USER MOD reduce.3.24.130724 H: found=0, std=0, add=987, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 987 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 21 SER OG : rot 57:sc= 1.64 USER MOD Set 1.2: A 78 LYS NZ :NH3+ -146:sc= 1.17 (180deg=0) USER MOD Set 2.1: A 75 LYS NZ :NH3+ -164:sc= 0.461 (180deg=-0.5!) USER MOD Set 2.2: A 77 TYR OH : rot 180:sc= -0.242 USER MOD Set 3.1: A 65 LYS NZ :NH3+ -170:sc= 0.191 (180deg=-0.0815) USER MOD Set 3.2: A 69 GLN : amide:sc= -0.189 K(o=-1.1,f=-10!) USER MOD Set 3.3: A 70 TYR OH : rot 180:sc= -1.06 USER MOD Set 4.1: A 16 THR OG1 : rot 144:sc= 0.994 USER MOD Set 4.2: A 80 ASN : amide:sc= 0.837 K(o=1.8,f=-1.1!) USER MOD Set 5.1: A 5 HIS : no HD1:sc=-0.00666 X(o=-0.028,f=-0.0031) USER MOD Set 5.2: A 7 HIS : no HD1:sc= -0.0212 X(o=-0.028,f=-0.0031) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 152:sc= 0.424 (180deg=-0.104!) USER MOD Single : A 3 HIS : no HD1:sc= -0.075 X(o=-0.075,f=-0.032) USER MOD Single : A 4 HIS : no HD1:sc= -0.0157 X(o=-0.016,f=-0.001) USER MOD Single : A 6 HIS : no HD1:sc= -0.296 X(o=-0.3,f=-0.09) USER MOD Single : A 8 HIS : no HD1:sc= -0.047 X(o=-0.047,f=0) USER MOD Single : A 9 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot 29:sc= 1.04 USER MOD Single : A 15 GLN : amide:sc= -0.207 X(o=-0.21,f=-0.21) USER MOD Single : A 17 GLN : amide:sc= -0.222 X(o=-0.22,f=-0.64) USER MOD Single : A 22 MET CE :methyl -154:sc= -0.173 (180deg=-1.32) USER MOD Single : A 25 GLN : amide:sc= -0.114 K(o=-0.11,f=-2.2!) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= 0.598 K(o=0.6,f=-0.59) USER MOD Single : A 34 LYS NZ :NH3+ 175:sc= 0.00266 (180deg=-0.0491) USER MOD Single : A 36 THR OG1 : rot -77:sc= 1.2 USER MOD Single : A 37 SER OG : rot -25:sc= 0.16 USER MOD Single : A 38 CYS SG : rot -64:sc= -0.902 USER MOD Single : A 39 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 41 ASN : amide:sc= -0.632 X(o=-0.63,f=-0.27) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 62 GLN : amide:sc= -0.309 X(o=-0.31,f=-0.014) USER MOD Single : A 68 GLN : amide:sc= -0.422! K(o=-0.42!,f=-2.6) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 ASN : amide:sc= -0.316 K(o=-0.32,f=-3.9!) USER MOD Single : A 84 ASN : amide:sc= -1.14 K(o=-1.1,f=-6.5!) USER MOD Single : A 85 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 GLN : amide:sc= -0.174 X(o=-0.17,f=-0.16) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 98 THR OG1 : rot 62:sc= -1.27! USER MOD Single : A 101 MET CE :methyl -121:sc= 0 (180deg=-2.4!) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 ASN : amide:sc= -1.18 X(o=-1.2,f=-1.3) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 LYS NZ :NH3+ -148:sc= 0 (180deg=-0.814) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 GLN : amide:sc= -0.891 X(o=-0.89,f=-1) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ -128:sc= -0.0657 (180deg=-0.409) USER MOD Single : A 121 SER OG : rot 94:sc= 1.2 USER MOD Single : A 124 ASN : amide:sc= -3.78! K(o=-3.8!,f=-0.98) USER MOD Single : A 125 ASN : amide:sc= 0.56 K(o=0.56,f=-0.31) USER MOD Single : A 126 ASN : amide:sc= -5.06! C(o=-5.1!,f=-4!) USER MOD Single : A 128 ASN : amide:sc= 0.529 K(o=0.53,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -6.870 -42.151 -48.727 1.00 73.24 N ATOM 2 CA MET A 1 -7.938 -43.175 -48.801 1.00 53.02 C ATOM 3 C MET A 1 -9.137 -42.761 -47.952 1.00 61.40 C ATOM 4 O MET A 1 -8.989 -42.419 -46.776 1.00 10.15 O ATOM 5 CB MET A 1 -7.410 -44.533 -48.321 1.00 60.25 C ATOM 6 CG MET A 1 -6.247 -45.073 -49.143 1.00 75.42 C ATOM 7 SD MET A 1 -4.810 -43.978 -49.118 1.00 33.20 S ATOM 8 CE MET A 1 -3.656 -44.897 -50.140 1.00 63.14 C ATOM 0 H1 MET A 1 -5.945 -42.602 -48.877 1.00 73.24 H new ATOM 0 H2 MET A 1 -7.027 -41.432 -49.461 1.00 73.24 H new ATOM 0 H3 MET A 1 -6.887 -41.699 -47.790 1.00 73.24 H new ATOM 0 HA MET A 1 -8.254 -43.262 -49.840 1.00 53.02 H new ATOM 0 HB2 MET A 1 -7.095 -44.442 -47.282 1.00 60.25 H new ATOM 0 HB3 MET A 1 -8.225 -45.257 -48.345 1.00 60.25 H new ATOM 0 HG2 MET A 1 -5.960 -46.052 -48.760 1.00 75.42 H new ATOM 0 HG3 MET A 1 -6.571 -45.217 -50.174 1.00 75.42 H new ATOM 0 HE1 MET A 1 -2.719 -44.345 -50.217 1.00 63.14 H new ATOM 0 HE2 MET A 1 -3.467 -45.871 -49.689 1.00 63.14 H new ATOM 0 HE3 MET A 1 -4.080 -45.034 -51.135 1.00 63.14 H new ATOM 20 N ALA A 2 -10.326 -42.795 -48.548 1.00 4.20 N ATOM 21 CA ALA A 2 -11.560 -42.473 -47.836 1.00 23.41 C ATOM 22 C ALA A 2 -12.033 -43.682 -47.029 1.00 34.04 C ATOM 23 O ALA A 2 -13.108 -44.234 -47.274 1.00 4.43 O ATOM 24 CB ALA A 2 -12.633 -42.014 -48.817 1.00 14.54 C ATOM 0 H ALA A 2 -10.461 -43.044 -49.528 1.00 4.20 H new ATOM 0 HA ALA A 2 -11.366 -41.655 -47.142 1.00 23.41 H new ATOM 0 HB1 ALA A 2 -13.547 -41.778 -48.272 1.00 14.54 H new ATOM 0 HB2 ALA A 2 -12.286 -41.127 -49.347 1.00 14.54 H new ATOM 0 HB3 ALA A 2 -12.834 -42.809 -49.535 1.00 14.54 H new ATOM 30 N HIS A 3 -11.212 -44.087 -46.067 1.00 52.43 N ATOM 31 CA HIS A 3 -11.482 -45.283 -45.263 1.00 23.31 C ATOM 32 C HIS A 3 -12.435 -44.959 -44.112 1.00 63.32 C ATOM 33 O HIS A 3 -12.919 -45.856 -43.419 1.00 44.40 O ATOM 34 CB HIS A 3 -10.163 -45.858 -44.722 1.00 42.32 C ATOM 35 CG HIS A 3 -10.294 -47.215 -44.091 1.00 31.34 C ATOM 36 ND1 HIS A 3 -10.201 -48.388 -44.808 1.00 43.53 N ATOM 37 CD2 HIS A 3 -10.499 -47.583 -42.801 1.00 4.31 C ATOM 38 CE1 HIS A 3 -10.346 -49.415 -43.992 1.00 23.24 C ATOM 39 NE2 HIS A 3 -10.528 -48.955 -42.767 1.00 65.04 N ATOM 0 H HIS A 3 -10.348 -43.604 -45.820 1.00 52.43 H new ATOM 0 HA HIS A 3 -11.960 -46.029 -45.898 1.00 23.31 H new ATOM 0 HB2 HIS A 3 -9.444 -45.918 -45.539 1.00 42.32 H new ATOM 0 HB3 HIS A 3 -9.753 -45.166 -43.986 1.00 42.32 H new ATOM 0 HD2 HIS A 3 -10.617 -46.919 -41.957 1.00 4.31 H new ATOM 0 HE1 HIS A 3 -10.320 -50.456 -44.278 1.00 23.24 H new ATOM 0 HE2 HIS A 3 -10.667 -49.526 -41.933 1.00 65.04 H new ATOM 48 N HIS A 4 -12.701 -43.671 -43.910 1.00 71.22 N ATOM 49 CA HIS A 4 -13.613 -43.229 -42.860 1.00 40.44 C ATOM 50 C HIS A 4 -15.063 -43.484 -43.272 1.00 42.51 C ATOM 51 O HIS A 4 -15.712 -42.626 -43.877 1.00 15.33 O ATOM 52 CB HIS A 4 -13.391 -41.740 -42.539 1.00 22.12 C ATOM 53 CG HIS A 4 -14.355 -41.178 -41.533 1.00 24.11 C ATOM 54 ND1 HIS A 4 -14.378 -41.564 -40.208 1.00 5.22 N ATOM 55 CD2 HIS A 4 -15.340 -40.257 -41.669 1.00 70.13 C ATOM 56 CE1 HIS A 4 -15.330 -40.904 -39.576 1.00 43.14 C ATOM 57 NE2 HIS A 4 -15.929 -40.107 -40.440 1.00 33.43 N ATOM 0 H HIS A 4 -12.297 -42.914 -44.461 1.00 71.22 H new ATOM 0 HA HIS A 4 -13.406 -43.804 -41.958 1.00 40.44 H new ATOM 0 HB2 HIS A 4 -12.375 -41.607 -42.166 1.00 22.12 H new ATOM 0 HB3 HIS A 4 -13.469 -41.165 -43.462 1.00 22.12 H new ATOM 0 HD2 HIS A 4 -15.611 -39.738 -42.577 1.00 70.13 H new ATOM 0 HE1 HIS A 4 -15.577 -41.000 -38.529 1.00 43.14 H new ATOM 0 HE2 HIS A 4 -16.705 -39.480 -40.228 1.00 33.43 H new ATOM 66 N HIS A 5 -15.551 -44.681 -42.974 1.00 33.03 N ATOM 67 CA HIS A 5 -16.937 -45.037 -43.253 1.00 63.31 C ATOM 68 C HIS A 5 -17.840 -44.330 -42.239 1.00 14.45 C ATOM 69 O HIS A 5 -18.016 -44.802 -41.113 1.00 33.53 O ATOM 70 CB HIS A 5 -17.114 -46.564 -43.186 1.00 65.22 C ATOM 71 CG HIS A 5 -18.241 -47.091 -44.027 1.00 2.32 C ATOM 72 ND1 HIS A 5 -18.035 -47.792 -45.197 1.00 51.22 N ATOM 73 CD2 HIS A 5 -19.583 -47.035 -43.859 1.00 52.42 C ATOM 74 CE1 HIS A 5 -19.198 -48.141 -45.710 1.00 32.40 C ATOM 75 NE2 HIS A 5 -20.156 -47.696 -44.919 1.00 53.32 N ATOM 0 H HIS A 5 -15.006 -45.424 -42.538 1.00 33.03 H new ATOM 0 HA HIS A 5 -17.212 -44.716 -44.258 1.00 63.31 H new ATOM 0 HB2 HIS A 5 -16.186 -47.040 -43.503 1.00 65.22 H new ATOM 0 HB3 HIS A 5 -17.283 -46.854 -42.149 1.00 65.22 H new ATOM 0 HD2 HIS A 5 -20.107 -46.559 -43.043 1.00 52.42 H new ATOM 0 HE1 HIS A 5 -19.343 -48.698 -46.624 1.00 32.40 H new ATOM 0 HE2 HIS A 5 -21.157 -47.822 -45.070 1.00 53.32 H new ATOM 84 N HIS A 6 -18.384 -43.186 -42.642 1.00 75.12 N ATOM 85 CA HIS A 6 -19.031 -42.255 -41.712 1.00 34.43 C ATOM 86 C HIS A 6 -20.439 -42.702 -41.306 1.00 23.31 C ATOM 87 O HIS A 6 -21.259 -43.074 -42.147 1.00 54.44 O ATOM 88 CB HIS A 6 -19.079 -40.842 -42.319 1.00 42.00 C ATOM 89 CG HIS A 6 -19.787 -40.757 -43.642 1.00 13.52 C ATOM 90 ND1 HIS A 6 -21.127 -40.463 -43.763 1.00 32.33 N ATOM 91 CD2 HIS A 6 -19.325 -40.919 -44.907 1.00 12.01 C ATOM 92 CE1 HIS A 6 -21.460 -40.448 -45.041 1.00 63.32 C ATOM 93 NE2 HIS A 6 -20.386 -40.721 -45.753 1.00 73.40 N ATOM 0 H HIS A 6 -18.391 -42.876 -43.614 1.00 75.12 H new ATOM 0 HA HIS A 6 -18.427 -42.245 -40.805 1.00 34.43 H new ATOM 0 HB2 HIS A 6 -19.572 -40.173 -41.613 1.00 42.00 H new ATOM 0 HB3 HIS A 6 -18.059 -40.478 -42.443 1.00 42.00 H new ATOM 0 HD2 HIS A 6 -18.312 -41.159 -45.194 1.00 12.01 H new ATOM 0 HE1 HIS A 6 -22.445 -40.246 -45.435 1.00 63.32 H new ATOM 0 HE2 HIS A 6 -20.349 -40.776 -46.771 1.00 73.40 H new ATOM 102 N HIS A 7 -20.696 -42.651 -40.000 1.00 62.42 N ATOM 103 CA HIS A 7 -22.009 -42.941 -39.414 1.00 65.13 C ATOM 104 C HIS A 7 -22.135 -42.196 -38.086 1.00 32.10 C ATOM 105 O HIS A 7 -21.131 -41.752 -37.526 1.00 12.14 O ATOM 106 CB HIS A 7 -22.203 -44.450 -39.161 1.00 65.21 C ATOM 107 CG HIS A 7 -22.545 -45.254 -40.380 1.00 32.15 C ATOM 108 ND1 HIS A 7 -21.910 -46.433 -40.708 1.00 30.24 N ATOM 109 CD2 HIS A 7 -23.491 -45.065 -41.332 1.00 1.33 C ATOM 110 CE1 HIS A 7 -22.450 -46.931 -41.803 1.00 0.14 C ATOM 111 NE2 HIS A 7 -23.412 -46.123 -42.203 1.00 45.42 N ATOM 0 H HIS A 7 -19.990 -42.404 -39.307 1.00 62.42 H new ATOM 0 HA HIS A 7 -22.773 -42.615 -40.119 1.00 65.13 H new ATOM 0 HB2 HIS A 7 -21.289 -44.851 -38.723 1.00 65.21 H new ATOM 0 HB3 HIS A 7 -22.994 -44.581 -38.423 1.00 65.21 H new ATOM 0 HD2 HIS A 7 -24.180 -44.235 -41.394 1.00 1.33 H new ATOM 0 HE1 HIS A 7 -22.154 -47.848 -42.291 1.00 0.14 H new ATOM 0 HE2 HIS A 7 -24.001 -46.261 -43.024 1.00 45.42 H new ATOM 120 N HIS A 8 -23.360 -42.060 -37.586 1.00 13.45 N ATOM 121 CA HIS A 8 -23.592 -41.455 -36.274 1.00 23.23 C ATOM 122 C HIS A 8 -24.454 -42.384 -35.425 1.00 74.33 C ATOM 123 O HIS A 8 -25.307 -43.100 -35.952 1.00 52.42 O ATOM 124 CB HIS A 8 -24.254 -40.068 -36.400 1.00 33.02 C ATOM 125 CG HIS A 8 -25.704 -40.090 -36.804 1.00 23.32 C ATOM 126 ND1 HIS A 8 -26.128 -39.959 -38.109 1.00 24.34 N ATOM 127 CD2 HIS A 8 -26.832 -40.195 -36.059 1.00 53.33 C ATOM 128 CE1 HIS A 8 -27.448 -39.981 -38.147 1.00 31.13 C ATOM 129 NE2 HIS A 8 -27.900 -40.124 -36.917 1.00 15.55 N ATOM 0 H HIS A 8 -24.208 -42.360 -38.067 1.00 13.45 H new ATOM 0 HA HIS A 8 -22.627 -41.313 -35.787 1.00 23.23 H new ATOM 0 HB2 HIS A 8 -24.166 -39.552 -35.444 1.00 33.02 H new ATOM 0 HB3 HIS A 8 -23.697 -39.481 -37.131 1.00 33.02 H new ATOM 0 HD2 HIS A 8 -26.881 -40.313 -34.987 1.00 53.33 H new ATOM 0 HE1 HIS A 8 -28.055 -39.896 -39.036 1.00 31.13 H new ATOM 0 HE2 HIS A 8 -28.882 -40.174 -36.647 1.00 15.55 H new ATOM 138 N MET A 9 -24.224 -42.376 -34.117 1.00 13.43 N ATOM 139 CA MET A 9 -24.948 -43.251 -33.192 1.00 15.14 C ATOM 140 C MET A 9 -26.102 -42.497 -32.535 1.00 73.11 C ATOM 141 O MET A 9 -27.273 -42.772 -32.802 1.00 44.24 O ATOM 142 CB MET A 9 -23.991 -43.797 -32.120 1.00 12.04 C ATOM 143 CG MET A 9 -22.798 -44.557 -32.689 1.00 32.20 C ATOM 144 SD MET A 9 -21.664 -45.129 -31.408 1.00 63.45 S ATOM 145 CE MET A 9 -20.369 -45.864 -32.406 1.00 61.35 C ATOM 0 H MET A 9 -23.538 -41.770 -33.667 1.00 13.43 H new ATOM 0 HA MET A 9 -25.359 -44.088 -33.756 1.00 15.14 H new ATOM 0 HB2 MET A 9 -23.626 -42.967 -31.515 1.00 12.04 H new ATOM 0 HB3 MET A 9 -24.546 -44.457 -31.453 1.00 12.04 H new ATOM 0 HG2 MET A 9 -23.156 -45.413 -33.260 1.00 32.20 H new ATOM 0 HG3 MET A 9 -22.260 -43.913 -33.384 1.00 32.20 H new ATOM 0 HE1 MET A 9 -19.591 -46.264 -31.756 1.00 61.35 H new ATOM 0 HE2 MET A 9 -20.787 -46.670 -33.009 1.00 61.35 H new ATOM 0 HE3 MET A 9 -19.940 -45.106 -33.061 1.00 61.35 H new ATOM 155 N GLY A 10 -25.756 -41.528 -31.692 1.00 21.04 N ATOM 156 CA GLY A 10 -26.754 -40.753 -30.978 1.00 12.25 C ATOM 157 C GLY A 10 -26.132 -39.548 -30.309 1.00 70.45 C ATOM 158 O GLY A 10 -24.934 -39.299 -30.473 1.00 34.22 O ATOM 0 H GLY A 10 -24.792 -41.264 -31.490 1.00 21.04 H new ATOM 0 HA2 GLY A 10 -27.530 -40.428 -31.671 1.00 12.25 H new ATOM 0 HA3 GLY A 10 -27.238 -41.380 -30.229 1.00 12.25 H new ATOM 162 N THR A 11 -26.927 -38.801 -29.555 1.00 23.34 N ATOM 163 CA THR A 11 -26.438 -37.601 -28.891 1.00 5.34 C ATOM 164 C THR A 11 -27.332 -37.233 -27.707 1.00 73.25 C ATOM 165 O THR A 11 -28.487 -37.664 -27.627 1.00 41.22 O ATOM 166 CB THR A 11 -26.361 -36.413 -29.886 1.00 3.23 C ATOM 167 OG1 THR A 11 -25.704 -35.285 -29.283 1.00 31.45 O ATOM 168 CG2 THR A 11 -27.750 -36.002 -30.365 1.00 54.52 C ATOM 0 H THR A 11 -27.912 -39.005 -29.388 1.00 23.34 H new ATOM 0 HA THR A 11 -25.435 -37.811 -28.519 1.00 5.34 H new ATOM 0 HB THR A 11 -25.781 -36.745 -30.747 1.00 3.23 H new ATOM 0 HG1 THR A 11 -25.064 -35.600 -28.611 1.00 31.45 H new ATOM 0 HG21 THR A 11 -27.663 -35.167 -31.061 1.00 54.52 H new ATOM 0 HG22 THR A 11 -28.226 -36.845 -30.867 1.00 54.52 H new ATOM 0 HG23 THR A 11 -28.355 -35.700 -29.510 1.00 54.52 H new ATOM 176 N LEU A 12 -26.786 -36.450 -26.787 1.00 74.23 N ATOM 177 CA LEU A 12 -27.513 -35.996 -25.608 1.00 43.44 C ATOM 178 C LEU A 12 -26.902 -34.680 -25.133 1.00 71.21 C ATOM 179 O LEU A 12 -25.722 -34.417 -25.373 1.00 3.42 O ATOM 180 CB LEU A 12 -27.452 -37.083 -24.509 1.00 12.22 C ATOM 181 CG LEU A 12 -28.462 -36.961 -23.343 1.00 24.24 C ATOM 182 CD1 LEU A 12 -28.000 -35.945 -22.298 1.00 50.32 C ATOM 183 CD2 LEU A 12 -29.852 -36.605 -23.871 1.00 34.25 C ATOM 0 H LEU A 12 -25.825 -36.111 -26.836 1.00 74.23 H new ATOM 0 HA LEU A 12 -28.563 -35.826 -25.846 1.00 43.44 H new ATOM 0 HB2 LEU A 12 -27.598 -38.053 -24.984 1.00 12.22 H new ATOM 0 HB3 LEU A 12 -26.447 -37.083 -24.088 1.00 12.22 H new ATOM 0 HG LEU A 12 -28.516 -37.932 -22.850 1.00 24.24 H new ATOM 0 HD11 LEU A 12 -28.736 -35.888 -21.496 1.00 50.32 H new ATOM 0 HD12 LEU A 12 -27.039 -36.256 -21.888 1.00 50.32 H new ATOM 0 HD13 LEU A 12 -27.895 -34.965 -22.764 1.00 50.32 H new ATOM 0 HD21 LEU A 12 -30.548 -36.524 -23.036 1.00 34.25 H new ATOM 0 HD22 LEU A 12 -29.807 -35.653 -24.400 1.00 34.25 H new ATOM 0 HD23 LEU A 12 -30.193 -37.384 -24.553 1.00 34.25 H new ATOM 195 N GLU A 13 -27.710 -33.838 -24.504 1.00 14.14 N ATOM 196 CA GLU A 13 -27.236 -32.564 -23.975 1.00 12.15 C ATOM 197 C GLU A 13 -27.748 -32.358 -22.547 1.00 4.31 C ATOM 198 O GLU A 13 -28.860 -31.876 -22.327 1.00 75.42 O ATOM 199 CB GLU A 13 -27.646 -31.391 -24.898 1.00 73.01 C ATOM 200 CG GLU A 13 -29.154 -31.168 -25.056 1.00 3.41 C ATOM 201 CD GLU A 13 -29.889 -32.361 -25.641 1.00 32.20 C ATOM 202 OE1 GLU A 13 -30.498 -33.132 -24.866 1.00 74.13 O ATOM 203 OE2 GLU A 13 -29.858 -32.538 -26.877 1.00 51.23 O1- ATOM 0 H GLU A 13 -28.702 -34.014 -24.346 1.00 14.14 H new ATOM 0 HA GLU A 13 -26.147 -32.586 -23.944 1.00 12.15 H new ATOM 0 HB2 GLU A 13 -27.200 -30.475 -24.511 1.00 73.01 H new