050 18.490 1.00 73.14 H new ATOM 0 HG2 GLN A 112 -2.845 -0.105 19.605 1.00 14.54 H new ATOM 0 HG3 GLN A 112 -1.153 -0.336 20.003 1.00 14.54 H new ATOM 0 HE21 GLN A 112 -2.740 2.854 20.073 1.00 41.00 H new ATOM 0 HE22 GLN A 112 -2.716 3.030 21.830 1.00 41.00 H new ATOM 1725 N GLU A 113 -1.928 1.519 15.192 1.00 22.00 N ATOM 1726 CA GLU A 113 -1.763 2.441 14.066 1.00 41.12 C ATOM 1727 C GLU A 113 -2.169 3.870 14.466 1.00 0.33 C ATOM 1728 O GLU A 113 -3.355 4.177 14.593 1.00 64.12 O ATOM 1729 CB GLU A 113 -2.593 1.982 12.851 1.00 23.34 C ATOM 1730 CG GLU A 113 -2.355 0.526 12.427 1.00 2.14 C ATOM 1731 CD GLU A 113 -3.321 -0.454 13.081 1.00 50.00 C ATOM 1732 OE1 GLU A 113 -3.107 -0.821 14.254 1.00 53.54 O ATOM 1733 OE2 GLU A 113 -4.309 -0.851 12.421 1.00 24.01 O ATOM 0 H GLU A 113 -2.769 0.943 15.145 1.00 22.00 H new ATOM 0 HA GLU A 113 -0.709 2.439 13.789 1.00 41.12 H new ATOM 0 HB2 GLU A 113 -3.651 2.111 13.080 1.00 23.34 H new ATOM 0 HB3 GLU A 113 -2.368 2.634 12.007 1.00 23.34 H new ATOM 0 HG2 GLU A 113 -2.448 0.450 11.344 1.00 2.14 H new ATOM 0 HG3 GLU A 113 -1.333 0.243 12.680 1.00 2.14 H new ATOM 1740 N ILE A 114 -1.178 4.735 14.680 1.00 15.50 N ATOM 1741 CA ILE A 114 -1.427 6.130 15.082 1.00 64.00 C ATOM 1742 C ILE A 114 -1.193 7.106 13.917 1.00 45.24 C ATOM 1743 O ILE A 114 -0.406 6.826 13.015 1.00 74.01 O ATOM 1744 CB ILE A 114 -0.528 6.547 16.273 1.00 64.51 C ATOM 1745 CG1 ILE A 114 0.961 6.395 15.909 1.00 22.25 C ATOM 1746 CG2 ILE A 114 -0.875 5.727 17.517 1.00 3.52 C ATOM 1747 CD1 ILE A 114 1.912 6.925 16.963 1.00 73.12 C ATOM 0 H ILE A 114 -0.191 4.499 14.583 1.00 15.50 H new ATOM 0 HA ILE A 114 -2.473 6.180 15.386 1.00 64.00 H new ATOM 0 HB ILE A 114 -0.714 7.598 16.496 1.00 64.51 H new ATOM 0 HG12 ILE A 114 1.176 5.340 15.738 1.00 22.25 H new ATOM 0 HG13 ILE A 114 1.150 6.915 14.970 1.00 22.25 H new ATOM 0 HG21 ILE A 114 -0.234 6.032 18.344 1.00 3.52 H new ATOM 0 HG22 ILE A 114 -1.918 5.895 17.784 1.00 3.52 H new ATOM 0 HG23 ILE A 114 -0.720 4.668 17.310 1.00 3.52 H new ATOM 0 HD11 ILE A 114 2.940 6.781 16.631 1.00 73.12 H new ATOM 0 HD12 ILE A 114 1.727 7.988 17.119 1.00 73.12 H new ATOM 0 HD13 ILE A 114 1.754 6.388 17.898 1.00 73.12 H new ATOM 1759 N ASN A 115 -1.878 8.254 13.954 1.00 14.45 N ATOM 1760 CA ASN A 115 -1.785 9.264 12.883 1.00 41.32 C ATOM 1761 C ASN A 115 -2.168 8.661 11.520 1.00 70.14 C ATOM 1762 O ASN A 115 -1.711 9.115 10.470 1.00 4.54 O ATOM 1763 CB ASN A 115 -0.372 9.864 12.824 1.00 53.23 C ATOM 1764 CG ASN A 115 0.036 10.514 14.133 1.00 63.42 C ATOM 1765 OD1 ASN A 115 -0.258 11.679 14.382 1.00 22.53 O ATOM 1766 ND2 ASN A 115 0.737 9.780 14.972 1.00 3.32 N ATOM 0 H ASN A 115 -2.506 8.512 14.715 1.00 14.45 H new ATOM 0 HA ASN A 115 -2.492 10.061 13.113 1.00 41.32 H new ATOM 0 HB2 ASN A 115 0.342 9.080 12.573 1.00 53.23 H new ATOM 0 HB3 ASN A 115 -0.328 10.604 12.025 1.00 53.23 H new ATOM 0 HD21 ASN A 115 1.051 10.177 15.857 1.00 3.32 H new ATOM 0 HD22 ASN A 115 0.966 8.814 14.737 1.00 3.32 H new ATOM 1773 N VAL A 116 -3.028 7.643 11.554 1.00 12.20 N ATOM 1774 CA VAL A 116 -3.440 6.930 10.344 1.00 31.34 C ATOM 1775 C VAL A 116 -4.713 7.532 9.728 1.00 10.15 C ATOM 1776 O VAL A 116 -5.660 7.878 10.431 1.00 3.23 O ATOM 1777 CB VAL A 116 -3.665 5.418 10.629 1.00 10.14 C ATOM 1778 CG1 VAL A 116 -4.729 5.215 11.706 1.00 52.12 C ATOM 1779 CG2 VAL A 116 -4.032 4.667 9.346 1.00 10.30 C ATOM 0 H VAL A 116 -3.455 7.292 12.411 1.00 12.20 H new ATOM 0 HA VAL A 116 -2.626 7.040 9.627 1.00 31.34 H new ATOM 0 HB VAL A 116 -2.728 5.005 11.003 1.00 10.14 H new ATOM 0 HG11 VAL A 116 -4.866 4.149 11.885 1.00 52.12 H new ATOM 0 HG12 VAL A 116 -4.410 5.700 12.629 1.00 52.12 H new ATOM 0 HG13 VAL A 116 -5.671 5.651 11.374 1.00 52.12 H new ATOM 0 HG21 VAL A 116 -4.184 3.612 9.573 1.00 10.30 H new ATOM 0 HG22 VAL A 116 -4.949 5.084 8.930 1.00 10.30 H new ATOM 0 HG23 VAL A 116 -3.225 4.770 8.621 1.00 10.30 H new ATOM 1789 N GLN A 117 -4.714 7.663 8.408 1.00 51.54 N ATOM 1790 CA GLN A 117 -5.892 8.122 7.670 1.00 60.22 C ATOM 1791 C GLN A 117 -6.029 7.368 6.343 1.00 40.24 C ATOM 1792 O GLN A 117 -5.128 6.628 5.941 1.00 35.41 O ATOM 1793 CB GLN A 117 -5.856 9.643 7.425 1.00 2.22 C ATOM 1794 CG GLN A 117 -4.592 10.165 6.738 1.00 72.13 C ATOM 1795 CD GLN A 117 -3.446 10.421 7.708 1.00 42.43 C ATOM 1796 OE1 GLN A 117 -3.343 11.498 8.287 1.00 24.10 O ATOM 1797 NE2 GLN A 117 -2.564 9.458 7.874 1.00 4.00 N ATOM 0 H GLN A 117 -3.907 7.457 7.819 1.00 51.54 H new ATOM 0 HA GLN A 117 -6.765 7.907 8.286 1.00 60.22 H new ATOM 0 HB2 GLN A 117 -6.719 9.917 6.818 1.00 2.22 H new ATOM 0 HB3 GLN A 117 -5.965 10.151 8.383 1.00 2.22 H new ATOM 0 HG2 GLN A 117 -4.270 9.444 5.987 1.00 72.13 H new ATOM 0 HG3 GLN A 117 -4.828 11.090 6.211 1.00 72.13 H new ATOM 0 HE21 GLN A 117 -2.676 8.573 7.379 1.00 4.00 H new ATOM 0 HE22 GLN A 117 -1.769 9.597 8.497 1.00 4.00 H new ATOM 1806 N ASN A 118 -7.159 7.565 5.669 1.00 12.44 N ATOM 1807 CA ASN A 118 -7.479 6.823 4.443 1.00 41.41 C ATOM 1808 C ASN A 118 -7.393 7.703 3.185 1.00 30.13 C ATOM 1809 O ASN A 118 -7.254 8.927 3.266 1.00 30.24 O ATOM 1810 CB ASN A 118 -8.882 6.222 4.562 1.00 11.34 C ATOM 1811 CG ASN A 118 -9.921 7.267 4.926 1.00 31.44 C ATOM 1812 OD1 ASN A 118 -10.163 7.534 6.099 1.00 33.43 O ATOM 1813 ND2 ASN A 118 -10.548 7.869 3.935 1.00 54.34 N ATOM 0 H ASN A 118 -7.875 8.235 5.950 1.00 12.44 H new ATOM 0 HA ASN A 118 -6.737 6.032 4.334 1.00 41.41 H new ATOM 0 HB2 ASN A 118 -9.156 5.752 3.617 1.00 11.34 H new ATOM 0 HB3 ASN A 118 -8.877 5.437 5.319 1.00 11.34 H new ATOM 0 HD21 ASN A 118 -11.255 8.577 4.134 1.00 54.34 H new ATOM 0 HD22 ASN A 118 -10.326 7.627 2.969 1.00 54.34 H new ATOM 1820 N GLN A 119 -7.465 7.056 2.021 1.00 4.22 N ATOM 1821 CA GLN A 119 -7.502 7.758 0.732 1.00 0.31 C ATOM 1822 C GLN A 119 -7.989 6.823 -0.391 1.00 4.10 C ATOM 1823 O GLN A 119 -7.768 5.613 -0.339 1.00 42.40 O ATOM 1824 CB GLN A 119 -6.113 8.317 0.395 1.00 25.31 C ATOM 1825 CG GLN A 119 -6.075 9.158 -0.875 1.00 1.44 C ATOM 1826 CD GLN A 119 -4.702 9.726 -1.174 1.00 52.35 C ATOM 1827 OE1 GLN A 119 -4.335 9.922 -2.328 1.00 21.43 O ATOM 1828 NE2 GLN A 119 -3.937 10.017 -0.140 1.00 40.34 N ATOM 0 H GLN A 119 -7.499 6.040 1.942 1.00 4.22 H new ATOM 0 HA GLN A 119 -8.207 8.585 0.813 1.00 0.31 H new ATOM 0 HB2 GLN A 119 -5.764 8.924 1.231 1.00 25.31 H new ATOM 0 HB3 GLN A 119 -5.414 7.487 0.290 1.00 25.31 H new ATOM 0 HG2 GLN A 119 -6.400 8.547 -1.717 