ATOM 0 HB3 GLU A 13 -27.217 -31.562 -25.885 1.00 73.01 H new ATOM 0 HG2 GLU A 13 -29.581 -30.931 -24.082 1.00 3.41 H new ATOM 0 HG3 GLU A 13 -29.319 -30.301 -25.696 1.00 3.41 H new ATOM 210 N ALA A 14 -26.951 -32.782 -21.571 1.00 44.53 N ATOM 211 CA ALA A 14 -27.312 -32.619 -20.168 1.00 21.22 C ATOM 212 C ALA A 14 -27.099 -31.173 -19.735 1.00 50.53 C ATOM 213 O ALA A 14 -28.015 -30.351 -19.830 1.00 52.13 O ATOM 214 CB ALA A 14 -26.517 -33.584 -19.289 1.00 0.11 C ATOM 0 H ALA A 14 -26.053 -33.240 -21.726 1.00 44.53 H new ATOM 0 HA ALA A 14 -28.369 -32.858 -20.048 1.00 21.22 H new ATOM 0 HB1 ALA A 14 -26.802 -33.445 -18.246 1.00 0.11 H new ATOM 0 HB2 ALA A 14 -26.730 -34.610 -19.590 1.00 0.11 H new ATOM 0 HB3 ALA A 14 -25.451 -33.386 -19.403 1.00 0.11 H new ATOM 220 N GLN A 15 -25.881 -30.864 -19.293 1.00 4.44 N ATOM 221 CA GLN A 15 -25.508 -29.519 -18.869 1.00 35.21 C ATOM 222 C GLN A 15 -24.101 -29.544 -18.289 1.00 15.42 C ATOM 223 O GLN A 15 -23.613 -30.601 -17.886 1.00 13.51 O ATOM 224 CB GLN A 15 -26.489 -28.965 -17.817 1.00 23.33 C ATOM 225 CG GLN A 15 -26.493 -29.741 -16.503 1.00 20.14 C ATOM 226 CD GLN A 15 -27.484 -29.185 -15.495 1.00 2.31 C ATOM 227 OE1 GLN A 15 -28.635 -29.621 -15.426 1.00 15.13 O ATOM 228 NE2 GLN A 15 -27.048 -28.213 -14.711 1.00 70.34 N ATOM 0 H GLN A 15 -25.124 -31.543 -19.219 1.00 4.44 H new ATOM 0 HA GLN A 15 -25.544 -28.866 -19.741 1.00 35.21 H new ATOM 0 HB2 GLN A 15 -26.237 -27.925 -17.612 1.00 23.33 H new ATOM 0 HB3 GLN A 15 -27.496 -28.972 -18.235 1.00 23.33 H new ATOM 0 HG2 GLN A 15 -26.733 -30.785 -16.704 1.00 20.14 H new ATOM 0 HG3 GLN A 15 -25.492 -29.721 -16.071 1.00 20.14 H new ATOM 0 HE21 GLN A 15 -26.088 -27.879 -14.798 1.00 70.34 H new ATOM 0 HE22 GLN A 15 -27.672 -27.797 -14.019 1.00 70.34 H new ATOM 237 N THR A 16 -23.453 -28.392 -18.261 1.00 54.35 N ATOM 238 CA THR A 16 -22.160 -28.249 -17.609 1.00 70.15 C ATOM 239 C THR A 16 -21.907 -26.783 -17.277 1.00 32.44 C ATOM 240 O THR A 16 -22.570 -25.891 -17.814 1.00 63.23 O ATOM 241 CB THR A 16 -20.999 -28.801 -18.478 1.00 55.41 C ATOM 242 OG1 THR A 16 -19.762 -28.720 -17.749 1.00 33.34 O ATOM 243 CG2 THR A 16 -20.868 -28.034 -19.791 1.00 42.31 C ATOM 0 H THR A 16 -23.804 -27.534 -18.686 1.00 54.35 H new ATOM 0 HA THR A 16 -22.190 -28.838 -16.692 1.00 70.15 H new ATOM 0 HB THR A 16 -21.224 -29.841 -18.713 1.00 55.41 H new ATOM 0 HG1 THR A 16 -19.206 -29.499 -17.960 1.00 33.34 H new ATOM 0 HG21 THR A 16 -20.045 -28.448 -20.374 1.00 42.31 H new ATOM 0 HG22 THR A 16 -21.795 -28.122 -20.358 1.00 42.31 H new ATOM 0 HG23 THR A 16 -20.671 -26.983 -19.580 1.00 42.31 H new ATOM 251 N GLN A 17 -20.959 -26.544 -16.384 1.00 5.12 N ATOM 252 CA GLN A 17 -20.619 -25.193 -15.953 1.00 31.24 C ATOM 253 C GLN A 17 -19.129 -25.133 -15.608 1.00 21.02 C ATOM 254 O GLN A 17 -18.682 -24.268 -14.857 1.00 15.31 O ATOM 255 CB GLN A 17 -21.487 -24.791 -14.745 1.00 44.40 C ATOM 256 CG GLN A 17 -21.426 -23.303 -14.395 1.00 20.35 C ATOM 257 CD GLN A 17 -21.918 -22.402 -15.521 1.00 71.40 C ATOM 258 OE1 GLN A 17 -22.787 -22.782 -16.309 1.00 24.53 O ATOM 259 NE2 GLN A 17 -21.367 -21.200 -15.606 1.00 70.42 N ATOM 0 H GLN A 17 -20.405 -27.275 -15.938 1.00 5.12 H new ATOM 0 HA GLN A 17 -20.819 -24.486 -16.758 1.00 31.24 H new ATOM 0 HB2 GLN A 17 -22.523 -25.062 -14.950 1.00 44.40 H new ATOM 0 HB3 GLN A 17 -21.172 -25.370 -13.877 1.00 44.40 H new ATOM 0 HG2 GLN A 17 -22.026 -23.121 -13.504 1.00 20.35 H new ATOM 0 HG3 GLN A 17 -20.399 -23.036 -14.147 1.00 20.35 H new ATOM 0 HE21 GLN A 17 -20.651 -20.919 -14.937 1.00 70.42 H new ATOM 0 HE22 GLN A 17 -21.659 -20.556 -16.341 1.00 70.42 H new ATOM 268 N GLY A 18 -18.366 -26.059 -16.189 1.00 22.20 N ATOM 269 CA GLY A 18 -16.941 -26.145 -15.917 1.00 74.21 C ATOM 270 C GLY A 18 -16.102 -25.659 -17.087 1.00 24.32 C ATOM 271 O GLY A 18 -15.862 -26.416 -18.027 1.00 62.33 O ATOM 0 H GLY A 18 -18.714 -26.755 -16.848 1.00 22.20 H new ATOM 0 HA2 GLY A 18 -16.705 -25.553 -15.033 1.00 74.21 H new ATOM 0 HA3 GLY A 18 -16.678 -27.178 -15.688 1.00 74.21 H new ATOM 275 N PRO A 19 -15.643 -24.392 -17.059 1.00 54.21 N ATOM 276 CA PRO A 19 -14.817 -23.815 -18.120 1.00 75.33 C ATOM 277 C PRO A 19 -13.325 -24.030 -17.863 1.00 4.25 C ATOM 278 O PRO A 19 -12.495 -23.163 -18.155 1.00 21.34 O ATOM 279 CB PRO A 19 -15.184 -22.334 -18.029 1.00 30.43 C ATOM 280 CG PRO A 19 -15.405 -22.097 -16.570 1.00 41.32 C ATOM 281 CD PRO A 19 -15.897 -23.406 -15.987 1.00 21.44 C ATOM 0 HA PRO A 19 -14.993 -24.261 -19.099 1.00 75.33 H new ATOM 0 HB2 PRO A 19 -14.386 -21.702 -18.418 1.00 30.43 H new ATOM 0 HB3 PRO A 19 -16.080 -22.110 -18.609 1.00 30.43 H new ATOM 0 HG2 PRO A 19 -14.482 -21.780 -16.085 1.00 41.32 H new ATOM 0 HG3 PRO A 19 -16.136 -21.304 -16.413 1.00 41.32 H new ATOM 0 HD2 PRO A 19 -15.361 -23.663 -15.073 1.00 21.44 H new ATOM 0 HD3 PRO A 19 -16.956 -23.357 -15.732 1.00 21.44 H new ATOM 289 N GLY A 20 -12.995 -25.196 -17.326 1.00 0.13 N ATOM 290 CA GLY A 20 -11.621 -25.504 -16.967 1.00 11.40 C ATOM 291 C GLY A 20 -11.442 -25.646 -15.467 1.00 30.41 C ATOM 292 O GLY A 20 -12.319 -25.240 -14.700 1.00 31.00 O ATOM 0 H GLY A 20 -13.661 -25.943 -17.130 1.00 0.13 H new ATOM 0 HA2 GLY A 20 -11.317 -26.429 -17.457 1.00 11.40 H new ATOM 0 HA3 GLY A 20 -10.965 -24.716 -17.337 1.00 11.40 H new ATOM 296 N SER A 21 -10.314 -26.234 -15.067 1.00 65.42 N ATOM 297 CA SER A 21 -9.985 -26.471 -13.657 1.00 70.35 C ATOM 298 C SER A 21 -8.761 -27.381 -13.564 1.00 61.03 C ATOM 299 O SER A 21 -8.403 -28.030 -14.550 1.00 35.42 O ATOM 300 CB SER A 21 -11.173 -27.123 -12.922 1.00 2.21 C ATOM 301 OG SER A 21 -11.649 -28.269 -13.620 1.00 14.23 O ATOM 0 H SER A 21 -9.597 -26.562 -15.714 1.00 65.42 H new ATOM 0 HA SER A 21 -9.768 -25.513 -13.184 1.00 70.35 H new ATOM 0 HB2 SER A 21 -10.868 -27.409 -11.915 1.00 2.21 H new ATOM 0 HB3 SER A 21 -11.980 -26.398 -12.817 1.00 2.21 H new ATOM 0 HG SER A 21 -10.916 -28.909 -13.737 1.00 14.23 H new ATOM 307 N MET A 22 -8.124 -27.437 -12.388 1.00 71.32 N ATOM 308 CA MET A 22 -7.063 -28.424 -12.141 1.00 14.44 C ATOM 309 C MET A 22 -7.612 -29.824 -12.368 1.00 34.21 C ATOM 310 O MET A 22 -6.876 -30.753 -12.705 1.00 25.22 O ATOM 311 CB MET A 22 -6.495 -28.298 -10.718 1.00 32.01 C ATOM 312 CG MET A 22 -5.367 -27.284 -10.593 1.00 64.35 C ATOM 313 SD MET A 22 -3.896 -27.773 -11.526 1.00 62.34 S ATOM 314 CE MET A 22 -3.419 -29.301 -10.701 1.00 41.55 C ATOM 0 H MET A 22 -8.321 -26.819 -11.601 1.00 71.32 H new ATOM 0 HA MET A 22 -6.247 -28.233 -12.837 1.00 14.44 H new ATOM 0 HB2 MET A 22 -7.300 -28.017 -10.039 1.00 32.01 H new ATOM 0 HB3 MET A 22 -6.131 -29.273 -10.395 1.00 32.01 H new ATOM 0 HG2 MET A 22 -5.713 -26.313 -10.948 1.00 64.35 H new ATOM 0 HG3 MET A 22 -5.104 -27.164 -9.542 1.00 64.35 H new ATOM 0 HE1 MET A 22 -2.349 -29.463 -10.827 1.00 41.55 H new ATOM 0 HE2 MET A 22 -3.653 -29.229 -9.639 1.00 41.55 H new ATOM 0 HE3 MET A 22 -3.966 -30.136 -11.138 1.00 41.55 H new ATOM 324 N ILE A 23 -8.919 -29.960 -12.162 1.00 11.52 N ATOM 325 CA ILE A 23 -9.633 -31.163 -12.545 1.00 62.20 C ATOM 326 C ILE A 23 -9.729 -31.176 -14.069 1.00 11.52 C ATOM 327 O ILE A 23 -10.661 -30.607 -14.651 1.00 51.53 O ATOM 328 CB ILE A 23 -11.056 -31.210 -11.925 1.00 4.53 C ATOM 329 CG1 ILE A 23 -11.026 -30.740 -10.459 1.00 14.53 C ATOM 330 CG2 ILE A 23 -11.638 -32.620 -12.023 1.00 3.25 C ATOM 331 CD1 ILE A 23 -10.110 -31.551 -9.564 1.00 12.43 C ATOM 0 H ILE A 23 -9.503 -29.245 -11.729 1.00 11.52 H new ATOM 0 HA ILE A 23 -9.095 -32.036 -12.175 1.00 62.20 H new ATOM 0 HB ILE A 23 -11.697 -30.532 -12.489 1.00 4.53 H new ATOM 0 HG12 ILE A 23 -10.712 -29.696 -10.430 1.00 14.53 H new ATOM 0 HG13 ILE A 23 -12.038 -30.780 -10.056 1.00 14.53 H new ATOM 0 HG21 ILE A 23 -12.635 -32.633 -11.583 1.00 3.25 H new ATOM 0 HG22 ILE A 23 -11.699 -32.917 -13.070 1.00 3.25 H new ATOM 0 HG23 ILE A 23 -10.995 -33.317 -11.485 1.00 3.25 H new ATOM 0 HD11 ILE A 23 -10.148 -31.154 -8.550 1.00 12.43 H new ATOM 0 HD12 ILE A 23 -10.434 -32.592 -9.559 1.00 12.43 H new ATOM 0 HD13 ILE A 23 -9.088 -31.491 -9.939 1.00 12.43 H new ATOM 343 N GLU A 24 -8.724 -31.767 -14.698 1.00 63.12 N ATOM 344 CA GLU A 24 -8.545 -31.684 -16.144 1.00 10.03 C ATOM 345 C GLU A 24 -9.706 -32.344 -16.890 1.00 51.50 C ATOM 346 O GLU A 24 -9.892 -33.561 -16.836 1.00 10.23 O ATOM 347 CB GLU A 24 -7.204 -32.320 -16.533 1.00 41.42 C ATOM 348 CG GLU A 24 -6.767 -32.046 -17.969 1.00 40.21 C ATOM 349 CD GLU A 24 -5.325 -32.462 -18.215 1.00 32.25 C ATOM 350 OE1 GLU A 24 -4.412 -31.676 -17.884 1.00 35.10 O ATOM 351 OE2 GLU A 24 -5.091 -33.583 -18.698 1.00 70.14 O1- ATOM 0 H GLU A 24 -8.009 -32.318 -14.223 1.00 63.12 H new ATOM 0 HA GLU A 24 -8.536 -30.633 -16.434 1.00 10.03 H new ATOM 0 HB2 GLU A 24 -6.433 -31.954 -15.856 1.00 41.42 H new ATOM 0 HB3 GLU A 24 -7.271 -33.398 -16.386 1.00 41.42 H new ATOM 0 HG2 GLU A 24 -7.421 -32.583 -18.656 1.00 40.21 H new ATOM 0 HG3 GLU A 24 -6.880 -30.984 -18.186 1.00 40.21 H new ATOM 358 N GLN A 25 -10.492 -31.521 -17.577 1.00 3.42 N ATOM 359 CA GLN A 25 -11.622 -32.006 -18.358 1.00 70.21 C ATOM 360 C GLN A 25 -11.129 -32.605 -19.672 1.00 62.55 C ATOM 361 O GLN A 25 -10.535 -31.914 -20.502 1.00 71.41 O ATOM 362 CB GLN A 25 -12.636 -30.873 -18.595 1.00 35.52 C ATOM 363 CG GLN A 25 -12.042 -29.596 -19.190 1.00 35.52 C ATOM 364 CD GLN A 25 -12.924 -28.380 -18.944 1.00 34.41 C ATOM 365 OE1 GLN A 25 -13.607 -28.292 -17.921 1.00 41.35 O ATOM 366 NE2 GLN A 25 -12.916 -27.439 -19.875 1.00 13.53 N ATOM 0 H GLN A 25 -10.365 -30.509 -17.608 1.00 3.42 H new ATOM 0 HA GLN A 25 -12.133 -32.792 -17.802 1.00 70.21 H new ATOM 0 HB2 GLN A 25 -13.418 -31.238 -19.261 1.00 35.52 H new ATOM 0 HB3 GLN A 25 -13.114 -30.627 -17.646 1.00 35.52 H new ATOM 0 HG2 GLN A 25 -11.057 -29.421 -18.758 1.00 35.52 H new ATOM 0 HG3 GLN A 25 -11.901 -29.729 -20.263 1.00 35.52 H new ATOM 0 HE21 GLN A 25 -12.337 -27.550 -20.707 1.00 13.53 H new ATOM 0 HE22 GLN A 25 -13.489 -26.603 -19.760 1.00 13.53 H new ATOM 375 N ILE A 26 -11.369 -33.899 -19.844 1.00 73.45 N ATOM 376 CA ILE A 26 -10.824 -34.642 -20.973 1.00 30.23 C ATOM 377 C ILE A 26 -11.923 -35.043 -21.954 1.00 44.22 C ATOM 378 O ILE A 26 -13.109 -35.076 -21.603 1.00 73.54 O ATOM 379 CB ILE A 26 -10.070 -35.909 -20.493 1.00 32.02 C ATOM 380 CG1 ILE A 26 -11.013 -36.842 -19.709 1.00 24.53 C ATOM 381 CG2 ILE A 26 -8.862 -35.519 -19.641 1.00 54.44 C ATOM 382 CD1 ILE A 26 -10.341 -38.100 -19.194 1.00 35.42 C ATOM 0 H ILE A 26 -11.941 -34.458 -19.212 1.00 73.45 H new ATOM 0 HA ILE A 26 -10.122 -33.983 -21.484 1.00 30.23 H new ATOM 0 HB ILE A 26 -9.713 -36.450 -21.369 1.00 32.02 H new ATOM 0 HG12 ILE A 26 -11.432 -36.294 -18.865 1.00 24.53 H new ATOM 0 HG13 ILE A 26 -11.847 -37.124 -20.352 1.00 24.53 H new ATOM 0 HG21 ILE A 26 -8.343 -36.419 -19.312 1.00 54.44 H new ATOM 0 HG22 ILE A 26 -8.183 -34.905 -20.232 1.00 54.44 H new ATOM 0 HG23 ILE A 26 -9.197 -34.955 -18.771 1.00 54.44 H new ATOM 0 HD11 ILE A 26 -11.068 -38.706 -18.653 1.00 35.42 H new ATOM 0 HD12 ILE A 26 -9.946 -38.671 -20.034 1.00 35.42 H new ATOM 0 HD13 ILE A 26 -9.525 -37.829 -18.524 1.00 35.42 H new ATOM 394 N GLY A 27 -11.518 -35.328 -23.188 1.00 62.23 N ATOM 395 CA GLY A 27 -12.453 -35.731 -24.219 1.00 35.05 C ATOM 396 C GLY A 27 -12.555 -37.237 -24.370 1.00 75.43 C ATOM 397 O GLY A 27 -11.899 -37.994 -23.647 1.00 55.43 O ATOM 0 H GLY A 27 -10.546 -35.286 -23.493 1.00 62.23 H new ATOM 0 HA2 GLY A 27 -13.438 -35.327 -23.986 1.00 35.05 H new ATOM 0 HA3 GLY A 27 -12.146 -35.296 -25.170 1.00 35.05 H new ATOM 401 N ASP A 28 -13.367 -37.652 -25.338 1.00 55.22 N ATOM 402 CA ASP A 28 -13.645 -39.064 -25.618 1.00 30.13 C ATOM 403 C ASP A 28 -12.358 -39.884 -25.760 1.00 31.43 C ATOM 404 O ASP A 28 -12.137 -40.848 -25.027 1.00 52.43 O ATOM 405 CB ASP A 28 -14.499 -39.160 -26.899 1.00 2.44 C ATOM 406 CG ASP A 28 -14.364 -40.487 -27.635 1.00 31.34 C ATOM 407 OD1 ASP A 28 -13.616 -40.538 -28.639 1.00 33.35 O ATOM 408 OD2 ASP A 28 -15.012 -41.475 -27.237 1.00 65.03 O1- ATOM 0 H ASP A 28 -13.859 -37.011 -25.961 1.00 55.22 H new ATOM 0 HA ASP A 28 -14.193 -39.485 -24.775 1.00 30.13 H new ATOM 0 HB2 ASP A 28 -15.546 -39.006 -26.638 1.00 2.44 H new ATOM 0 HB3 ASP A 28 -14.216 -38.352 -27.573 1.00 2.44 H new ATOM 413 N SER A 29 -11.501 -39.472 -26.682 1.00 43.14 N ATOM 414 CA SER A 29 -10.275 -40.207 -26.984 1.00 21.41 C ATOM 415 C SER A 29 -9.245 -40.037 -25.864 1.00 74.42 C ATOM 416 O SER A 29 -8.316 -40.840 -25.728 1.00 31.25 O ATOM 417 CB SER A 29 -9.702 -39.722 -28.324 1.00 13.32 C ATOM 418 OG SER A 29 -8.600 -40.512 -28.742 1.00 44.32 O ATOM 0 H SER A 29 -11.631 -38.627 -27.239 1.00 43.14 H new ATOM 0 HA SER A 29 -10.511 -41.269 -27.059 1.00 21.41 H new ATOM 0 HB2 SER A 29 -10.481 -39.753 -29.085 1.00 13.32 H new ATOM 0 HB3 SER A 29 -9.389 -38.682 -28.231 1.00 13.32 H new ATOM 0 HG SER A 29 -8.262 -40.176 -29.598 1.00 44.32 H new ATOM 424 N GLU A 30 -9.433 -39.007 -25.041 1.00 44.24 N ATOM 425 CA GLU A 30 -8.463 -38.666 -24.010 1.00 41.13 C ATOM 426 C GLU A 30 -8.658 -39.488 -22.746 1.00 44.35 C ATOM 427 O GLU A 30 -7.792 -39.490 -21.878 1.00 55.03 O ATOM 428 CB GLU A 30 -8.524 -37.172 -23.683 1.00 34.32 C ATOM 429 CG GLU A 30 -8.089 -36.285 -24.840 1.00 30.32 C ATOM 430 CD GLU A 30 -6.769 -36.730 -25.448 1.00 70.04 C ATOM 431 OE1 GLU A 30 -6.709 -36.928 -26.681 1.00 75.54 O ATOM 432 OE2 GLU A 30 -5.788 -36.906 -24.696 1.00 72.31 O1- ATOM 0 H GLU A 30 -10.249 -38.396 -25.071 1.00 44.24 H new ATOM 0 HA GLU A 30 -7.477 -38.904 -24.408 1.00 41.13 H new ATOM 0 HB2 GLU A 30 -9.543 -36.911 -23.397 1.00 34.32 H new ATOM 0 HB3 GLU A 30 -7.889 -36.970 -22.820 1.00 34.32 H new ATOM 0 HG2 GLU A 30 -8.861 -36.292 -25.610 1.00 30.32 H new ATOM 0 HG3 GLU A 30 -7.996 -35.257 -24.491 1.00 30.32 H new ATOM 439 N PHE A 31 -9.785 -40.188 -22.638 1.00 52.35 N ATOM 440 CA PHE A 31 -10.022 -41.037 -21.476 1.00 4.33 C ATOM 441 C PHE A 31 -8.905 -42.073 -21.359 1.00 54.44 C ATOM 442 O PHE A 31 -8.142 -42.073 -20.391 1.00 42.52 O ATOM 443 CB PHE A 31 -11.389 -41.729 -21.571 1.00 52.22 C ATOM 444 CG PHE A 31 -11.702 -42.604 -20.378 1.00 11.55 C ATOM 445 CD1 PHE A 31 -11.666 -43.990 -20.481 1.00 31.15 C ATOM 446 CD2 PHE A 31 -12.026 -42.037 -19.150 1.00 33.32 C ATOM 447 CE1 PHE A 31 -11.945 -44.788 -19.388 1.00 3.32 C ATOM 448 CE2 PHE A 31 -12.307 -42.834 -18.056 1.00 65.25 C ATOM 449 CZ PHE A 31 -12.267 -44.209 -18.176 1.00 11.43 C ATOM 0 H PHE A 31 -10.536 -40.185 -23.328 1.00 52.35 H new ATOM 0 HA PHE A 31 -10.025 -40.412 -20.583 1.00 4.33 H new ATOM 0 HB2 PHE A 31 -12.166 -40.971 -21.670 1.00 52.22 H new ATOM 0 HB3 PHE A 31 -11.419 -42.336 -22.476 1.00 52.22 H new ATOM 0 HD1 PHE A 31 -11.417 -44.448 -21.427 1.00 31.15 H new ATOM 0 HD2 PHE A 31 -12.058 -40.962 -19.050 1.00 33.32 H new ATOM 0 HE1 PHE A 31 -11.911 -45.863 -19.481 1.00 3.32 H new ATOM 0 HE2 PHE A 31 -12.558 -42.381 -17.108 1.00 65.25 H new ATOM 0 HZ PHE A 31 -12.488 -44.832 -17.322 