1.00 1.44 H new ATOM 0 HG3 GLN A 119 -6.788 9.977 -0.782 1.00 1.44 H new ATOM 0 HE21 GLN A 119 -4.272 9.842 0.807 1.00 40.34 H new ATOM 0 HE22 GLN A 119 -3.011 10.417 -0.288 1.00 40.34 H new ATOM 1837 N LEU A 120 -8.655 7.385 -1.400 1.00 51.10 N ATOM 1838 CA LEU A 120 -9.186 6.598 -2.525 1.00 61.33 C ATOM 1839 C LEU A 120 -8.198 6.536 -3.702 1.00 3.35 C ATOM 1840 O LEU A 120 -7.734 7.567 -4.193 1.00 31.03 O ATOM 1841 CB LEU A 120 -10.517 7.196 -3.007 1.00 21.35 C ATOM 1842 CG LEU A 120 -11.683 7.102 -2.009 1.00 35.12 C ATOM 1843 CD1 LEU A 120 -12.912 7.837 -2.542 1.00 64.04 C ATOM 1844 CD2 LEU A 120 -12.012 5.640 -1.712 1.00 34.22 C ATOM 0 H LEU A 120 -8.843 8.385 -1.466 1.00 51.10 H new ATOM 0 HA LEU A 120 -9.344 5.582 -2.163 1.00 61.33 H new ATOM 0 HB2 LEU A 120 -10.356 8.245 -3.254 1.00 21.35 H new ATOM 0 HB3 LEU A 120 -10.809 6.693 -3.929 1.00 21.35 H new ATOM 0 HG LEU A 120 -11.380 7.582 -1.079 1.00 35.12 H new ATOM 0 HD11 LEU A 120 -13.725 7.758 -1.820 1.00 64.04 H new ATOM 0 HD12 LEU A 120 -12.668 8.888 -2.700 1.00 64.04 H new ATOM 0 HD13 LEU A 120 -13.221 7.391 -3.487 1.00 64.04 H new ATOM 0 HD21 LEU A 120 -12.839 5.590 -1.004 1.00 34.22 H new ATOM 0 HD22 LEU A 120 -12.294 5.136 -2.636 1.00 34.22 H new ATOM 0 HD23 LEU A 120 -11.138 5.150 -1.284 1.00 34.22 H new ATOM 1856 N ILE A 121 -7.886 5.322 -4.155 1.00 1.32 N ATOM 1857 CA ILE A 121 -7.025 5.124 -5.332 1.00 54.31 C ATOM 1858 C ILE A 121 -7.816 4.545 -6.515 1.00 61.13 C ATOM 1859 O ILE A 121 -8.673 3.676 -6.335 1.00 64.13 O ATOM 1860 CB ILE A 121 -5.826 4.190 -5.022 1.00 43.02 C ATOM 1861 CG1 ILE A 121 -6.311 2.809 -4.536 1.00 14.42 C ATOM 1862 CG2 ILE A 121 -4.906 4.837 -3.988 1.00 22.53 C ATOM 1863 CD1 ILE A 121 -5.202 1.791 -4.372 1.00 33.31 C ATOM 0 H ILE A 121 -8.215 4.456 -3.727 1.00 1.32 H new ATOM 0 HA ILE A 121 -6.644 6.109 -5.600 1.00 54.31 H new ATOM 0 HB ILE A 121 -5.262 4.039 -5.942 1.00 43.02 H new ATOM 0 HG12 ILE A 121 -6.823 2.930 -3.582 1.00 14.42 H new ATOM 0 HG13 ILE A 121 -7.044 2.422 -5.244 1.00 14.42 H new ATOM 0 HG21 ILE A 121 -4.068 4.171 -3.779 1.00 22.53 H new ATOM 0 HG22 ILE A 121 -4.529 5.783 -4.377 1.00 22.53 H new ATOM 0 HG23 ILE A 121 -5.463 5.019 -3.069 1.00 22.53 H new ATOM 0 HD11 ILE A 121 -5.623 0.846 -4.028 1.00 33.31 H new ATOM 0 HD12 ILE A 121 -4.704 1.639 -5.329 1.00 33.31 H new ATOM 0 HD13 ILE A 121 -4.480 2.154 -3.641 1.00 33.31 H new ATOM 1875 N ASN A 122 -7.529 5.031 -7.723 1.00 64.40 N ATOM 1876 CA ASN A 122 -8.211 4.560 -8.934 1.00 22.40 C ATOM 1877 C ASN A 122 -7.198 4.070 -9.982 1.00 14.14 C ATOM 1878 O ASN A 122 -6.225 4.762 -10.285 1.00 14.12 O ATOM 1879 CB ASN A 122 -9.070 5.682 -9.532 1.00 32.34 C ATOM 1880 CG ASN A 122 -9.979 6.329 -8.501 1.00 0.51 C ATOM 1881 OD1 ASN A 122 -9.628 7.331 -7.888 1.00 13.11 O ATOM 1882 ND2 ASN A 122 -11.143 5.751 -8.285 1.00 14.42 N ATOM 0 H ASN A 122 -6.828 5.752 -7.891 1.00 64.40 H new ATOM 0 HA ASN A 122 -8.853 3.725 -8.654 1.00 22.40 H new ATOM 0 HB2 ASN A 122 -8.420 6.441 -9.966 1.00 32.34 H new ATOM 0 HB3 ASN A 122 -9.675 5.279 -10.344 1.00 32.34 H new ATOM 0 HD21 ASN A 122 -11.783 6.136 -7.590 1.00 14.42 H new ATOM 0 HD22 ASN A 122 -11.405 4.918 -8.813 1.00 14.42 H new ATOM 1889 N ALA A 123 -7.430 2.880 -10.534 1.00 63.13 N ATOM 1890 CA ALA A 123 -6.528 2.301 -11.537 1.00 3.44 C ATOM 1891 C ALA A 123 -7.274 1.936 -12.835 1.00 71.52 C ATOM 1892 O ALA A 123 -8.365 1.357 -12.790 1.00 41.55 O ATOM 1893 CB ALA A 123 -5.829 1.074 -10.960 1.00 52.33 C ATOM 0 H ALA A 123 -8.234 2.295 -10.306 1.00 63.13 H new ATOM 0 HA ALA A 123 -5.782 3.054 -11.792 1.00 3.44 H new ATOM 0 HB1 ALA A 123 -5.161 0.649 -11.710 1.00 52.33 H new ATOM 0 HB2 ALA A 123 -5.252 1.363 -10.082 1.00 52.33 H new ATOM 0 HB3 ALA A 123 -6.574 0.331 -10.675 1.00 52.33 H new ATOM 1899 N PRO A 124 -6.693 2.276 -14.008 1.00 62.14 N ATOM 1900 CA PRO A 124 -7.302 1.984 -15.322 1.00 62.21 C ATOM 1901 C PRO A 124 -7.319 0.481 -15.665 1.00 65.30 C ATOM 1902 O PRO A 124 -6.658 -0.329 -15.014 1.00 65.42 O ATOM 1903 CB PRO A 124 -6.406 2.756 -16.319 1.00 2.01 C ATOM 1904 CG PRO A 124 -5.568 3.667 -15.478 1.00 55.44 C ATOM 1905 CD PRO A 124 -5.410 2.978 -14.154 1.00 20.21 C ATOM 0 HA PRO A 124 -8.350 2.281 -15.346 1.00 62.21 H new ATOM 0 HB2 PRO A 124 -5.784 2.073 -16.898 1.00 2.01 H new ATOM 0 HB3 PRO A 124 -7.007 3.321 -17.031 1.00 2.01 H new ATOM 0 HG2 PRO A 124 -4.599 3.846 -15.943 1.00 55.44 H new ATOM 0 HG3 PRO A 124 -6.048 4.638 -15.358 1.00 55.44 H new ATOM 0 HD2 PRO A 124 -4.567 2.287 -14.154 1.00 20.21 H new ATOM 0 HD3 PRO A 124 -5.241 3.688 -13.344 1.00 20.21 H new ATOM 1913 N ALA A 125 -8.069 0.122 -16.705 1.00 50.31 N ATOM 1914 CA ALA A 125 -8.203 -1.277 -17.129 1.00 21.04 C ATOM 1915 C ALA A 125 -7.052 -1.717 -18.046 1.00 62.04 C ATOM 1916 O ALA A 125 -6.730 -1.042 -19.025 1.00 30.45 O ATOM 1917 CB ALA A 125 -9.541 -1.480 -17.834 1.00 14.21 C ATOM 0 H ALA A 125 -8.598 0.782 -17.275 1.00 50.31 H new ATOM 0 HA ALA A 125 -8.161 -1.897 -16.234 1.00 21.04 H new ATOM 0 HB1 ALA A 125 -9.634 -2.520 -18.146 1.00 14.21 H new ATOM 0 HB2 ALA A 125 -10.353 -1.232 -17.151 1.00 14.21 H new ATOM 0 HB3 ALA A 125 -9.593 -0.833 -18.709 1.00 14.21 H new ATOM 1923 N SER A 126 -6.443 -2.860 -17.731 1.00 2.14 N ATOM 1924 CA SER A 126 -5.373 -3.420 -18.569 1.00 55.41 C ATOM 1925 C SER A 126 -5.960 -4.141 -19.788 1.00 75.00 C ATOM 1926 O SER A 126 -6.442 -5.266 -19.684 1.00 2.32 O ATOM 1927 CB SER A 126 -4.490 -4.390 -17.767 1.00 43.40 C ATOM 1928 OG SER A 126 -3.787 -3.718 -16.732 1.00 13.11 O ATOM 0 H SER A 126 -6.668 -3.417 -16.907 1.00 2.14 H new ATOM 0 HA SER A 126 -4.755 -2.590 -18.911 1.00 55.41 H new ATOM 0 HB2 SER A 126 -5.110 -5.177 -17.336 1.00 43.40 H new ATOM 0 HB3 SER A 126 -3.779 -4.875 -18.436 1.00 43.40 H new ATOM 0 HG SER A 126 -3.236 -4.362 -16.239 1.00 13.11 H new ATOM 1934 N VAL A 127 -5.936 -3.475 -20.939 1.00 43.14 N ATOM 1935 CA VAL A 127 -6.487 -4.041 -22.178 1.00 11.40 C ATOM 1936 C VAL A 127 -5.610 -5.178 -22.743 1.00 54.54 C ATOM 1937 O VAL A 127 -6.107 -6.074 -23.433 1.00 50.30 O ATOM 1938 CB VAL A 127 -6.672 -2.937 -23.255 1.00 32.23 C ATOM 1939 CG1 VAL A 127 -5.338 -2.269 -23.591 1.00 55.33 C ATOM 1940 CG2 VAL A 127 -7.338 -3.497 -24.515 1.00 21.40 C ATOM 0 H VAL A 127 -5.541 -2.540 -21.045 1.00 43.14 H new ATOM 0 HA VAL A 127 -7.459 -4.464 -21.923 1.00 11.40 H new ATOM 0 HB VAL A 127 -7.334 -2.177 -22.840 1.00 32.23 H new ATOM 0 HG11 VAL A 