1.00 11.43 H new ATOM 459 N ASP A 32 -8.789 -42.914 -22.383 1.00 24.45 N ATOM 460 CA ASP A 32 -7.761 -43.956 -22.432 1.00 14.44 C ATOM 461 C ASP A 32 -6.370 -43.353 -22.245 1.00 54.45 C ATOM 462 O ASP A 32 -5.606 -43.774 -21.373 1.00 73.42 O ATOM 463 CB ASP A 32 -7.833 -44.697 -23.776 1.00 2.53 C ATOM 464 CG ASP A 32 -6.673 -45.663 -23.990 1.00 22.33 C ATOM 465 OD1 ASP A 32 -5.671 -45.267 -24.630 1.00 54.10 O ATOM 466 OD2 ASP A 32 -6.762 -46.821 -23.529 1.00 35.01 O1- ATOM 0 H ASP A 32 -9.400 -42.895 -23.199 1.00 24.45 H new ATOM 0 HA ASP A 32 -7.944 -44.660 -21.620 1.00 14.44 H new ATOM 0 HB2 ASP A 32 -8.772 -45.248 -23.830 1.00 2.53 H new ATOM 0 HB3 ASP A 32 -7.845 -43.968 -24.586 1.00 2.53 H new ATOM 471 N ASN A 33 -6.066 -42.350 -23.058 1.00 43.22 N ATOM 472 CA ASN A 33 -4.754 -41.703 -23.058 1.00 4.32 C ATOM 473 C ASN A 33 -4.384 -41.171 -21.669 1.00 12.24 C ATOM 474 O ASN A 33 -3.364 -41.555 -21.086 1.00 43.20 O ATOM 475 CB ASN A 33 -4.745 -40.566 -24.072 1.00 4.00 C ATOM 476 CG ASN A 33 -3.383 -39.914 -24.197 1.00 1.45 C ATOM 477 OD1 ASN A 33 -2.345 -40.544 -23.982 1.00 34.52 O ATOM 478 ND2 ASN A 33 -3.385 -38.652 -24.559 1.00 23.04 N ATOM 0 H ASN A 33 -6.719 -41.960 -23.737 1.00 43.22 H new ATOM 0 HA ASN A 33 -4.009 -42.450 -23.334 1.00 4.32 H new ATOM 0 HB2 ASN A 33 -5.052 -40.948 -25.045 1.00 4.00 H new ATOM 0 HB3 ASN A 33 -5.479 -39.815 -23.778 1.00 4.00 H new ATOM 0 HD21 ASN A 33 -2.503 -38.153 -24.673 1.00 23.04 H new ATOM 0 HD22 ASN A 33 -4.269 -38.171 -24.726 1.00 23.04 H new ATOM 485 N LYS A 34 -5.236 -40.308 -21.130 1.00 32.10 N ATOM 486 CA LYS A 34 -4.960 -39.639 -19.865 1.00 63.34 C ATOM 487 C LYS A 34 -4.912 -40.633 -18.702 1.00 13.43 C ATOM 488 O LYS A 34 -4.129 -40.454 -17.768 1.00 20.22 O ATOM 489 CB LYS A 34 -6.004 -38.545 -19.605 1.00 42.13 C ATOM 490 CG LYS A 34 -5.923 -37.364 -20.576 1.00 54.23 C ATOM 491 CD LYS A 34 -4.604 -36.602 -20.443 1.00 2.25 C ATOM 492 CE LYS A 34 -4.581 -35.348 -21.313 1.00 10.31 C ATOM 493 NZ LYS A 34 -4.629 -35.664 -22.766 1.00 61.25 N1+ ATOM 0 H LYS A 34 -6.129 -40.054 -21.552 1.00 32.10 H new ATOM 0 HA LYS A 34 -3.976 -39.175 -19.937 1.00 63.34 H new ATOM 0 HB2 LYS A 34 -6.999 -38.985 -19.666 1.00 42.13 H new ATOM 0 HB3 LYS A 34 -5.881 -38.175 -18.587 1.00 42.13 H new ATOM 0 HG2 LYS A 34 -6.030 -37.727 -21.598 1.00 54.23 H new ATOM 0 HG3 LYS A 34 -6.755 -36.684 -20.390 1.00 54.23 H new ATOM 0 HD2 LYS A 34 -4.449 -36.324 -19.401 1.00 2.25 H new ATOM 0 HD3 LYS A 34 -3.778 -37.255 -20.725 1.00 2.25 H new ATOM 0 HE2 LYS A 34 -5.429 -34.714 -21.054 1.00 10.31 H new ATOM 0 HE3 LYS A 34 -3.678 -34.777 -21.098 1.00 10.31 H new ATOM 0 HZ1 LYS A 34 -4.697 -34.781 -23.311 1.00 61.25 H new ATOM 0 HZ2 LYS A 34 -3.765 -36.174 -23.039 1.00 61.25 H new ATOM 0 HZ3 LYS A 34 -5.459 -36.258 -22.965 1.00 61.25 H new ATOM 507 N VAL A 35 -5.735 -41.682 -18.764 1.00 1.14 N ATOM 508 CA VAL A 35 -5.730 -42.718 -17.730 1.00 22.00 C ATOM 509 C VAL A 35 -4.450 -43.557 -17.801 1.00 74.14 C ATOM 510 O VAL A 35 -3.909 -43.965 -16.771 1.00 12.35 O ATOM 511 CB VAL A 35 -6.975 -43.643 -17.831 1.00 71.34 C ATOM 512 CG1 VAL A 35 -6.856 -44.837 -16.881 1.00 55.41 C ATOM 513 CG2 VAL A 35 -8.253 -42.856 -17.538 1.00 4.12 C ATOM 0 H VAL A 35 -6.409 -41.836 -19.514 1.00 1.14 H new ATOM 0 HA VAL A 35 -5.766 -42.206 -16.768 1.00 22.00 H new ATOM 0 HB VAL A 35 -7.025 -44.026 -18.850 1.00 71.34 H new ATOM 0 HG11 VAL A 35 -7.741 -45.466 -16.974 1.00 55.41 H new ATOM 0 HG12 VAL A 35 -5.970 -45.418 -17.136 1.00 55.41 H new ATOM 0 HG13 VAL A 35 -6.772 -44.479 -15.855 1.00 55.41 H new ATOM 0 HG21 VAL A 35 -9.114 -43.520 -17.613 1.00 4.12 H new ATOM 0 HG22 VAL A 35 -8.202 -42.441 -16.532 1.00 4.12 H new ATOM 0 HG23 VAL A 35 -8.355 -42.046 -18.260 1.00 4.12 H new ATOM 523 N THR A 36 -3.959 -43.808 -19.011 1.00 14.23 N ATOM 524 CA THR A 36 -2.740 -44.595 -19.194 1.00 5.43 C ATOM 525 C THR A 36 -1.490 -43.712 -19.092 1.00 53.41 C ATOM 526 O THR A 36 -0.368 -44.218 -18.984 1.00 51.32 O ATOM 527 CB THR A 36 -2.745 -45.327 -20.554 1.00 11.34 C ATOM 528 OG1 THR A 36 -2.950 -44.383 -21.617 1.00 35.24 O ATOM 529 CG2 THR A 36 -3.831 -46.402 -20.595 1.00 31.14 C ATOM 0 H THR A 36 -4.384 -43.480 -19.878 1.00 14.23 H new ATOM 0 HA THR A 36 -2.715 -45.337 -18.396 1.00 5.43 H new ATOM 0 HB THR A 36 -1.778 -45.814 -20.683 1.00 11.34 H new ATOM 0 HG1 THR A 36 -3.896 -44.131 -21.653 1.00 35.24 H new ATOM 0 HG21 THR A 36 -3.812 -46.902 -21.564 1.00 31.14 H new ATOM 0 HG22 THR A 36 -3.650 -47.132 -19.806 1.00 31.14 H new ATOM 0 HG23 THR A 36 -4.806 -45.940 -20.444 1.00 31.14 H new ATOM 537 N SER A 37 -1.693 -42.396 -19.138 1.00 74.54 N ATOM 538 CA SER A 37 -0.601 -41.422 -19.037 1.00 42.32 C ATOM 539 C SER A 37 0.129 -41.495 -17.680 1.00 73.45 C ATOM 540 O SER A 37 1.178 -40.869 -17.498 1.00 65.42 O ATOM 541 CB SER A 37 -1.153 -40.002 -19.265 1.00 1.24 C ATOM 542 OG SER A 37 -0.122 -39.029 -19.270 1.00 11.40 O ATOM 0 H SER A 37 -2.615 -41.973 -19.246 1.00 74.54 H new ATOM 0 HA SER A 37 0.131 -41.666 -19.807 1.00 42.32 H new ATOM 0 HB2 SER A 37 -1.688 -39.969 -20.214 1.00 1.24 H new ATOM 0 HB3 SER A 37 -1.874 -39.763 -18.483 1.00 1.24 H new ATOM 0 HG SER A 37 0.640 -39.357 -18.747 1.00 11.40 H new ATOM 548 N CYS A 38 -0.420 -42.243 -16.724 1.00 31.04 N ATOM 549 CA CYS A 38 0.220 -42.390 -15.416 1.00 10.42 C ATOM 550 C CYS A 38 1.402 -43.359 -15.498 1.00 51.55 C ATOM 551 O CYS A 38 1.233 -44.538 -15.809 1.00 23.12 O ATOM 552 CB CYS A 38 -0.794 -42.859 -14.364 1.00 55.23 C ATOM 553 SG CYS A 38 -1.692 -44.365 -14.807 1.00 22.33 S ATOM 0 H CYS A 38 -1.298 -42.752 -16.828 1.00 31.04 H new ATOM 0 HA CYS A 38 0.599 -41.415 -15.111 1.00 10.42 H new ATOM 0 HB2 CYS A 38 -0.271 -43.027 -13.423 1.00 55.23 H new ATOM 0 HB3 CYS A 38 -1.514 -42.060 -14.190 1.00 55.23 H new ATOM 0 HG CYS A 38 -2.419 -44.142 -15.862 1.00 22.33 H new ATOM 559 N ASN A 39 2.600 -42.844 -15.227 1.00 72.42 N ATOM 560 CA ASN A 39 3.824 -43.646 -15.288 1.00 15.33 C ATOM 561 C ASN A 39 3.833 -44.729 -14.213 1.00 11.44 C ATOM 562 O ASN A 39 3.561 -45.894 -14.496 1.00 34.54 O ATOM 563 CB ASN A 39 5.070 -42.755 -15.149 1.00 42.12 C ATOM 564 CG ASN A 39 5.390 -41.989 -16.425 1.00 14.24 C ATOM 565 OD1 ASN A 39 6.139 -42.469 -17.276 1.00 23.53 O ATOM 566 ND2 ASN A 39 4.830 -40.797 -16.570 1.00 10.15 N ATOM 0 H ASN A 39 2.751 -41.871 -14.962 1.00 72.42 H new ATOM 0 HA ASN A 39 3.847 -44.132 -16.263 1.00 15.33 H new ATOM 0 HB2 ASN A 39 4.917 -42.047 -14.334 1.00 42.12 H new ATOM 0 HB3 ASN A 39 5.925 -43.373 -14.877 1.00 42.12 H new ATOM 0 HD21 ASN A 39 5.015 -40.245 -17.408 1.00 10.15 H new ATOM 0 HD22 ASN A 39 4.214 -40.431 -15.844 1.00 10.15 H new ATOM 573 N ASP A 40 4.134 -44.344 -12.977 1.00 2.41 N ATOM 574 CA ASP A 40 4.242 -45.308 -11.883 1.00 42.21 C ATOM 575 C ASP A 40 3.783 -44.689 -10.567 1.00 11.11 C ATOM 576 O ASP A 40 4.232 -43.603 -10.196 1.00 52.12 O ATOM 577 CB ASP A 40 5.690 -45.805 -11.750 1.00 54.20 C ATOM 578 CG ASP A 40 5.861 -46.839 -10.645 1.00 63.42 C ATOM 579 OD1 ASP A 40 6.265 -46.465 -9.524 1.00 24.22 O ATOM 580 OD2 ASP A 40 5.583 -48.033 -10.895 1.00 1.42 O1- ATOM 0 H ASP A 40 4.307 -43.376 -12.707 1.00 2.41 H new ATOM 0 HA ASP A 40 3.595 -46.154 -12.113 1.00 42.21 H new ATOM 0 HB2 ASP A 40 6.009 -46.237 -12.698 1.00 54.20 H new ATOM 0 HB3 ASP A 40 6.344 -44.956 -11.551 1.00 54.20 H new ATOM 585 N ASN A 41 2.861 -45.379 -9.891 1.00 20.22 N ATOM 586 CA ASN A 41 2.358 -44.968 -8.572 1.00 43.41 C ATOM 587 C ASN A 41 1.668 -43.595 -8.638 1.00 72.45 C ATOM 588 O ASN A 41 1.385 -42.975 -7.615 1.00 25.45 O ATOM 589 CB ASN A 41 3.505 -44.963 -7.539 1.00 53.22 C ATOM 590 CG ASN A 41 3.018 -44.857 -6.096 1.00 43.00 C ATOM 591 OD1 ASN A 41 2.668 -45.861 -5.475 1.00 12.13 O ATOM 592 ND2 ASN A 41 3.014 -43.651 -5.546 1.00 51.54 N ATOM 0 H ASN A 41 2.440 -46.240 -10.241 1.00 20.22 H new ATOM 0 HA ASN A 41 1.609 -45.693 -8.253 1.00 43.41 H new ATOM 0 HB2 ASN A 41 4.090 -45.876 -7.652 1.00 53.22 H new ATOM 0 HB3 ASN A 41 4.173 -44.128 -7.752 1.00 53.22 H new ATOM 0 HD21 ASN A 41 2.714 -43.533 -4.578 1.00 51.54 H new ATOM 0 HD22 ASN A 41 3.311 -42.841 -6.091 1.00 51.54 H new ATOM 599 N ILE A 42 1.374 -43.142 -9.857 1.00 4.44 N ATOM 600 CA ILE A 42 0.694 -41.867 -10.065 1.00 53.42 C ATOM 601 C ILE A 42 -0.810 -42.045 -9.877 1.00 61.41 C ATOM 602 O ILE A 42 -1.439 -42.845 -10.576 1.00 70.51 O ATOM 603 CB ILE A 42 0.974 -41.291 -11.479 1.00 60.24 C ATOM 604 CG1 ILE A 42 2.489 -41.138 -11.718 1.00 24.42 C ATOM 605 CG2 ILE A 42 0.258 -39.952 -11.672 1.00 31.35 C ATOM 606 CD1 ILE A 42 3.180 -40.200 -10.747 1.00 11.11 C ATOM 0 H ILE A 42 1.598 -43.643 -10.717 1.00 4.44 H new ATOM 0 HA ILE A 42 1.081 -41.162 -9.330 1.00 53.42 H new ATOM 0 HB ILE A 42 0.583 -41.995 -12.214 1.00 60.24 H new ATOM 0 HG12 ILE A 42 2.957 -42.120 -11.652 1.00 24.42 H new ATOM 0 HG13 ILE A 42 2.651 -40.775 -12.733 1.00 24.42 H new ATOM 0 HG21 ILE A 42 0.469 -39.567 -12.670 1.00 31.35 H new ATOM 0 HG22 ILE A 42 -0.817 -40.094 -11.557 1.00 31.35 H new ATOM 0 HG23 ILE A 42 0.611 -39.240 -10.926 1.00 31.35 H new ATOM 0 HD11 ILE A 42 4.243 -40.149 -10.984 1.00 11.11 H new ATOM 0 HD12 ILE A 42 2.742 -39.205 -10.828 1.00 11.11 H new ATOM 0 HD13 ILE A 42 3.053 -40.571 -9.730 1.00 11.11 H new ATOM 618 N LEU A 43 -1.372 -41.313 -8.924 1.00 61.41 N ATOM 619 CA LEU A 43 -2.792 -41.403 -8.611 1.00 72.33 C ATOM 620 C LEU A 43 -3.599 -40.561 -9.600 1.00 70.42 C ATOM 621 O LEU A 43 -3.356 -39.360 -9.753 1.00 24.44 O ATOM 622 CB LEU A 43 -3.053 -40.921 -7.170 1.00 53.01 C ATOM 623 CG LEU A 43 -4.171 -41.656 -6.398 1.00 15.11 C ATOM 624 CD1 LEU A 43 -4.486 -40.927 -5.096 1.00 20.34 C ATOM 625 CD2 LEU A 43 -5.436 -41.820 -7.239 1.00 60.11 C ATOM 0 H LEU A 43 -0.860 -40.644 -8.349 1.00 61.41 H new ATOM 0 HA LEU A 43 -3.104 -42.444 -8.693 1.00 72.33 H new ATOM 0 HB2 LEU A 43 -2.126 -41.015 -6.604 1.00 53.01 H new ATOM 0 HB3 LEU A 43 -3.300 -39.860 -7.203 1.00 53.01 H new ATOM 0 HG LEU A 43 -3.804 -42.656 -6.166 1.00 15.11 H new ATOM 0 HD11 LEU A 43 -5.276 -41.457 -4.564 1.00 20.34 H new ATOM 0 HD12 LEU A 43 -3.591 -40.889 -4.474 1.00 20.34 H new ATOM 0 HD13 LEU A 43 -4.816 -39.912 -5.318 1.00 20.34 H new ATOM 0 HD21 LEU A 43 -6.195 -42.342 -6.656 1.00 60.11 H new ATOM 0 HD22 LEU A 43 -5.811 -40.838 -7.527 1.00 60.11 H new ATOM 0 HD23 LEU A 43 -5.205 -42.397 -8.134 1.00 60.11 H new ATOM 637 N ILE A 44 -4.548 -41.199 -10.267 1.00 53.43 N ATOM 638 CA ILE A 44 -5.448 -40.523 -11.193 1.00 3.43 C ATOM 639 C ILE A 44 -6.874 -40.561 -10.658 1.00 52.32 C ATOM 640 O ILE A 44 -7.451 -41.632 -10.484 1.00 63.21 O ATOM 641 CB ILE A 44 -5.410 -41.172 -12.601 1.00 54.14 C ATOM 642 CG1 ILE A 44 -4.048 -40.919 -13.271 1.00 72.45 C ATOM 643 CG2 ILE A 44 -6.554 -40.654 -13.476 1.00 35.25 C ATOM 644 CD1 ILE A 44 -3.951 -41.460 -14.682 1.00 52.24 C ATOM 0 H ILE A 44 -4.717 -42.201 -10.183 1.00 53.43 H new ATOM 0 HA ILE A 44 -5.113 -39.490 -11.283 1.00 3.43 H new ATOM 0 HB ILE A 44 -5.542 -42.248 -12.485 1.00 54.14 H new ATOM 0 HG12 ILE A 44 -3.856 -39.846 -13.289 1.00 72.45 H new ATOM 0 HG13 ILE A 44 -3.265 -41.372 -12.663 1.00 72.45 H new ATOM 0 HG21 ILE A 44 -6.503 -41.125 -14.458 1.00 35.25 H new ATOM 0 HG22 ILE A 44 -7.508 -40.894 -13.007 1.00 35.25 H new ATOM 0 HG23 ILE A 44 -6.466 -39.573 -13.588 1.00 35.25 H new ATOM 0 HD11 ILE A 44 -2.963 -41.243 -15.088 1.00 52.24 H new ATOM 0 HD12 ILE A 44 -4.110 -42.538 -14.670 1.00 52.24 H new ATOM 0 HD13 ILE A 44 -4.710 -40.988 -15.306 1.00 52.24 H new ATOM 656 N LEU A 45 -7.435 -39.392 -10.389 1.00 65.44 N ATOM 657 CA LEU A 45 -8.809 -39.288 -9.910 1.00 1.02 C ATOM 658 C LEU A 45 -9.696 -38.786 -11.047 1.00 41.11 C ATOM 659 O LEU A 45 -9.400 -37.763 -11.657 1.00 73.21 O ATOM 660 CB LEU A 45 -8.919 -38.328 -8.709 1.00 45.12 C ATOM 661 CG LEU A 45 -8.028 -38.639 -7.485 1.00 11.25 C ATOM 662 CD1 LEU A 45 -6.551 -38.414 -7.794 1.00 71.43 C ATOM 663 CD2 LEU A 45 -8.451 -37.794 -6.286 1.00 43.24 C ATOM 0 H LEU A 45 -6.959 -38.496 -10.494 1.00 65.44 H new ATOM 0 HA LEU A 45 -9.134 -40.275 -9.581 1.00 1.02 H new ATOM 0 HB2 LEU A 45 -8.682 -37.322 -9.055 1.00 45.12 H new ATOM 0 HB3 LEU A 45 -9.958 -38.315 -8.379 1.00 45.12 H new ATOM 0 HG LEU A 45 -8.162 -39.693 -7.241 1.00 11.25 H new ATOM 0 HD11 LEU A 45 -5.955 -38.643 -6.910 1.00 71.43 H new ATOM 0 HD12 LEU A 45 -6.248 -39.065 -8.614 1.00 71.43 H new ATOM 0 HD13 LEU A 45 -6.393 -37.374 -8.079 1.00 71.43 H new ATOM 0 HD21 LEU A 45 -7.813 -38.027 -5.434 1.00 43.24 H new ATOM 0 HD22 LEU A 45 -8.355 -36.737 -6.534 1.00 43.24 H new ATOM 0 HD23 LEU A 45 -9.488 -38.014 -6.033 1.00 43.24 H new ATOM 675 N VAL A 46 -10.761 -39.515 -11.343 1.00 52.30 N ATOM 676 CA VAL A 46 -11.713 -39.123 -12.374 1.00 52.42 C ATOM 677 C VAL A 46 -12.989 -38.593 -11.722 1.00 21.23 C ATOM 678 O VAL A 46 -13.782 -39.360 -11.168 1.00 14.33 O ATOM 679 CB VAL A 46 -12.054 -40.309 -13.318 1.00 13.25 C ATOM 680 CG1 VAL A 46 -13.062 -39.887 -14.390 1.00 25.32 C ATOM 681 CG2 VAL A 46 -10.783 -40.865 -13.960 1.00 72.45 C ATOM 0 H VAL A 46 -10.991 -40.393 -10.877 1.00 52.30 H new ATOM 0 HA VAL A 46 -11.254 -38.339 -12.976 1.00 52.42 H new ATOM 0 HB VAL A 46 -12.512 -41.097 -12.720 1.00 13.25 H new ATOM 0 HG11 VAL A 46 -13.283 -40.736 -15.037 1.00 25.32 H new ATOM 0 HG12 VAL A 46 -13.981 -39.547 -13.912 1.00 25.32 H new ATOM 0 HG13 VAL A 46 -12.642 -39.077 -14.986 1.00 25.32 H new ATOM 0 HG21 VAL A 46 -11.041 -41.695 -14.618 1.00 72.45 H new ATOM 0 HG22 VAL A 46 -10.295 -40.081 -14.539 1.00 72.45 H new ATOM 0 HG23 VAL A 46 -10.106 -41.216 -13.181 1.00 72.45 H new ATOM 691 N ASP A 47 -13.149 -37.278 -11.761 1.00 11.12 N ATOM 692 CA ASP A 47 -14.306 -36.602 -11.177 1.00 51.13 C ATOM 693 C ASP A 47 -15.531 -36.670 -12.091 1.00 54.22 C ATOM 694 O ASP A 47 -15.412 -36.655 -13.323 1.00 62.13 O ATOM 695 CB ASP A 47 -13.957 -35.134 -10.886 1.00 0.54 C ATOM 696 CG ASP A 47 -15.187 -34.262 -10.645 1.00 13.50 C ATOM 697 OD1 ASP A 47 -15.904 -34.506 -9.649 1.00 30.41 O ATOM 698 OD2 ASP A 47 -15.433 -33.333 -11.454 1.00 0.25 O1- ATOM 0 H ASP A 47 -12.480 -36.645 -12.199 1.00 11.12 H new ATOM 0 HA ASP A 47 -14.556 -37.117 -10.249 1.00 51.13 H new ATOM 0 HB2 ASP A 47 -13.309 -35.088 -10.011 1.00 0.54 H new ATOM 0 HB3 ASP A 47 -13.390 -34.729 -11.724 1.00 0.54 H new ATOM 703 N PHE A 48 -16.700 -36.769 -11.470 1.00 33.43 N ATOM 704 CA PHE A 48 -17.971 -36.614 -12.162 1.00 51.34 C ATOM 705 C PHE A 48 -18.608 -35.293 -11.749 1.00 61.52 C ATOM 706 O PHE A 48 -19.213 -35.190 -10.675 1.00 13.11 O ATOM 707 CB PHE A 48 -18.915 -37.792 -11.869 1.00 65.22 C ATOM 708 CG PHE A 48 -18.705 -38.980 -12.777 1.00 13.55 C ATOM 709 CD1 PHE A 48 -17.732 -39.930 -12.501 1.00 62.52 C ATOM 710 CD2 PHE A 48 -19.487 -39.144 -13.913 1.00 12.32 C ATOM 711 CE1 PHE A 48 -17.544 -41.016 -13.339 1.00 14.23 C ATOM 712 CE2 PHE A 48 -19.302 -40.227 -14.752 1.00 3.03 C ATOM 713 CZ PHE A 48 -18.330 -41.165 -14.464 1.00 0.02 C ATOM 0 H PHE