127 -5.496 -1.500 -24.347 1.00 55.33 H new ATOM 0 HG12 VAL A 127 -4.923 -1.813 -22.692 1.00 55.33 H new ATOM 0 HG13 VAL A 127 -4.643 -3.016 -23.973 1.00 55.33 H new ATOM 0 HG21 VAL A 127 -7.454 -2.700 -25.250 1.00 21.40 H new ATOM 0 HG22 VAL A 127 -6.717 -4.289 -24.933 1.00 21.40 H new ATOM 0 HG23 VAL A 127 -8.318 -3.901 -24.260 1.00 21.40 H new ATOM 1950 N LEU A 128 -4.313 -5.147 -22.437 1.00 72.34 N ATOM 1951 CA LEU A 128 -3.363 -6.141 -22.961 1.00 14.34 C ATOM 1952 C LEU A 128 -2.678 -6.937 -21.837 1.00 64.52 C ATOM 1953 O LEU A 128 -2.719 -6.550 -20.668 1.00 32.23 O ATOM 1954 CB LEU A 128 -2.302 -5.447 -23.831 1.00 14.54 C ATOM 1955 CG LEU A 128 -2.845 -4.754 -25.092 1.00 43.31 C ATOM 1956 CD1 LEU A 128 -1.727 -4.041 -25.844 1.00 1.22 C ATOM 1957 CD2 LEU A 128 -3.553 -5.763 -25.997 1.00 41.21 C ATOM 0 H LEU A 128 -3.891 -4.445 -21.829 1.00 72.34 H new ATOM 0 HA LEU A 128 -3.931 -6.848 -23.565 1.00 14.34 H new ATOM 0 HB2 LEU A 128 -1.783 -4.706 -23.223 1.00 14.54 H new ATOM 0 HB3 LEU A 128 -1.561 -6.187 -24.132 1.00 14.54 H new ATOM 0 HG LEU A 128 -3.573 -4.004 -24.782 1.00 43.31 H new ATOM 0 HD11 LEU A 128 -2.136 -3.559 -26.732 1.00 1.22 H new ATOM 0 HD12 LEU A 128 -1.276 -3.288 -25.197 1.00 1.22 H new ATOM 0 HD13 LEU A 128 -0.969 -4.765 -26.141 1.00 1.22 H new ATOM 0 HD21 LEU A 128 -3.930 -5.254 -26.884 1.00 41.21 H new ATOM 0 HD22 LEU A 128 -2.849 -6.540 -26.296 1.00 41.21 H new ATOM 0 HD23 LEU A 128 -4.385 -6.215 -25.457 1.00 41.21 H new ATOM 1969 N ALA A 129 -2.044 -8.050 -22.210 1.00 11.44 N ATOM 1970 CA ALA A 129 -1.344 -8.923 -21.253 1.00 35.32 C ATOM 1971 C ALA A 129 0.187 -8.778 -21.378 1.00 72.31 C ATOM 1972 O ALA A 129 0.696 -8.438 -22.449 1.00 34.53 O ATOM 1973 CB ALA A 129 -1.759 -10.375 -21.487 1.00 42.35 C ATOM 0 H ALA A 129 -1.998 -8.374 -23.176 1.00 11.44 H new ATOM 0 HA ALA A 129 -1.624 -8.622 -20.243 1.00 35.32 H new ATOM 0 HB1 ALA A 129 -1.240 -11.020 -20.778 1.00 42.35 H new ATOM 0 HB2 ALA A 129 -2.835 -10.473 -21.346 1.00 42.35 H new ATOM 0 HB3 ALA A 129 -1.498 -10.669 -22.504 1.00 42.35 H new ATOM 1979 N PRO A 130 0.959 -9.046 -20.297 1.00 12.22 N ATOM 1980 CA PRO A 130 0.433 -9.484 -18.988 1.00 51.14 C ATOM 1981 C PRO A 130 -0.035 -8.322 -18.088 1.00 70.40 C ATOM 1982 O PRO A 130 0.131 -7.146 -18.424 1.00 51.11 O ATOM 1983 CB PRO A 130 1.644 -10.189 -18.370 1.00 42.03 C ATOM 1984 CG PRO A 130 2.820 -9.436 -18.902 1.00 64.34 C ATOM 1985 CD PRO A 130 2.434 -8.957 -20.283 1.00 12.12 C ATOM 0 HA PRO A 130 -0.456 -10.105 -19.094 1.00 51.14 H new ATOM 0 HB2 PRO A 130 1.610 -10.157 -17.281 1.00 42.03 H new ATOM 0 HB3 PRO A 130 1.682 -11.240 -18.657 1.00 42.03 H new ATOM 0 HG2 PRO A 130 3.067 -8.595 -18.255 1.00 64.34 H new ATOM 0 HG3 PRO A 130 3.702 -10.075 -18.945 1.00 64.34 H new ATOM 0 HD2 PRO A 130 2.773 -7.936 -20.460 1.00 12.12 H new ATOM 0 HD3 PRO A 130 2.878 -9.580 -21.059 1.00 12.12 H new ATOM 1993 N SER A 131 -0.611 -8.669 -16.936 1.00 52.21 N ATOM 1994 CA SER A 131 -1.173 -7.673 -16.009 1.00 24.01 C ATOM 1995 C SER A 131 -0.087 -6.914 -15.225 1.00 14.32 C ATOM 1996 O SER A 131 0.433 -7.404 -14.216 1.00 20.45 O ATOM 1997 CB SER A 131 -2.147 -8.347 -15.029 1.00 31.14 C ATOM 1998 OG SER A 131 -3.252 -8.920 -15.713 1.00 5.54 O ATOM 0 H SER A 131 -0.703 -9.634 -16.618 1.00 52.21 H new ATOM 0 HA SER A 131 -1.706 -6.942 -16.617 1.00 24.01 H new ATOM 0 HB2 SER A 131 -1.624 -9.120 -14.467 1.00 31.14 H new ATOM 0 HB3 SER A 131 -2.504 -7.614 -14.306 1.00 31.14 H new ATOM 0 HG SER A 131 -3.080 -9.872 -15.873 1.00 5.54 H new ATOM 2004 N ASP A 132 0.264 -5.723 -15.718 1.00 51.10 N ATOM 2005 CA ASP A 132 1.160 -4.795 -15.013 1.00 61.23 C ATOM 2006 C ASP A 132 0.596 -3.360 -15.075 1.00 34.30 C ATOM 2007 O ASP A 132 0.342 -2.830 -16.159 1.00 0.10 O ATOM 2008 CB ASP A 132 2.569 -4.820 -15.622 1.00 51.22 C ATOM 2009 CG ASP A 132 3.245 -6.175 -15.509 1.00 20.45 C ATOM 2010 OD1 ASP A 132 3.813 -6.481 -14.437 1.00 44.24 O ATOM 2011 OD2 ASP A 132 3.234 -6.938 -16.497 1.00 4.52 O ATOM 0 H ASP A 132 -0.064 -5.372 -16.618 1.00 51.10 H new ATOM 0 HA ASP A 132 1.225 -5.115 -13.973 1.00 61.23 H new ATOM 0 HB2 ASP A 132 2.509 -4.538 -16.673 1.00 51.22 H new ATOM 0 HB3 ASP A 132 3.186 -4.071 -15.126 1.00 51.22 H new ATOM 2016 N VAL A 133 0.381 -2.745 -13.911 1.00 33.40 N ATOM 2017 CA VAL A 133 -0.164 -1.378 -13.829 1.00 32.40 C ATOM 2018 C VAL A 133 0.633 -0.515 -12.827 1.00 23.34 C ATOM 2019 O VAL A 133 1.344 -1.045 -11.971 1.00 12.11 O ATOM 2020 CB VAL A 133 -1.662 -1.394 -13.389 1.00 24.24 C ATOM 2021 CG1 VAL A 133 -2.283 0.006 -13.455 1.00 1.23 C ATOM 2022 CG2 VAL A 133 -2.470 -2.380 -14.231 1.00 24.52 C ATOM 0 H VAL A 133 0.575 -3.170 -13.004 1.00 33.40 H new ATOM 0 HA VAL A 133 -0.080 -0.946 -14.826 1.00 32.40 H new ATOM 0 HB VAL A 133 -1.692 -1.724 -12.350 1.00 24.24 H new ATOM 0 HG11 VAL A 133 -3.326 -0.043 -13.142 1.00 1.23 H new ATOM 0 HG12 VAL A 133 -1.737 0.678 -12.793 1.00 1.23 H new ATOM 0 HG13 VAL A 133 -2.228 0.380 -14.477 1.00 1.23 H new ATOM 0 HG21 VAL A 133 -3.510 -2.371 -13.904 1.00 24.52 H new ATOM 0 HG22 VAL A 133 -2.418 -2.090 -15.281 1.00 24.52 H new ATOM 0 HG23 VAL A 133 -2.060 -3.383 -14.110 1.00 24.52 H new ATOM 2032 N ASP A 134 0.529 0.809 -12.959 1.00 12.24 N ATOM 2033 CA ASP A 134 1.057 1.744 -11.957 1.00 14.33 C ATOM 2034 C ASP A 134 0.184 3.009 -11.871 1.00 13.53 C ATOM 2035 O ASP A 134 -0.344 3.482 -12.880 1.00 41.04 O ATOM 2036 CB ASP A 134 2.519 2.116 -12.254 1.00 32.34 C ATOM 2037 CG ASP A 134 2.730 2.720 -13.635 1.00 62.12 C ATOM 2038 OD1 ASP A 134 2.396 3.909 -13.834 1.00 31.53 O ATOM 2039 OD2 ASP A 134 3.262 2.019 -14.521 1.00 62.11 O ATOM 0 H ASP A 134 0.081 1.263 -13.755 1.00 12.24 H new ATOM 0 HA ASP A 134 1.028 1.240 -10.991 1.00 14.33 H new ATOM 0 HB2 ASP A 134 2.864 2.825 -11.501 1.00 32.34 H new ATOM 0 HB3 ASP A 134 3.138 1.224 -12.159 1.00 32.34 H new ATOM 2044 N ILE A 135 0.017 3.538 -10.658 1.00 24.04 N ATOM 2045 CA ILE A 135 -0.787 4.748 -10.436 1.00 53.11 C ATOM 2046 C ILE A 135 -0.139 5.680 -9.396 1.00 12.44 C ATOM 2047 O ILE A 135 0.539 5.220 -8.473 1.00 31.42 O ATOM 2048 CB ILE A 135 -2.233 4.401 -9.977 1.00 22.31 C ATOM 2049 CG1 ILE A 135 -2.207 3.500 -8.728 1.00 24.41 C ATOM 2050 CG2 ILE A 135 -3.018 3.733 -11.106 1.00 10.23 C ATOM 2051 CD1 ILE A 135 -3.579 3.140 -8.194 1.00 35.11 C ATOM 0 H ILE A 135 0.428 3.148 -9.810 1.00 24.04 H new ATOM 0 HA ILE A 135 -0.832 5.264 -11.395 1.00 53.11 H new ATOM 0 HB ILE A 135 -2.737 5.332 -9.718 1.00 22.31 H new ATOM 0 HG12 ILE A 135 -1.670 2.582 -8.967 1.00 24.41 H new ATOM 0 HG13 ILE A 135 -1.644 4.003 -7.942 1.00 24.41 H new ATOM 0 HG21 ILE A 135 -4.025 3.500 -10.761 1.00 10.23 H new ATOM 0 HG22 ILE A 135 -3.074 4.409 -11.959 1.00 10.23 H new ATOM 0 HG23 ILE A 135 -2.515 2.813 -11.404 1.00 10.23 H new ATOM 0 HD11 ILE A 135 -3.472 2.504 -7.315 1.00 35.11 H new ATOM 0 HD12 ILE A 135 -4.113 4.050 -7.921 1.00 35.11 H new ATOM 0 HD13 ILE A 135 -4.140 2.606 -8.962 1.00 35.11 H new ATOM 2063 N PRO A 136 -0.324 7.009 -9.543 1.00 72.52 N ATOM 2064 CA PRO A 136 0.185 7.995 -8.575 1.00 23.32 C ATOM 2065 C PRO A 136 -0.682 8.082 -7.304 1.00 61.23 C ATOM 2066 O PRO A 136 -1.909 7.970 -7.364 1.00 42.23 O ATOM 2067 CB PRO A 136 0.124 9.306 -9.366 1.00 11.14 C ATOM 2068 CG PRO A 136 -1.025 9.122 -10.300 1.00 44.43 C ATOM 2069 CD PRO A 136 -1.033 7.658 -10.667 1.00 11.24 C ATOM 0 HA PRO A 136 1.180 7.741 -8.209 1.00 23.32 H new ATOM 0 HB2 PRO A 136 -0.032 10.161 -8.708 1.00 11.14 H new ATOM 0 HB3 PRO A 136 1.052 9.487 -9.908 1.00 11.14 H new ATOM 0 HG2 PRO A 136 -1.963 9.410 -9.826 1.00 44.43 H new ATOM 0 HG3 PRO A 136 -0.911 9.746 -11.187 1.00 44.43 H new ATOM 0 HD2 PRO A 136 -2.049 7.277 -10.772 1.00 11.24 H new ATOM 0 HD3 PRO A 136 -0.526 7.481 -11.616 1.00 11.24 H new ATOM 2077 N LEU A 137 -0.045 8.300 -6.155 1.00 4.41 N ATOM 2078 CA LEU A 137 -0.758 8.347 -4.872 1.00 44.33 C ATOM 2079 C LEU A 137 -0.220 9.490 -3.986 1.00 4.53 C ATOM 2080 O LEU A 137 0.900 9.419 -3.476 1.00 72.52 O ATOM 2081 CB LEU A 137 -0.613 6.989 -4.152 1.00 41.41 C ATOM 2082 CG LEU A 137 -1.811 6.534 -3.295 1.00 61.23 C ATOM 2083 CD1 LEU A 137 -1.502 5.210 -2.599 1.00 52.31 C ATOM 2084 CD2 LEU A 137 -2.202 7.597 -2.274 1.00 52.54 C ATOM 0 H LEU A 137 0.962 8.447 -6.082 1.00 4.41 H new ATOM 0 HA LEU A 137 -1.814 8.541 -5.062 1.00 44.33 H new ATOM 0 HB2 LEU A 137 -0.421 6.223 -4.903 1.00 41.41 H new ATOM 0 HB3 LEU A 137 0.267 7.035 -3.511 1.00 41.41 H new ATOM 0 HG LEU A 137 -2.660 6.387 -3.963 1.00 61.23 H new ATOM 0 HD11 LEU A 137 -2.360 4.906 -1.999 1.00 52.31 H new ATOM 0 HD12 LEU A 137 -1.293 4.446 -3.347 1.00 52.31 H new ATOM 0 HD13 LEU A 137 -0.633 5.333 -1.953 1.00 52.31 H new ATOM 0 HD21 LEU A 137 -3.050 7.243 -1.687 1.00 52.54 H new ATOM 0 HD22 LEU A 137 -1.359 7.793 -1.612 1.00 52.54 H new ATOM 0 HD23 LEU A 137 -2.478 8.515 -2.792 1.00 52.54 H new ATOM 2096 N GLN A 138 -1.022 10.542 -3.814 1.00 5.42 N ATOM 2097 CA GLN A 138 -0.638 11.685 -2.970 1.00 44.11 C ATOM 2098 C GLN A 138 -1.193 11.547 -1.542 1.00 5.40 C ATOM 2099 O GLN A 138 -2.354 11.861 -1.277 1.00 73.23 O ATOM 2100 CB GLN A 138 -1.123 13.006 -3.598 1.00 4.42 C ATOM 2101 CG GLN A 138 -0.989 14.216 -2.672 1.00 1.51 C ATOM 2102 CD GLN A 138 -1.450 15.512 -3.319 1.00 11.44 C ATOM 2103 OE1 GLN A 138 -2.628 15.854 -3.287 1.00 35.35 O ATOM 2104 NE2 GLN A 138 -0.527 16.254 -3.890 1.00 50.12 N ATOM 0 H GLN A 138 -1.942 10.630 -4.246 1.00 5.42 H new ATOM 0 HA GLN A 138 0.450 11.696 -2.909 1.00 44.11 H new ATOM 0 HB2 GLN A 138 -0.556 13.194 -4.510 1.00 4.42 H new ATOM 0 HB3 GLN A 138 -2.168 12.897 -3.889 1.00 4.42 H new ATOM 0 HG2 GLN A 138 -1.571 14.041 -1.767 1.00 1.51 H new ATOM 0 HG3 GLN A 138 0.052 14.319 -2.366 1.00 1.51 H new ATOM 0 HE21 GLN A 138 0.444 15.942 -3.900 1.00 50.12 H new ATOM 0 HE22 GLN A 138 -0.782 17.142 -4.323 1.00 50.12 H new ATOM 2113 N LEU A 139 -0.356 11.065 -0.628 1.00 3.34 N ATOM 2114 CA LEU A 139 -0.725 10.943 0.786 1.00 10.22 C ATOM 2115 C LEU A 139 -0.739 12.320 1.465 1.00 33.14 C ATOM 2116 O LEU A 139 0.228 13.069 1.373 1.00 50.32 O ATOM 2117 CB LEU A 139 0.265 10.013 1.497 1.00 24.14 C ATOM 2118 CG LEU A 139 0.431 8.625 0.855 1.00 50.05 C ATOM 2119 CD1 LEU A 139 1.551 7.844 1.535 1.00 0.44 C ATOM 2120 CD2 LEU A 139 -0.878 7.843 0.907 1.00 3.13 C ATOM 0 H LEU A 139 0.590 10.749 -0.840 1.00 3.34 H new ATOM 0 HA LEU A 139 -1.728 10.521 0.852 1.00 10.22 H new ATOM 0 HB2 LEU A 139 1.239 10.501 1.529 1.00 24.14 H new ATOM 0 HB3 LEU A 139 -0.060 9.882 2.529 1.00 24.14 H new ATOM 0 HG LEU A 139 0.701 8.768 -0.191 1.00 50.05 H new ATOM 0 HD11 LEU A 139 1.650 6.866 1.064 1.00 0.44 H new ATOM 0 HD12 LEU A 139 2.488 8.391 1.436 1.00 0.44 H new ATOM 0 HD13 LEU A 139 1.316 7.716 2.592 1.00 0.44 H new ATOM 0 HD21 LEU A 139 -0.736 6.865 0.447 1.00 3.13 H new ATOM 0 HD22 LEU A 139 -1.184 7.715 1.945 1.00 3.13 H new ATOM 0 HD23 LEU A 139 -1.650 8.390 0.366 1.00 3.13 H new ATOM 2132 N LYS A 140 -1.830 12.650 2.150 1.00 40.54 N ATOM 2133 CA LYS A 140 -1.993 13.987 2.741 1.00 54.10 C ATOM 2134 C LYS A 140 -1.770 13.981 4.259 1.00 41.14 C ATOM 2135 O LYS A 140 -2.172 13.046 4.955 1.00 12.34 O ATOM 2136 CB LYS A 140 -3.388 14.539 2.424 1.00 41.23 C ATOM 2137 CG LYS A 140 -3.665 14.680 0.929 1.00 21.11 C ATOM 2138 CD LYS A 140 -5.003 15.363 0.660 1.00 1.05 C ATOM 2139 CE LYS A 140 -5.249 15.561 -0.831 1.00 52.34 C ATOM 2140 NZ LYS A 140 -6.484 16.348 -1.090 1.00 62.35 N ATOM 0 H LYS A 140 -2.614 12.018 2.313 1.00 40.54 H new ATOM 0 HA LYS A 140 -1.233 14.630 2.298 1.00 54.10 H new ATOM 0 HB2 LYS A 140 -4.138 13.882 2.863 1.00 41.23 H new ATOM 0 HB3 LYS A 140 -3.501 15.513 2.899 1.00 41.23 H new ATOM 0 HG2 LYS A 140 -2.864 15.255 0.464 1.00 21.11 H new ATOM 0 HG3 LYS A 140 -3.661 13.694 0.464 1.00 21.11 H new ATOM 0 HD2 LYS A 140 -5.809 14.764 1.085 1.00 1.05 H new ATOM 0 HD3 LYS A 140 -5.025 16.330 1.163 1.00 1.05 H new ATOM 0 HE2 LYS A 140 -4.394 16.071 -1.275 1.00 52.34 H new ATOM 0 HE3 LYS A 140 -5.329 14.589 -1.318 1.00 52.34 H new ATOM 0 HZ1 LYS A 140 -6.615 16.460 -2.116 1.00 62.35 H new ATOM 0 HZ2 LYS A 140 -7.304 15.850 -0.688 1.00 62.35 H new ATOM 0 HZ3 LYS A 140 -6.398 17.285 -0.647 1.00 62.35 H new ATOM 2154 N GLY A 141 -1.136 15.040 4.762 1.00 4.44 N ATOM 2155 CA GLY A 141 -0.905 15.185 6.196 1.00 32.40 C ATOM 2156 C GLY A 141 0.061 14.153 6.774 1.00 42.25 C ATOM 2157 O GLY A 141 -0.095 13.721 7.918 1.00 21.24 O ATOM 0 H GLY A 141 -0.774 15.808 4.197 1.00 4.44 H new ATOM 0 HA2 GLY A 141 -0.515 16.184 6.392 1.00 32.40 H new ATOM 0 HA3 GLY A 141 -1.859 15.108 6.718 1.00 32.40 H new ATOM 2161 N ILE A 142 1.067 13.763 5.993 1.00 74.52 N ATOM 2162 CA ILE A 142 2.048 12.770 6.443 1.00 72.25 C ATOM 2163 C ILE A 142 3.329 12.810 5.586 1.00 54.21 C ATOM 2164 O ILE A 142 3.275 12.731 4.358 1.00 64.10 O ATOM 2165 CB ILE A 142 1.439 11.338 6.429 1.00 54.02 C ATOM 2166 CG1 ILE A 142 2.449 