A 48 -16.792 -36.959 -10.472 1.00 33.43 H new ATOM 0 HA PHE A 48 -17.789 -36.608 -13.237 1.00 51.34 H new ATOM 0 HB2 PHE A 48 -18.777 -38.108 -10.835 1.00 65.22 H new ATOM 0 HB3 PHE A 48 -19.946 -37.452 -11.964 1.00 65.22 H new ATOM 0 HD1 PHE A 48 -17.114 -39.821 -11.622 1.00 62.52 H new ATOM 0 HD2 PHE A 48 -20.250 -38.415 -14.144 1.00 12.32 H new ATOM 0 HE1 PHE A 48 -16.782 -41.747 -13.112 1.00 14.23 H new ATOM 0 HE2 PHE A 48 -19.917 -40.340 -15.632 1.00 3.03 H new ATOM 0 HZ PHE A 48 -18.185 -42.013 -15.117 1.00 0.02 H new ATOM 723 N TRP A 49 -18.425 -34.291 -12.605 1.00 62.40 N ATOM 724 CA TRP A 49 -18.924 -32.932 -12.387 1.00 3.51 C ATOM 725 C TRP A 49 -20.354 -32.914 -11.841 1.00 41.31 C ATOM 726 O TRP A 49 -21.214 -33.690 -12.268 1.00 63.54 O ATOM 727 CB TRP A 49 -18.840 -32.137 -13.703 1.00 40.21 C ATOM 728 CG TRP A 49 -19.271 -32.924 -14.911 1.00 42.53 C ATOM 729 CD1 TRP A 49 -18.479 -33.711 -15.698 1.00 65.23 C ATOM 730 CD2 TRP A 49 -20.589 -33.004 -15.470 1.00 72.13 C ATOM 731 NE1 TRP A 49 -19.222 -34.279 -16.700 1.00 33.30 N ATOM 732 CE2 TRP A 49 -20.518 -33.862 -16.584 1.00 34.35 C ATOM 733 CE3 TRP A 49 -21.823 -32.439 -15.136 1.00 22.14 C ATOM 734 CZ2 TRP A 49 -21.629 -34.166 -17.365 1.00 54.21 C ATOM 735 CZ3 TRP A 49 -22.926 -32.742 -15.912 1.00 74.34 C ATOM 736 CH2 TRP A 49 -22.823 -33.600 -17.014 1.00 43.42 C ATOM 0 H TRP A 49 -17.918 -34.400 -13.484 1.00 62.40 H new ATOM 0 HA TRP A 49 -18.294 -32.464 -11.631 1.00 3.51 H new ATOM 0 HB2 TRP A 49 -19.462 -31.246 -13.620 1.00 40.21 H new ATOM 0 HB3 TRP A 49 -17.814 -31.798 -13.848 1.00 40.21 H new ATOM 0 HD1 TRP A 49 -17.420 -33.864 -15.552 1.00 65.23 H new ATOM 0 HE1 TRP A 49 -18.865 -34.911 -17.417 1.00 33.30 H new ATOM 0 HE3 TRP A 49 -21.913 -31.778 -14.287 1.00 22.14 H new ATOM 0 HZ2 TRP A 49 -21.551 -34.825 -18.217 1.00 54.21 H new ATOM 0 HZ3 TRP A 49 -23.884 -32.309 -15.664 1.00 74.34 H new ATOM 0 HH2 TRP A 49 -23.704 -33.819 -17.598 1.00 43.42 H new ATOM 747 N ALA A 50 -20.593 -32.016 -10.890 1.00 41.34 N ATOM 748 CA ALA A 50 -21.895 -31.884 -10.252 1.00 51.22 C ATOM 749 C ALA A 50 -22.756 -30.839 -10.968 1.00 20.23 C ATOM 750 O ALA A 50 -22.434 -29.651 -10.948 1.00 33.32 O ATOM 751 CB ALA A 50 -21.712 -31.506 -8.784 1.00 54.33 C ATOM 0 H ALA A 50 -19.891 -31.362 -10.542 1.00 41.34 H new ATOM 0 HA ALA A 50 -22.411 -32.842 -10.316 1.00 51.22 H new ATOM 0 HB1 ALA A 50 -22.688 -31.408 -8.309 1.00 54.33 H new ATOM 0 HB2 ALA A 50 -21.138 -32.282 -8.277 1.00 54.33 H new ATOM 0 HB3 ALA A 50 -21.179 -30.558 -8.716 1.00 54.33 H new ATOM 757 N PRO A 51 -23.857 -31.267 -11.625 1.00 55.40 N ATOM 758 CA PRO A 51 -24.810 -30.345 -12.258 1.00 12.22 C ATOM 759 C PRO A 51 -25.557 -29.515 -11.212 1.00 34.03 C ATOM 760 O PRO A 51 -25.797 -28.316 -11.394 1.00 2.20 O ATOM 761 CB PRO A 51 -25.784 -31.273 -13.010 1.00 62.34 C ATOM 762 CG PRO A 51 -25.113 -32.609 -13.045 1.00 64.33 C ATOM 763 CD PRO A 51 -24.255 -32.671 -11.814 1.00 24.12 C ATOM 0 HA PRO A 51 -24.317 -29.627 -12.913 1.00 12.22 H new ATOM 0 HB2 PRO A 51 -26.746 -31.330 -12.500 1.00 62.34 H new ATOM 0 HB3 PRO A 51 -25.979 -30.905 -14.017 1.00 62.34 H new ATOM 0 HG2 PRO A 51 -25.847 -33.415 -13.050 1.00 64.33 H new ATOM 0 HG3 PRO A 51 -24.511 -32.720 -13.947 1.00 64.33 H new ATOM 0 HD2 PRO A 51 -24.806 -33.055 -10.955 1.00 24.12 H new ATOM 0 HD3 PRO A 51 -23.391 -33.321 -11.955 1.00 24.12 H new ATOM 771 N TRP A 52 -25.919 -30.178 -10.118 1.00 52.31 N ATOM 772 CA TRP A 52 -26.589 -29.543 -8.989 1.00 61.04 C ATOM 773 C TRP A 52 -26.522 -30.467 -7.774 1.00 61.45 C ATOM 774 O TRP A 52 -26.670 -31.684 -7.908 1.00 73.15 O ATOM 775 CB TRP A 52 -28.053 -29.215 -9.337 1.00 34.34 C ATOM 776 CG TRP A 52 -28.822 -28.621 -8.193 1.00 2.33 C ATOM 777 CD1 TRP A 52 -29.803 -29.231 -7.465 1.00 55.55 C ATOM 778 CD2 TRP A 52 -28.663 -27.310 -7.636 1.00 2.31 C ATOM 779 NE1 TRP A 52 -30.270 -28.379 -6.498 1.00 21.24 N ATOM 780 CE2 TRP A 52 -29.586 -27.193 -6.580 1.00 34.23 C ATOM 781 CE3 TRP A 52 -27.833 -26.220 -7.928 1.00 4.45 C ATOM 782 CZ2 TRP A 52 -29.701 -26.036 -5.814 1.00 10.31 C ATOM 783 CZ3 TRP A 52 -27.950 -25.071 -7.166 1.00 4.30 C ATOM 784 CH2 TRP A 52 -28.878 -24.988 -6.121 1.00 60.21 C ATOM 0 H TRP A 52 -25.755 -31.176 -9.989 1.00 52.31 H new ATOM 0 HA TRP A 52 -26.082 -28.606 -8.757 1.00 61.04 H new ATOM 0 HB2 TRP A 52 -28.072 -28.520 -10.177 1.00 34.34 H new ATOM 0 HB3 TRP A 52 -28.553 -30.126 -9.666 1.00 34.34 H new ATOM 0 HD1 TRP A 52 -30.159 -30.238 -7.627 1.00 55.55 H new ATOM 0 HE1 TRP A 52 -31.007 -28.593 -5.826 1.00 21.24 H new ATOM 0 HE3 TRP A 52 -27.115 -26.275 -8.733 1.00 4.45 H new ATOM 0 HZ2 TRP A 52 -30.415 -25.969 -5.006 1.00 10.31 H new ATOM 0 HZ3 TRP A 52 -27.315 -24.224 -7.381 1.00 4.30 H new ATOM 0 HH2 TRP A 52 -28.945 -24.077 -5.545 1.00 60.21 H new ATOM 795 N CYS A 53 -26.292 -29.892 -6.600 1.00 50.22 N ATOM 796 CA CYS A 53 -26.144 -30.671 -5.372 1.00 20.35 C ATOM 797 C CYS A 53 -26.227 -29.759 -4.150 1.00 44.23 C ATOM 798 O CYS A 53 -27.189 -29.820 -3.382 1.00 40.01 O ATOM 799 CB CYS A 53 -24.807 -31.425 -5.395 1.00 43.12 C ATOM 800 SG CYS A 53 -23.388 -30.357 -5.802 1.00 63.30 S ATOM 0 H CYS A 53 -26.203 -28.884 -6.470 1.00 50.22 H new ATOM 0 HA CYS A 53 -26.956 -31.396 -5.310 1.00 20.35 H new ATOM 0 HB2 CYS A 53 -24.640 -31.885 -4.421 1.00 43.12 H new ATOM 0 HB3 CYS A 53 -24.866 -32.234 -6.124 1.00 43.12 H new ATOM 805 N GLY A 54 -25.220 -28.901 -3.983 1.00 43.40 N ATOM 806 CA GLY A 54 -25.210 -27.967 -2.871 1.00 13.40 C ATOM 807 C GLY A 54 -23.803 -27.614 -2.405 1.00 4.44 C ATOM 808 O GLY A 54 -23.161 -26.737 -2.984 1.00 31.03 O ATOM 0 H GLY A 54 -24.411 -28.838 -4.600 1.00 43.40 H new ATOM 0 HA2 GLY A 54 -25.729 -27.055 -3.165 1.00 13.40 H new ATOM 0 HA3 GLY A 54 -25.766 -28.396 -2.038 1.00 13.40 H new ATOM 812 N PRO A 55 -23.278 -28.314 -1.376 1.00 11.55 N ATOM 813 CA PRO A 55 -21.996 -27.961 -0.735 1.00 25.30 C ATOM 814 C PRO A 55 -20.782 -28.219 -1.630 1.00 32.04 C ATOM 815 O PRO A 55 -19.659 -27.836 -1.289 1.00 53.41 O ATOM 816 CB PRO A 55 -21.959 -28.871 0.503 1.00 54.22 C ATOM 817 CG PRO A 55 -22.790 -30.050 0.128 1.00 31.01 C ATOM 818 CD PRO A 55 -23.888 -29.513 -0.759 1.00 51.53 C ATOM 0 HA PRO A 55 -21.942 -26.896 -0.508 1.00 25.30 H new ATOM 0 HB2 PRO A 55 -20.939 -29.167 0.747 1.00 54.22 H new ATOM 0 HB3 PRO A 55 -22.363 -28.364 1.380 1.00 54.22 H new ATOM 0 HG2 PRO A 55 -22.194 -30.798 -0.396 1.00 31.01 H new ATOM 0 HG3 PRO A 55 -23.203 -30.534 1.013 1.00 31.01 H new ATOM 0 HD2 PRO A 55 -24.189 -30.242 -1.511 1.00 51.53 H new ATOM 0 HD3 PRO A 55 -24.780 -29.260 -0.185 1.00 51.53 H new ATOM 826 N CYS A 56 -21.015 -28.850 -2.777 1.00 70.12 N ATOM 827 CA CYS A 56 -19.941 -29.218 -3.702 1.00 20.13 C ATOM 828 C CYS A 56 -19.097 -28.005 -4.093 1.00 71.35 C ATOM 829 O CYS A 56 -17.896 -28.121 -4.307 1.00 52.03 O ATOM 830 CB CYS A 56 -20.533 -29.857 -4.961 1.00 24.21 C ATOM 831 SG CYS A 56 -21.887 -31.028 -4.617 1.00 62.21 S ATOM 0 H CYS A 56 -21.946 -29.120 -3.093 1.00 70.12 H new ATOM 0 HA CYS A 56 -19.294 -29.933 -3.193 1.00 20.13 H new ATOM 0 HB2 CYS A 56 -20.903 -29.070 -5.618 1.00 24.21 H new ATOM 0 HB3 CYS A 56 -19.742 -30.378 -5.501 1.00 24.21 H new ATOM 836 N ARG A 57 -19.728 -26.832 -4.118 1.00 42.14 N ATOM 837 CA ARG A 57 -19.091 -25.615 -4.623 1.00 30.24 C ATOM 838 C ARG A 57 -17.751 -25.349 -3.926 1.00 54.23 C ATOM 839 O ARG A 57 -16.848 -24.751 -4.507 1.00 53.21 O ATOM 840 CB ARG A 57 -20.035 -24.422 -4.431 