10.300 6.954 1.00 21.00 C ATOM 2167 CG2 ILE A 142 0.962 10.966 5.021 1.00 53.23 C ATOM 2168 CD1 ILE A 142 1.854 8.922 7.182 1.00 42.24 C ATOM 0 H ILE A 142 1.226 14.116 5.049 1.00 74.52 H new ATOM 0 HA ILE A 142 2.318 13.025 7.468 1.00 72.25 H new ATOM 0 HB ILE A 142 0.577 11.334 7.096 1.00 54.02 H new ATOM 0 HG12 ILE A 142 3.272 10.217 6.244 1.00 21.00 H new ATOM 0 HG13 ILE A 142 2.872 10.662 7.891 1.00 21.00 H new ATOM 0 HG21 ILE A 142 0.540 9.961 5.034 1.00 53.23 H new ATOM 0 HG22 ILE A 142 0.201 11.675 4.695 1.00 53.23 H new ATOM 0 HG23 ILE A 142 1.805 10.997 4.331 1.00 53.23 H new ATOM 0 HD11 ILE A 142 2.627 8.248 7.551 1.00 42.24 H new ATOM 0 HD12 ILE A 142 1.051 8.989 7.916 1.00 42.24 H new ATOM 0 HD13 ILE A 142 1.456 8.538 6.243 1.00 42.24 H new ATOM 2180 N SER A 143 4.478 12.959 6.245 1.00 21.34 N ATOM 2181 CA SER A 143 5.779 12.994 5.557 1.00 40.32 C ATOM 2182 C SER A 143 6.365 11.584 5.397 1.00 40.31 C ATOM 2183 O SER A 143 6.058 10.680 6.174 1.00 32.44 O ATOM 2184 CB SER A 143 6.772 13.887 6.320 1.00 51.42 C ATOM 2185 OG SER A 143 6.309 15.227 6.407 1.00 11.23 O ATOM 0 H SER A 143 4.539 13.058 7.258 1.00 21.34 H new ATOM 0 HA SER A 143 5.613 13.412 4.564 1.00 40.32 H new ATOM 0 HB2 SER A 143 6.925 13.488 7.323 1.00 51.42 H new ATOM 0 HB3 SER A 143 7.740 13.867 5.819 1.00 51.42 H new ATOM 0 HG SER A 143 6.962 15.767 6.899 1.00 11.23 H new ATOM 2191 N VAL A 144 7.223 11.411 4.392 1.00 65.31 N ATOM 2192 CA VAL A 144 7.806 10.100 4.065 1.00 21.13 C ATOM 2193 C VAL A 144 8.485 9.421 5.274 1.00 65.42 C ATOM 2194 O VAL A 144 8.368 8.209 5.455 1.00 40.21 O ATOM 2195 CB VAL A 144 8.812 10.213 2.888 1.00 31.31 C ATOM 2196 CG1 VAL A 144 9.922 11.212 3.201 1.00 3.11 C ATOM 2197 CG2 VAL A 144 9.396 8.844 2.528 1.00 13.43 C ATOM 0 H VAL A 144 7.535 12.167 3.782 1.00 65.31 H new ATOM 0 HA VAL A 144 6.970 9.467 3.766 1.00 21.13 H new ATOM 0 HB VAL A 144 8.264 10.584 2.022 1.00 31.31 H new ATOM 0 HG11 VAL A 144 10.610 11.268 2.357 1.00 3.11 H new ATOM 0 HG12 VAL A 144 9.487 12.195 3.380 1.00 3.11 H new ATOM 0 HG13 VAL A 144 10.464 10.888 4.090 1.00 3.11 H new ATOM 0 HG21 VAL A 144 10.097 8.954 1.701 1.00 13.43 H new ATOM 0 HG22 VAL A 144 9.916 8.432 3.392 1.00 13.43 H new ATOM 0 HG23 VAL A 144 8.591 8.171 2.234 1.00 13.43 H new ATOM 2207 N ASP A 145 9.180 10.195 6.106 1.00 40.13 N ATOM 2208 CA ASP A 145 9.834 9.643 7.302 1.00 50.22 C ATOM 2209 C ASP A 145 8.795 9.190 8.349 1.00 12.33 C ATOM 2210 O ASP A 145 9.042 8.274 9.135 1.00 13.04 O ATOM 2211 CB ASP A 145 10.784 10.683 7.906 1.00 12.43 C ATOM 2212 CG ASP A 145 11.607 10.123 9.055 1.00 10.02 C ATOM 2213 OD1 ASP A 145 12.538 9.334 8.794 1.00 54.15 O ATOM 2214 OD2 ASP A 145 11.328 10.468 10.222 1.00 31.42 O ATOM 0 H ASP A 145 9.307 11.199 5.980 1.00 40.13 H new ATOM 0 HA ASP A 145 10.408 8.766 7.003 1.00 50.22 H new ATOM 0 HB2 ASP A 145 11.454 11.052 7.130 1.00 12.43 H new ATOM 0 HB3 ASP A 145 10.206 11.536 8.260 1.00 12.43 H new ATOM 2219 N GLN A 146 7.624 9.828 8.333 1.00 53.04 N ATOM 2220 CA GLN A 146 6.539 9.503 9.267 1.00 31.14 C ATOM 2221 C GLN A 146 5.728 8.279 8.797 1.00 3.54 C ATOM 2222 O GLN A 146 4.823 7.818 9.492 1.00 51.23 O ATOM 2223 CB GLN A 146 5.610 10.717 9.424 1.00 43.24 C ATOM 2224 CG GLN A 146 6.297 11.966 9.972 1.00 71.35 C ATOM 2225 CD GLN A 146 6.750 11.812 11.414 1.00 40.25 C ATOM 2226 OE1 GLN A 146 7.868 11.391 11.691 1.00 23.34 O ATOM 2227 NE2 GLN A 146 5.885 12.157 12.346 1.00 54.14 N ATOM 0 H GLN A 146 7.399 10.578 7.680 1.00 53.04 H new ATOM 0 HA GLN A 146 6.988 9.254 10.229 1.00 31.14 H new ATOM 0 HB2 GLN A 146 5.172 10.953 8.454 1.00 43.24 H new ATOM 0 HB3 GLN A 146 4.788 10.448 10.087 1.00 43.24 H new ATOM 0 HG2 GLN A 146 7.160 12.202 9.349 1.00 71.35 H new ATOM 0 HG3 GLN A 146 5.612 12.811 9.901 1.00 71.35 H new ATOM 0 HE21 GLN A 146 4.963 12.504 12.083 1.00 54.14 H new ATOM 0 HE22 GLN A 146 6.138 12.077 13.331 1.00 54.14 H new ATOM 2236 N LEU A 147 6.058 7.764 7.612 1.00 52.50 N ATOM 2237 CA LEU A 147 5.381 6.589 7.051 1.00 44.44 C ATOM 2238 C LEU A 147 5.753 5.295 7.790 1.00 1.00 C ATOM 2239 O LEU A 147 6.924 4.922 7.869 1.00 61.41 O ATOM 2240 CB LEU A 147 5.710 6.444 5.557 1.00 40.34 C ATOM 2241 CG LEU A 147 4.894 7.339 4.613 1.00 41.54 C ATOM 2242 CD1 LEU A 147 5.426 7.245 3.185 1.00 75.13 C ATOM 2243 CD2 LEU A 147 3.419 6.948 4.661 1.00 4.12 C ATOM 0 H LEU A 147 6.795 8.143 7.017 1.00 52.50 H new ATOM 0 HA LEU A 147 4.310 6.748 7.178 1.00 44.44 H new ATOM 0 HB2 LEU A 147 6.768 6.662 5.413 1.00 40.34 H new ATOM 0 HB3 LEU A 147 5.556 5.404 5.268 1.00 40.34 H new ATOM 0 HG LEU A 147 4.993 8.373 4.945 1.00 41.54 H new ATOM 0 HD11 LEU A 147 4.833 7.887 2.533 1.00 75.13 H new ATOM 0 HD12 LEU A 147 6.467 7.567 3.163 1.00 75.13 H new ATOM 0 HD13 LEU A 147 5.358 6.214 2.838 1.00 75.13 H new ATOM 0 HD21 LEU A 147 2.850 7.589 3.988 1.00 4.12 H new ATOM 0 HD22 LEU A 147 3.308 5.909 4.352 1.00 4.12 H new ATOM 0 HD23 LEU A 147 3.044 7.066 5.678 1.00 4.12 H new ATOM 2255 N GLY A 148 4.743 4.619 8.331 1.00 22.21 N ATOM 2256 CA GLY A 148 4.946 3.319 8.956 1.00 22.42 C ATOM 2257 C GLY A 148 4.464 2.166 8.082 1.00 51.11 C ATOM 2258 O GLY A 148 5.182 1.184 7.879 1.00 62.53 O ATOM 0 H GLY A 148 3.779 4.950 8.348 1.00 22.21 H new ATOM 0 HA2 GLY A 148 6.006 3.186 9.174 1.00 22.42 H new ATOM 0 HA3 GLY A 148 4.419 3.292 9.910 1.00 22.42 H new ATOM 2262 N PHE A 149 3.248 2.292 7.548 1.00 63.01 N ATOM 2263 CA PHE A 149 2.634 1.228 6.741 1.00 13.12 C ATOM 2264 C PHE A 149 1.660 1.804 5.698 1.00 53.52 C ATOM 2265 O PHE A 149 1.217 2.947 5.814 1.00 73.33 O ATOM 2266 CB PHE A 149 1.869 0.256 7.649 1.00 54.13 C ATOM 2267 CG PHE A 149 0.619 0.864 8.244 1.00 43.04 C ATOM 2268 CD1 PHE A 149 0.696 1.731 9.324 1.00 22.22 C ATOM 2269 CD2 PHE A 149 -0.631 0.583 7.708 1.00 11.14 C ATOM 2270 CE1 PHE A 149 -0.442 2.301 9.857 1.00 43.41 C ATOM 2271 CE2 PHE A 149 -1.772 1.149 8.239 1.00 32.40 C ATOM 2272 CZ PHE A 149 -1.678 2.009 9.314 1.00 21.53 C ATOM 0 H PHE A 149 2.665 3.122 7.658 1.00 63.01 H new ATOM 0 HA PHE A 149 3.436 0.705 6.220 1.00 13.12 H new ATOM 0 HB2 PHE A 149 1.598 -0.631 7.076 1.00 54.13 H new ATOM 0 HB3 PHE A 149 2.525 -0.073 8.455 1.00 54.13 H new ATOM 0 HD1 PHE A 149 1.659 1.963 9.753 1.00 22.22 H new ATOM 0 HD2 PHE A 149 -0.711 -0.087 6.865 1.00 11.14 H new ATOM 0 HE1 PHE A 149 -0.366 2.975 10.698 1.00 43.41 H new ATOM 0 HE2 PHE A 149 -2.738 0.919 7.814 1.00 32.40 H new ATOM 0 HZ PHE A 149 -2.570 2.453 9.730 1.00 21.53 H new ATOM 2282 N VAL A 150 1.341 1.000 4.683 1.00 11.34 N ATOM 2283 CA VAL A 150 0.290 1.328 3.707 1.00 22.53 C ATOM 2284 C VAL A 150 -0.649 0.117 3.496 1.00 4.12 C ATOM 2285 O VAL A 150 -0.371 -0.778 2.697 1.00 1.15 O ATOM 2286 CB VAL A 150 0.895 1.773 2.344 1.00 53.34 C ATOM 2287 CG1 VAL A 150 -0.200 2.118 1.336 1.00 53.43 C ATOM 2288 CG2 VAL A 150 1.848 2.957 2.529 1.00 62.23 C ATOM 0 H VAL A 150 1.799 0.105 4.511 1.00 11.34 H new ATOM 0 HA VAL A 150 -0.284 2.162 4.111 1.00 22.53 H new ATOM 0 HB VAL A 150 1.464 0.933 1.947 1.00 53.34 H new ATOM 0 HG11 VAL A 150 0.256 2.425 0.395 1.00 53.43 H new ATOM 0 HG12 VAL A 150 -0.828 1.243 1.167 1.00 53.43 H new ATOM 0 HG13 VAL A 150 -0.810 2.932 1.726 1.00 53.43 H new ATOM 0 HG21 VAL A 150 2.258 3.249 1.562 1.00 62.23 H new ATOM 0 HG22 VAL A 150 1.305 3.797 2.962 1.00 62.23 H new ATOM 0 HG23 VAL A 150 2.661 2.669 3.195 1.00 62.23 H new ATOM 2298 N ARG A 151 -1.749 0.082 4.246 1.00 62.54 N ATOM 2299 CA ARG A 151 -2.689 -1.049 4.217 1.00 45.41 C ATOM 2300 C ARG A 151 -3.750 -0.891 3.107 1.00 4.52 C ATOM 2301 O ARG A 151 -4.664 -0.072 3.216 1.00 73.13 O ATOM 2302 CB ARG A 151 -3.364 -1.185 5.592 1.00 23.45 C ATOM 2303 CG ARG A 151 -4.378 -2.326 5.697 1.00 35.42 C ATOM 2304 CD ARG A 151 -4.922 -2.472 7.121 1.00 61.41 C ATOM 2305 NE ARG A 151 -5.616 -1.270 7.580 1.00 34.34 N ATOM 2306 CZ ARG A 151 -5.541 -0.783 8.793 1.00 42.10 C ATOM 2307 NH1 ARG A 151 -4.810 -1.362 9.700 1.00 35.11 N ATOM 2308 NH2 ARG A 151 -6.208 0.285 9.100 1.00 34.11 N ATOM 0 H ARG A 151 -2.017 0.828 4.888 1.00 62.54 H new ATOM 0 HA ARG A 151 -2.125 -1.954 3.992 1.00 45.41 H new ATOM 0 HB2 ARG A 151 -2.592 -1.333 6.347 1.00 23.45 H new ATOM 0 HB3 ARG A 151 -3.867 -0.247 5.829 1.00 23.45 H new ATOM 0 HG2 ARG A 151 -5.204 -2.143 5.009 1.00 35.42 H new ATOM 0 HG3 ARG A 151 -3.908 -3.260 5.390 1.00 35.42 H new ATOM 0 HD2 ARG A 151 -5.606 -3.320 7.160 1.00 61.41 H new ATOM 0 HD3 ARG A 151 -4.099 -2.694 7.800 1.00 61.41 H new ATOM 0 HE ARG A 151 -6.201 -0.775 6.907 1.00 34.34 H new ATOM 0 HH11 ARG A 151 -4.286 -2.206 9.470 1.00 35.11 H new ATOM 0 HH12 ARG A 151 -4.761 -0.972 10.641 1.00 35.11 H new ATOM 0 HH21 ARG A 151 -6.789 0.743 8.398 1.00 34.11 H new ATOM 0 HH22 ARG A 151 -6.152 0.667 10.044 1.00 34.11 H new ATOM 2322 N ILE A 152 -3.625 -1.688 2.046 1.00 41.53 N ATOM 2323 CA ILE A 152 -4.549 -1.627 0.901 1.00 72.43 C ATOM 2324 C ILE A 152 -5.798 -2.499 1.138 1.00 61.23 C ATOM 2325 O ILE A 152 -5.682 -3.641 1.591 1.00 30.32 O ATOM 2326 CB ILE A 152 -3.851 -2.110 -0.397 1.00 43.23 C ATOM 2327 CG1 ILE A 152 -2.467 -1.451 -0.557 1.00 23.24 C ATOM 2328 CG2 ILE A 152 -4.729 -1.828 -1.617 1.00 10.33 C ATOM 2329 CD1 ILE A 152 -2.510 0.054 -0.699 1.00 65.04 C ATOM 0 H ILE A 152 -2.890 -2.389 1.951 1.00 41.53 H new ATOM 0 HA ILE A 152 -4.852 -0.585 0.794 1.00 72.43 H new ATOM 0 HB ILE A 152 -3.704 -3.187 -0.322 1.00 43.23 H new ATOM 0 HG12 ILE A 152 -1.854 -1.706 0.307 1.00 23.24 H new ATOM 0 HG13 ILE A 152 -1.975 -1.874 -1.433 1.00 23.24 H new ATOM 0 HG21 ILE A 152 -4.222 -2.174 -2.518 1.00 10.33 H new ATOM 0 HG22 ILE A 152 -5.679 -2.352 -1.511 1.00 10.33 H new ATOM 0 HG23 ILE A 152 -4.913 -0.756 -1.693 1.00 10.33 H new ATOM 0 HD11 ILE A 152 -1.496 0.438 -0.807 1.00 65.04 H new ATOM 0 HD12 ILE A 152 -3.094 0.320 -1.580 1.00 65.04 H new ATOM 0 HD13 ILE A 152 -2.971 0.490 0.187 1.00 65.04 H new ATOM 2341 N HIS A 153 -6.986 -1.960 0.828 1.00 71.32 N ATOM 2342 CA HIS A 153 -8.245 -2.717 0.967 1.00 74.35 C ATOM 2343 C HIS A 153 -9.393 -2.091 0.143 1.00 33.31 C ATOM 2344 O HIS A 153 -9.207 -1.071 -0.521 1.00 43.40 O ATOM 2345 CB HIS A 153 -8.656 -2.811 2.442 1.00 54.21 C ATOM 2346 CG HIS A 153 -8.996 -1.492 3.068 1.00 12.44 C ATOM 2347 ND1 HIS A 153 -10.271 -1.157 3.476 1.00 54.54 N ATOM 2348 CD2 HIS A 153 -8.219 -0.426 3.372 1.00 64.44 C ATOM 2349 CE1 HIS A 153 -10.260 0.050 4.002 1.00 1.45 C ATOM 2350 NE2 HIS A 153 -9.032 0.516 3.951 1.00 71.42 N ATOM 0 H HIS A 153 -7.105 -1.008 0.481 1.00 71.32 H new ATOM 0 HA HIS A 153 -8.061 -3.718 0.577 1.00 74.35 H new ATOM 0 HB2 HIS A 153 -9.517 -3.474 2.527 1.00 54.21 H new ATOM 0 HB3 HIS A 153 -7.844 -3.270 3.006 1.00 54.21 H new ATOM 0 HD1 HIS A 153 -11.094 -1.752 3.384 1.00 54.54 H new ATOM 0 HD2 HIS A 153 -7.158 -0.334 3.193 1.00 64.44 H new ATOM 0 HE1 HIS A 153 -11.116 0.570 4.407 1.00 1.45 H new ATOM 2359 N ASP A 154 -10.574 -2.723 0.197 1.00 13.33 N ATOM 2360 CA ASP A 154 -11.783 -2.241 -0.505 1.00 72.03 C ATOM 2361 C ASP A 154 -11.627 -2.277 -2.033 1.00 2.22 C ATOM 2362 O ASP A 154 -12.344 -1.579 -2.752 1.00 2.22 O ATOM 2363 CB ASP A 154 -12.155 -0.818 -0.055 1.00 45.53 C ATOM 2364 CG ASP A 154 -12.493 -0.726 1.422 1.00 54.32 C ATOM 2365 OD1 ASP A 154 -12.742 -1.774 2.060 1.00 64.11 O ATOM 2366 OD2 ASP A 154 -12.501 0.398 1.953 1.00 11.52 O ATOM 0 H ASP A 154 -10.723 -3.582 0.726 1.00 13.33 H new ATOM 0 HA ASP A 154 -12.588 -2.925 -0.235 1.00 72.03 H new ATOM 0 HB2 ASP A 154 -11.325 -0.146 -0.273 1.00 45.53 H new ATOM 0 HB3 ASP A 154 -13.008 -0.471 -0.638 1.00 45.53 H new ATOM 2371 N ILE A 155 -10.717 -3.109 -2.531 1.00 21.13 N ATOM 2372 CA ILE A 155 -10.478 -3.198 -3.974 1.00 3.13 C ATOM 2373 C ILE A 155 -11.716 -3.731 -4.718 1.00 33.13 C ATOM 2374 O ILE A 155 -11.967 -4.942 -4.768 1.00 63.50 O ATOM 2375 CB ILE A 155 -9.242 -4.079 -4.299 1.00 72.04 C ATOM 2376 CG1 ILE A 155 -7.985 -3.527 -3.599 1.00 65.03 C ATOM 2377 CG2 ILE A 155 -9.018 -4.168 -5.810 1.00 62.53 C ATOM 2378 CD1 ILE A 155 -7.636 -2.105 -3.990 1.00 3.41 C ATOM 0 H ILE A 155 -10.136 -3.728 -1.965 1.00 21.13 H new ATOM 0 HA ILE A 155 -10.275 -2.185 -4.321 1.00 3.13 H new ATOM 0 HB ILE A 155 -9.434 -5.084 -3.924 1.00 72.04 H new ATOM 0 HG12 ILE A 155 -8.134 -3.570 -2.520 1.00 65.03 H new ATOM 0 HG13 ILE A 155 -7.139 -4.174 -3.830 1.00 65.03 H new ATOM 0 HG21 ILE A 155 -8.146 -4.790 -6.013 1.00 62.53 H new ATOM 0 HG22 ILE A 155 -9.896 -4.608 -6.283 1.00 62.53 H new ATOM 0 HG23 ILE A 155 -8.852 -3.169 -6.213 1.00 62.53 H new ATOM 0 HD11 ILE A 155 -6.740 -1.790 -3.455 1.00 3.41 H new ATOM 0 HD12 ILE A 155 -7.453 -2.057 -5.063 1.00 3.41 H new ATOM 0 HD13 ILE A 155 -8.463 -1.444 -3.733 1.00 3.41 H new ATOM 2390 N GLN A 156 -12.501 -2.806 -5.263 1.00 21.45 N ATOM 2391 CA GLN A 156 -13.720 -3.133 -6.010 1.00 31.23 C ATOM 2392 C GLN A 156 -13.588 -2.732 -7.492 1.00 14.03 C ATOM 2393 O GLN A 156 -12.871 -1.787 -7.826 1.00 14.25 O ATOM 2394 CB GLN A 156 -14.919 -2.418 -5.367 1.00 45.13 C ATOM 2395 CG GLN A 156 -14.807 -0.894 -5.370 1.00 60.21 C ATOM 2396 CD GLN A 156 -15.950 -0.208 -4.633 1.00 12.54 C ATOM 2397 OE1 GLN A 156 -16.362 0.891 -4.993 1.00 2.14 O ATOM 2398 NE2 GLN A 156 -16.448 -0.828 -3.578 1.00 75.31 N ATOM 0 H GLN A 156 -12.313 -1.805 -5.201 1.00 21.45 H new ATOM 0 HA GLN A 156 -13.875 -4.211 -5.971 1.00 31.23 H new ATOM 0 HB2 GLN A 156 -15.827 -2.707 -5.896 1.00 45.13 H new ATOM 0 HB3 GLN A 156 -15.026 -2.762 -4.338 1.00 45.13 H new ATOM 0 HG2 GLN A 156 -13.862 -0.605 -4.911 1.00 60.21 H new ATOM 0 HG3 GLN A 156 -14.783 -0.540 -6.401 1.00 60.21 H new ATOM 0 HE21 GLN A 156 -16.084 -1.741 -3.304 1.00 75.31 H new ATOM 0 HE22 GLN A 156 -17.196 -0.394 -3.037 1.00 75.31 H new ATOM 2407 N PRO A 157 -14.275 -3.445 -8.407 1.00 55.42 N ATOM 2408 CA PRO A 157 -14.187 -3.166 -9.852 1.00 31.55 C ATOM 2409 C PRO A 157 -14.912 -1.874 -10.282 1.00 53.02 C ATOM 2410 O PRO A 157 -15.921 -1.478 -9.692 1.00 60.21 O ATOM 2411 CB PRO A 157 -14.857 -4.393 -10.485 1.00 21.22 C ATOM 2412 CG PRO A 157 -15.818 -4.874 -9.449 1.00 4.45 C ATOM 2413 CD PRO A 157 -15.180 -4.577 -8.116 1.00 34.34 C ATOM 0 HA PRO A 157 -13.154 -3.004 -10.161 1.00 31.55 H new ATOM 0 HB2 PRO A 157 -15.370 -4.131 -11.410 1.00 21.22 H new ATOM 0 HB3 PRO A 157 -14.124 -5.161 -10.733 1.00 21.22 H new ATOM 0 HG2 PRO A 157 -16.778 -4.367 -9.543 1.00 4.45 H new ATOM 0 HG3 PRO A 157 -16.009 -5.941 -9.560 1.00 4.45 H new ATOM 0 HD2 PRO A 157 -15.925 -4.312 -7.365 1.00 34.34 H new ATOM 0 HD3 PRO A 157 -14.634 -5.439 -7.732 1.00 34.34 H new ATOM 2421 N VAL A 158 -14.378 -1.225 -11.316 1.00 24.51 N ATOM 2422 CA VAL A 158 -15.005 -0.042 -11.921 1.00 21.21 C ATOM 2423 C VAL A 158 -15.008 -0.166 -13.456 1.00 53.03 C ATOM 2424 O VAL A 158 -13.973 -0.417 -14.073 1.00 1.32 O ATOM 2425 CB VAL A 158 -14.296 1.270 -11.479 1.00 21.40 C ATOM 2426 CG1 VAL A 158 -12.791 1.198 -11.706 1.00 21.34 C ATOM 2427 CG2 VAL A 158 -14.884 2.483 -12.195 1.00 53.54 C ATOM 0 H VAL A 158 -13.502 -1.500 -11.759 1.00 24.51 H new ATOM 0 HA VAL A 158 -16.035 0.007 -11.569 1.00 21.21 H new ATOM 0 HB VAL A 158 -14.470 1.384 -10.409 1.00 21.40 H new ATOM 0 HG11 VAL A 158 -12.330 2.132 -11.386 1.00 21.34 H new ATOM 0 HG12 VAL A 158 -12.375 0.372 -11.130 1.00 21.34 H new ATOM 0 HG13 VAL A 158 -12.590 1.039 -12.765 1.00 21.34 H new ATOM 0 HG21 VAL A 158 -14.368 3.385 -11.866 1.00 53.54 H new ATOM 0 HG22 VAL A 158 -14.759 2.366 -13.271 1.00 53.54 H new ATOM 0 HG23 VAL A 158 -15.945 2.565 -11.960 1.00 53.54 H new ATOM 2437 N MET A 159 -16.178 -0.003 -14.071 1.00 11.24 N ATOM 2438 CA MET A 159 -16.337 -0.277 -15.506 1.00 73.50 C ATOM 2439 C MET A 159 -17.464 0.557 -16.137 1.00 35.14 C ATOM 2440 O MET A 159 -17.971 1.503 -15.532 1.00 2.11 O ATOM 2441 CB MET A 159 -16.620 -1.776 -15.709 1.00 51.32 C ATOM 2442 CG MET A 159 -17.876 -2.262 -14.989 1.00 52.21 C ATOM 2443 SD MET A 159 -18.170 -4.029 -15.204 1.00 12.34 S ATOM 2444 CE MET A 159 -19.699 -4.233 -14.292 1.00 13.32 C ATOM 0 H MET A 159 -17.028 0.315 -13.605 1.00 11.24 H new ATOM 0 HA MET A 159 -15.409 0.004 -16.004 1.00 73.50 H new ATOM 0 HB2 MET A 159 -16.721 -1.977 -16.775 1.00 51.32 H new ATOM 0 HB3 MET A 159 -15.763 -2.350 -15.356 1.00 51.32 H new ATOM 0 HG2 MET A 159 -17.788 -2.040 -13.925 1.00 52.21 H new ATOM 0 HG3 MET A 159 -18.738 -1.708 -15.359 1.00 52.21 H new ATOM 0 HE1 MET A 159 -20.010 -5.277 -14.333 1.00 13.32 H new ATOM 0 HE2 MET A 159 -19.545 -3.940 -13.253 1.00 13.32 H new ATOM 0 HE3 MET A 159 -20.473 -3.606 -14.734 1.00 13.32 H new ATOM 2454 N GLN A 160 -17.836 0.206 -17.369 1.00 41.24 N ATOM 2455 CA GLN A 160 -18.946 0.869 -18.070 1.00 32.15 C ATOM 2456 C GLN A 160 -20.301 0.544 -17.412 1.00 3.43 C ATOM 2457 O GLN A 160 -20.451 -0.478 -16.740 1.00 62.32 O ATOM 2458 CB GLN A 160 -18.973 0.470 -19.561 1.00 62.11 C ATOM 2459 CG GLN A 160 -19.236 -1.017 -19.828 1.00 73.30 C ATOM 2460 CD GLN A 160 -18.068 -1.926 -19.463 1.00 13.23 C ATOM 2461 OE1 GLN A 160 -18.257 -3.069 -19.065 1.00 65.14 O ATOM 2462 NE2 GLN A 160 -16.850 -1.435 -19.610 1.00 40.11 N ATOM 0 H GLN A 160 -17.386 -0.535 -17.906 1.00 41.24 H new ATOM 0 HA GLN A 160 -18.780 1.944 -17.997 1.00 32.15 H new ATOM 0 HB2 GLN A 160 -19.742 1.056 -20.065 1.00 62.11 H new ATOM 0 HB3 GLN A 160 -18.019 0.742 -20.012 1.00 62.11 H new ATOM 0 HG2 GLN A 160 -20.115 -1.327 -19.264 1.00 73.30 H new ATOM 0 HG3 GLN A 160 -19.471 -1.150 -20.884 1.00 73.30 H new ATOM 0 HE21 GLN A 160 -16.722 -0.480 -19.943 1.00 40.11 H new ATOM 0 HE22 GLN A 160 -16.038 -2.011 -19.390 1.00 40.11 H new ATOM 2471 N LEU A 161 -21.285 1.418 -17.616 1.00 73.02 N ATOM 2472 CA LEU A 161 -22.610 1.254 -17.005 1.00 72.21 C ATOM 2473 C LEU A 161 -23.436 0.164 -17.711 1.00 71.34 C ATOM 2474 O LEU A 161 -23.771 0.292 -18.890 1.00 54.23 O ATOM 2475 CB LEU A 161 -23.376 2.586 -17.042 1.00 55.14 C ATOM 2476 CG LEU A 161 -22.683 3.768 -16.341 1.00 62.14 C ATOM 2477 CD1 LEU A 161 -23.519 5.041 -16.477 1.00 40.14 C ATOM 2478 CD2 LEU A 161 -22.416 3.450 -14.871 1.00 1.33 C ATOM 0 H LEU A 161 -21.193 2.249 -18.200 1.00 73.02 H new ATOM 0 HA LEU A 161 -22.457 0.943 -15.971 1.00 72.21 H new ATOM 0 HB2 LEU A 161 -23.551 2.856 -18.083 1.00 55.14 H new ATOM 0 HB3 LEU A 161 -24.353 2.436 -16.583 1.00 55.14 H new ATOM 0 HG LEU A 161 -21.723 3.936 -16.829 1.00 62.14 H new ATOM 0 HD11 LEU A 161 -23.012 5.865 -15.975 1.00 40.14 H new ATOM 0 HD12 LEU A 161 -23.645 5.282 -17.532 1.00 40.14 H new ATOM 0 HD13 LEU A 161 -24.497 4.885 -16.021 1.00 40.14 H new ATOM 0 HD21 LEU A 161 -21.926 4.301 -14.398 1.00 1.33 H new ATOM 0 HD22 LEU A 161 -23.360 3.248 -14.365 1.00 1.33 H new ATOM 0 HD23 LEU A 161 -21.771 2.574 -14.800 1.00 1.33 H new ATOM 2490 N GLU A 162 -23.747 -0.914 -16.990 1.00 1.45 N ATOM 2491 CA GLU A 162 -24.625 -1.971 -17.508 1.00 63.42 C ATOM 2492 C GLU A 162 -25.880 -2.137 -16.641 1.00 15.21 C ATOM 2493 O GLU A 162 -25.812 -2.117 -15.409 1.00 61.21 O ATOM 2494 CB GLU A 162 -23.890 -3.317 -17.587 1.00 1.42 C ATOM 2495 CG GLU A 162 -22.709 -3.336 -18.549 1.00 0.25 C ATOM 2496 CD GLU A 162 -22.248 -4.751 -18.869 1.00 60.33 C ATOM 2497 OE1 GLU A 162 -21.645 -5.405 -17.992 1.00 65.12 O ATOM 2498 OE2 GLU A 162 -22.499 -5.222 -20.001 1.00 43.31 O ATOM 0 H GLU A 162 -23.405 -1.081 -16.044 1.00 1.45 H new ATOM 0 HA GLU A 162 -24.924 -1.665 -18.510 1.00 63.42 H new ATOM 0 HB2 GLU A 162 -23.535 -3.582 -16.591 1.00 1.42 H new ATOM 0 HB3 GLU A 162 -24.600 -4.087 -17.888 1.00 1.42 H new ATOM 0 HG2 GLU A 162 -22.988 -2.829 -19.473 1.00 0.25 H new ATOM 0 HG3 GLU A 162 -21.881 -2.776 -18.115 1.00 0.25 H new ATOM 2505 N HIS A 163 -27.025 -2.315 -17.293 1.00 73.15 N ATOM 2506 CA HIS A 163 -28.287 -2.577 -16.599 1.00 0.30 C ATOM 2507 C HIS A 163 -28.522 -4.091 -16.482 1.00 31.13 C ATOM 2508 O HIS A 163 -28.256 -4.836 -17.422 1.00 44.41 O ATOM 2509 CB HIS A 163 -29.450 -1.920 -17.354 1.00 73.41 C ATOM 2510 CG HIS A 163 -30.771 -2.021 -16.648 1.00 3.51 C ATOM 2511 ND1 HIS A 163 -31.653 -3.063 -16.843 1.00 75.41 N ATOM 2512 CD2 HIS A 163 -31.360 -1.203 -15.742 1.00 11.45 C ATOM 2513 CE1 HIS A 163 -32.719 -2.884 -16.093 1.00 23.12 C ATOM 2514 NE2 HIS A 163 -32.569 -1.767 -15.417 1.00 63.12 N ATOM 0 H HIS A 163 -27.107 -2.283 -18.309 1.00 73.15 H new ATOM 0 HA HIS A 163 -28.232 -2.151 -15.597 1.00 0.30 H new ATOM 0 HB2 HIS A 163 -29.216 -0.868 -17.516 1.00 73.41 H new ATOM 0 HB3 HIS A 163 -29.539 -2.382 -18.337 1.00 73.41 H new ATOM 0 HD2 HIS A 163 -30.955 -0.282 -15.350 1.00 11.45 H new ATOM 0 HE1 HIS A 163 -33.573 -3.543 -16.042 1.00 23.12 H new ATOM 0 HE2 HIS A 163 -33.243 -1.381 -14.756 1.00 63.12 H new ATOM 2523 N HIS A 164 -29.012 -4.545 -15.332 1.00 44.34 N ATOM 2524 CA HIS A 164 -29.254 -5.977 -15.110 1.00 12.41 C ATOM 2525 C HIS A 164 -30.715 -6.256 -14.732 1.00 30.40 C ATOM 2526 O HIS A 164 -31.217 -5.732 -13.734 1.00 10.42 O ATOM 2527 CB HIS A 164 -28.324 -6.508 -14.010 1.00 52.32 C ATOM 2528 CG HIS A 164 -26.866 -6.351 -14.326 1.00 42.42 C ATOM 2529 ND1 HIS A 164 -26.354 -6.486 -15.595 1.00 55.33 N ATOM 2530 CD2 HIS A 164 -25.807 -6.063 -13.531 1.00 4.32 C ATOM 2531 CE1 HIS A 164 -25.054 -6.291 -15.572 1.00 0.23 C ATOM 2532 NE2 HIS A 164 -24.689 -6.034 -14.333 1.00 62.24 N ATOM 0 H HIS A 164 -29.250 -3.949 -14.539 1.00 44.34 H new ATOM 0 HA HIS A 164 -29.045 -6.493 -16.047 1.00 12.41 H new ATOM 0 HB2 HIS A 164 -28.543 -5.987 -13.078 1.00 52.32 H new ATOM 0 HB3 HIS A 164 -28.539 -7.563 -13.843 1.00 52.32 H new ATOM 0 HD2 HIS A 164 -25.835 -5.889 -12.466 1.00 4.32 H new ATOM 0 HE1 HIS A 164 -24.395 -6.334 -16.427 1.00 0.23 H new ATOM 0 HE2 HIS A 164 -23.737 -5.845 -14.020 1.00 62.24 H new ATOM 2541 N HIS A 165 -31.398 -7.071 -15.535 1.00 65.42 N ATOM 2542 CA HIS A 165 -32.756 -7.519 -15.206 1.00 41.01 C ATOM 2543 C HIS A 165 -32.699 -8.764 -14.315 1.00 22.03 C ATOM 2544 O HIS A 165 -32.605 -9.892 -14.805 1.00 45.41 O ATOM 2545 CB HIS A 165 -33.561 -7.822 -16.479 1.00 25.40 C ATOM 2546 CG HIS A 165 -35.012 -8.131 -16.225 1.00 70.42 C ATOM 2547 ND1 HIS A 165 -36.033 -7.256 -16.525 1.00 24.41 N ATOM 2548 CD2 HIS A 165 -35.613 -9.227 -15.697 1.00 52.50 C ATOM 2549 CE1 HIS A 165 -37.188 -7.793 -16.194 1.00 61.45 C ATOM 2550 NE2 HIS A 165 -36.963 -8.988 -15.690 1.00 21.31 N ATOM 0 H HIS A 165 -31.037 -7.435 -16.417 1.00 65.42 H new ATOM 0 HA HIS A 165 -33.257 -6.714 -14.668 1.00 41.01 H new ATOM 0 HB2 HIS A 165 -33.494 -6.967 -17.151 1.00 25.40 H new ATOM 0 HB3 HIS A 165 -33.104 -8.668 -16.993 1.00 25.40 H new ATOM 0 HD2 HIS A 165 -35.119 -10.122 -15.347 1.00 52.50 H new ATOM 0 HE1 HIS A 165 -38.157 -7.331 -16.315 1.00 61.45 H new ATOM 0 HE2 HIS A 165 -37.677 -9.632 -15.349 1.00 21.31 H new ATOM 2559 N HIS A 166 -32.747 -8.557 -13.008 1.00 12.34 N ATOM 2560 CA HIS A 166 -32.661 -9.658 -12.051 1.00 32.10 C ATOM 2561 C HIS A 166 -34.030 -10.345 -11.897 1.00 1.51 C ATOM 2562 O HIS A 166 -35.043 -9.675 -11.693 1.00 43.34 O ATOM 2563 CB HIS A 166 -32.154 -9.126 -10.704 1.00 63.41 C ATOM 2564 CG HIS A 166 -31.553 -10.177 -9.825 1.00 51.20 C ATOM 2565 ND1 HIS A 166 -30.259 -10.617 -9.970 1.00 24.22 N ATOM 2566 CD2 HIS A 166 -32.066 -10.868 -8.783 1.00 72.11 C ATOM 2567 CE1 HIS A 166 -30.000 -11.530 -9.059 1.00 44.25 C ATOM 2568 NE2 HIS A 166 -31.080 -11.700 -8.324 1.00 73.32 N ATOM 0 H HIS A 166 -32.845 -7.636 -12.581 1.00 12.34 H new ATOM 0 HA HIS A 166 -31.957 -10.404 -12.419 1.00 32.10 H new ATOM 0 HB2 HIS A 166 -31.410 -8.351 -10.887 1.00 63.41 H new ATOM 0 HB3 HIS A 166 -32.983 -8.654 -10.176 1.00 63.41 H new ATOM 0 HD2 HIS A 166 -33.067 -10.780 -8.386 1.00 72.11 H new ATOM 0 HE1 HIS A 166 -29.062 -12.051 -8.935 1.00 44.25 H new ATOM 0 HE2 HIS A 166 -31.168 -12.347 -7.540 1.00 73.32 H new ATOM 2577 N HIS A 167 -34.044 -11.678 -12.009 1.00 13.41 N ATOM 2578 CA HIS A 167 -35.278 -12.479 -11.958 1.00 12.42 C ATOM 2579 C HIS A 167 -36.099 -12.345 -13.248 1.00 54.54 C ATOM 2580 O HIS A 167 -36.943 -11.456 -13.381 1.00 5.11 O ATOM 2581 CB HIS A 167 -36.151 -12.127 -10.736 1.00 11.21 C ATOM 2582 CG HIS A 167 -35.589 -12.590 -9.429 1.00 54.21 C ATOM 2583 ND1 HIS A 167 -35.298 -11.738 -8.382 1.00 55.11 N ATOM 2584 CD2 HIS A 167 -35.287 -13.833 -8.989 1.00 72.13 C ATOM 2585 CE1 HIS A 167 -34.844 -12.439 -7.363 1.00 64.02 C ATOM 2586 NE2 HIS A 167 -34.826 -13.709 -7.703 1.00 41.41 N ATOM 0 H HIS A 167 -33.200 -12.235 -12.138 1.00 13.41 H new ATOM 0 HA HIS A 167 -34.961 -13.517 -11.858 1.00 12.42 H new ATOM 0 HB2 HIS A 167 -36.286 -11.046 -10.699 1.00 11.21 H new ATOM 0 HB3 HIS A 167 -37.139 -12.567 -10.870 1.00 11.21 H new ATOM 0 HD2 HIS A 167 -35.390 -14.752 -9.547 1.00 72.13 H new ATOM 0 HE1 HIS A 167 -34.538 -12.038 -6.408 1.00 64.02 H new ATOM 0 HE2 HIS A 167 -34.519 -14.478 -7.107 1.00 41.41 H new ATOM 2595 N HIS A 168 -35.832 -13.228 -14.207 1.00 73.35 N ATOM 2596 CA HIS A 168 -36.607 -13.272 -15.457 1.00 43.40 C ATOM 2597 C HIS A 168 -37.506 -14.530 -15.523 1.00 51.54 C ATOM 2598 O HIS A 168 -36.987 -15.641 -15.750 1.00 37.15 O ATOM 2599 CB HIS A 168 -35.679 -13.182 -16.685 1.00 43.41 C ATOM 2600 CG HIS A 168 -34.520 -14.138 -16.675 1.00 4.10 C ATOM 2601 ND1 HIS A 168 -34.641 -15.478 -16.969 1.00 33.13 N ATOM 2602 CD2 HIS A 168 -33.207 -13.933 -16.423 1.00 52.01 C ATOM 2603 CE1 HIS A 168 -33.459 -16.053 -16.903 1.00 60.23 C ATOM 2604 NE2 HIS A 168 -32.572 -15.141 -16.572 1.00 24.32 N ATOM 2605 OXT HIS A 168 -38.739 -14.395 -15.349 1.00 37.15 O ATOM 0 H HIS A 168 -35.088 -13.923 -14.149 1.00 73.35 H new ATOM 0 HA HIS A 168 -37.264 -12.403 -15.470 1.00 43.40 H new ATOM 0 HB2 HIS A 168 -36.271 -13.361 -17.583 1.00 43.41 H new ATOM 0 HB3 HIS A 168 -35.292 -12.166 -16.756 1.00 43.41 H new ATOM 0 HD1 HIS A 168 -35.513 -15.952 -17.202 1.00 33.13 H new ATOM 0 HD2 HIS A 168 -32.745 -12.995 -16.155 1.00 52.01 H new ATOM 0 HE1 HIS A 168 -33.253 -17.097 -17.089 1.00 60.23 H new TER 2614 HIS A 168