1.00 42.45 C ATOM 841 CG ARG A 57 -19.569 -23.143 -5.119 1.00 14.45 C ATOM 842 CD ARG A 57 -20.526 -21.986 -4.857 1.00 71.53 C ATOM 843 NE ARG A 57 -20.135 -20.770 -5.574 1.00 20.02 N ATOM 844 CZ ARG A 57 -20.409 -19.532 -5.157 1.00 74.44 C ATOM 845 NH1 ARG A 57 -21.000 -19.332 -3.986 1.00 35.42 N1+ ATOM 846 NH2 ARG A 57 -20.070 -18.492 -5.905 1.00 33.01 N ATOM 0 H ARG A 57 -20.685 -26.698 -3.793 1.00 42.14 H new ATOM 0 HA ARG A 57 -18.888 -25.753 -5.685 1.00 30.24 H new ATOM 0 HB2 ARG A 57 -21.021 -24.688 -4.811 1.00 42.45 H new ATOM 0 HB3 ARG A 57 -20.146 -24.228 -3.364 1.00 42.45 H new ATOM 0 HG2 ARG A 57 -18.573 -22.880 -4.764 1.00 14.45 H new ATOM 0 HG3 ARG A 57 -19.489 -23.315 -6.192 1.00 14.45 H new ATOM 0 HD2 ARG A 57 -21.533 -22.275 -5.158 1.00 71.53 H new ATOM 0 HD3 ARG A 57 -20.560 -21.780 -3.787 1.00 71.53 H new ATOM 0 HE ARG A 57 -19.620 -20.876 -6.448 1.00 20.02 H new ATOM 0 HH11 ARG A 57 -21.248 -20.127 -3.398 1.00 35.42 H new ATOM 0 HH12 ARG A 57 -21.206 -18.383 -3.674 1.00 35.42 H new ATOM 0 HH21 ARG A 57 -19.600 -18.638 -6.799 1.00 33.01 H new ATOM 0 HH22 ARG A 57 -20.279 -17.546 -5.587 1.00 33.01 H new ATOM 860 N SER A 58 -17.642 -25.767 -2.666 1.00 22.42 N ATOM 861 CA SER A 58 -16.381 -25.682 -1.930 1.00 70.35 C ATOM 862 C SER A 58 -15.399 -26.767 -2.394 1.00 50.02 C ATOM 863 O SER A 58 -14.186 -26.540 -2.488 1.00 63.20 O ATOM 864 CB SER A 58 -16.644 -25.815 -0.424 1.00 12.11 C ATOM 865 OG SER A 58 -17.552 -24.821 0.020 1.00 40.31 O ATOM 0 H SER A 58 -18.413 -26.169 -2.132 1.00 22.42 H new ATOM 0 HA SER A 58 -15.931 -24.710 -2.131 1.00 70.35 H new ATOM 0 HB2 SER A 58 -17.047 -26.804 -0.207 1.00 12.11 H new ATOM 0 HB3 SER A 58 -15.705 -25.726 0.123 1.00 12.11 H new ATOM 0 HG SER A 58 -17.707 -24.925 0.982 1.00 40.31 H new ATOM 871 N LEU A 59 -15.933 -27.944 -2.691 1.00 35.33 N ATOM 872 CA LEU A 59 -15.117 -29.117 -2.980 1.00 33.30 C ATOM 873 C LEU A 59 -14.323 -28.969 -4.272 1.00 51.22 C ATOM 874 O LEU A 59 -13.131 -29.248 -4.271 1.00 44.13 O ATOM 875 CB LEU A 59 -15.974 -30.390 -3.016 1.00 34.51 C ATOM 876 CG LEU A 59 -16.352 -30.960 -1.636 1.00 64.10 C ATOM 877 CD1 LEU A 59 -15.096 -31.264 -0.823 1.00 21.22 C ATOM 878 CD2 LEU A 59 -17.268 -30.005 -0.872 1.00 63.33 C ATOM 0 H LEU A 59 -16.938 -28.113 -2.738 1.00 35.33 H new ATOM 0 HA LEU A 59 -14.396 -29.204 -2.167 1.00 33.30 H new ATOM 0 HB2 LEU A 59 -16.890 -30.178 -3.568 1.00 34.51 H new ATOM 0 HB3 LEU A 59 -15.436 -31.156 -3.574 1.00 34.51 H new ATOM 0 HG LEU A 59 -16.899 -31.889 -1.795 1.00 64.10 H new ATOM 0 HD11 LEU A 59 -15.380 -31.666 0.149 1.00 21.22 H new ATOM 0 HD12 LEU A 59 -14.487 -31.996 -1.354 1.00 21.22 H new ATOM 0 HD13 LEU A 59 -14.523 -30.348 -0.683 1.00 21.22 H new ATOM 0 HD21 LEU A 59 -17.516 -30.437 0.098 1.00 63.33 H new ATOM 0 HD22 LEU A 59 -16.759 -29.052 -0.725 1.00 63.33 H new ATOM 0 HD23 LEU A 59 -18.183 -29.844 -1.442 1.00 63.33 H new ATOM 890 N GLU A 60 -14.964 -28.534 -5.357 1.00 25.40 N ATOM 891 CA GLU A 60 -14.269 -28.379 -6.643 1.00 51.24 C ATOM 892 C GLU A 60 -12.930 -27.623 -6.478 1.00 31.13 C ATOM 893 O GLU A 60 -11.877 -28.145 -6.868 1.00 60.23 O ATOM 894 CB GLU A 60 -15.161 -27.695 -7.702 1.00 44.05 C ATOM 895 CG GLU A 60 -16.300 -28.569 -8.234 1.00 51.15 C ATOM 896 CD GLU A 60 -17.406 -28.809 -7.213 1.00 40.34 C ATOM 897 OE1 GLU A 60 -17.314 -29.793 -6.445 1.00 65.12 O ATOM 898 OE2 GLU A 60 -18.361 -28.004 -7.172 1.00 25.24 O1- ATOM 0 H GLU A 60 -15.953 -28.284 -5.376 1.00 25.40 H new ATOM 0 HA GLU A 60 -14.045 -29.383 -7.003 1.00 51.24 H new ATOM 0 HB2 GLU A 60 -15.587 -26.789 -7.270 1.00 44.05 H new ATOM 0 HB3 GLU A 60 -14.536 -27.385 -8.540 1.00 44.05 H new ATOM 0 HG2 GLU A 60 -16.728 -28.097 -9.118 1.00 51.15 H new ATOM 0 HG3 GLU A 60 -15.894 -29.529 -8.551 1.00 51.15 H new ATOM 905 N PRO A 61 -12.927 -26.398 -5.890 1.00 40.44 N ATOM 906 CA PRO A 61 -11.678 -25.677 -5.615 1.00 20.54 C ATOM 907 C PRO A 61 -10.805 -26.404 -4.584 1.00 64.23 C ATOM 908 O PRO A 61 -9.569 -26.361 -4.671 1.00 41.33 O ATOM 909 CB PRO A 61 -12.136 -24.306 -5.088 1.00 61.44 C ATOM 910 CG PRO A 61 -13.541 -24.510 -4.634 1.00 3.54 C ATOM 911 CD PRO A 61 -14.111 -25.612 -5.492 1.00 61.33 C ATOM 0 HA PRO A 61 -11.054 -25.597 -6.505 1.00 20.54 H new ATOM 0 HB2 PRO A 61 -11.503 -23.968 -4.268 1.00 61.44 H new ATOM 0 HB3 PRO A 61 -12.081 -23.546 -5.868 1.00 61.44 H new ATOM 0 HG2 PRO A 61 -13.572 -24.784 -3.579 1.00 3.54 H new ATOM 0 HG3 PRO A 61 -14.121 -23.594 -4.743 1.00 3.54 H new ATOM 0 HD2 PRO A 61 -14.827 -26.220 -4.939 1.00 61.33 H new ATOM 0 HD3 PRO A 61 -14.636 -25.212 -6.360 1.00 61.33 H new ATOM 919 N GLN A 62 -11.433 -27.082 -3.612 1.00 1.31 N ATOM 920 CA GLN A 62 -10.668 -27.872 -2.638 1.00 64.23 C ATOM 921 C GLN A 62 -9.977 -29.052 -3.327 1.00 72.30 C ATOM 922 O GLN A 62 -8.923 -29.516 -2.883 1.00 45.13 O ATOM 923 CB GLN A 62 -11.548 -28.368 -1.483 1.00 52.44 C ATOM 924 CG GLN A 62 -12.045 -27.250 -0.574 1.00 75.21 C ATOM 925 CD GLN A 62 -12.739 -27.762 0.680 1.00 5.22 C ATOM 926 OE1 GLN A 62 -12.106 -27.948 1.721 1.00 5.12 O ATOM 927 NE2 GLN A 62 -14.039 -27.996 0.591 1.00 34.41 N ATOM 0 H GLN A 62 -12.444 -27.100 -3.481 1.00 1.31 H new ATOM 0 HA GLN A 62 -9.909 -27.215 -2.213 1.00 64.23 H new ATOM 0 HB2 GLN A 62 -12.406 -28.900 -1.893 1.00 52.44 H new ATOM 0 HB3 GLN A 62 -10.983 -29.085 -0.888 1.00 52.44 H new ATOM 0 HG2 GLN A 62 -11.201 -26.623 -0.285 1.00 75.21 H new ATOM 0 HG3 GLN A 62 -12.736 -26.617 -1.131 1.00 75.21 H new ATOM 0 HE21 GLN A 62 -14.528 -27.830 -0.289 1.00 34.41 H new ATOM 0 HE22 GLN A 62 -14.551 -28.343 1.402 1.00 34.41 H new ATOM 936 N LEU A 63 -10.565 -29.518 -4.426 1.00 4.32 N ATOM 937 CA LEU A 63 -9.984 -30.601 -5.210 1.00 24.11 C ATOM 938 C LEU A 63 -8.833 -30.063 -6.043 1.00 34.30 C ATOM 939 O LEU A 63 -7.824 -30.742 -6.236 1.00 14.04 O ATOM 940 CB LEU A 63 -11.040 -31.259 -6.110 1.00 72.32 C ATOM 941 CG LEU A 63 -12.179 -31.976 -5.369 1.00 45.24 C ATOM 942 CD1 LEU A 63 -13.183 -32.568 -6.359 1.00 73.33 C ATOM 943 CD2 LEU A 63 -11.624 -33.058 -4.441 1.00 74.14 C ATOM 0 H LEU A 63 -11.447 -29.160 -4.794 1.00 4.32 H new ATOM 0 HA LEU A 63 -9.609 -31.365 -4.529 1.00 24.11 H new ATOM 0 HB2 LEU A 63 -11.473 -30.493 -6.754 1.00 72.32 H new ATOM 0 HB3 LEU A 63 -10.542 -31.978 -6.760 1.00 72.32 H new ATOM 0 HG LEU A 63 -12.703 -31.242 -4.757 1.00 45.24 H new ATOM 0 HD11 LEU A 63 -13.980 -33.071 -5.812 1.00 73.33 H new ATOM 0 HD12 LEU A 63 -13.608 -31.770 -6.968 1.00 73.33 H new ATOM 0 HD13 LEU A 63 -12.677 -33.286 -7.004 1.00 73.33 H new ATOM 0 HD21 LEU A 63 -12.447 -33.553 -3.926 1.00 74.14 H new ATOM 0 HD22 LEU A 63 -11.069 -33.791 -5.027 1.00 74.14 H new ATOM 0 HD23 LEU A 63 -10.959 -32.602 -3.707 1.00 74.14 H new ATOM 955 N GLU A 64 -8.987 -28.832 -6.532 1.00 4.53 N ATOM 956 CA GLU A 64 -7.895 -28.143 -7.209 1.00 14.32 C ATOM 957 C GLU A 64 -6.721 -27.973 -6.250 1.00 63.35 C ATOM 958 O GLU A 64 -5.560 -28.082 -6.653 1.00 10.34 O ATOM 959 CB GLU A 64 -8.341 -26.776 -7.746 1.00 61.33 C ATOM 960 CG GLU A 64 -9.400 -26.854 -8.841 1.00 42.54 C ATOM 961 CD GLU A 64 -9.615 -25.521 -9.540 1.00 13.44 C ATOM 962 OE1 GLU A 64 -10.421 -24.706 -9.051 1.00 52.13 O ATOM 963 OE2 GLU A 64 -8.967 -25.281 -10.583 1.00 65.51 O1- ATOM 0 H GLU A 64 -9.853 -28.297 -6.471 1.00 4.53 H new ATOM 0 HA GLU A 64 -7.586 -28.749 -8.060 1.00 14.32 H new ATOM 0 HB2 GLU A 64 -8.731 -26.182 -6.919 1.00 61.33 H new ATOM 0 HB3 GLU A 64 -7.470 -26.248 -8.134 1.00 61.33 H new ATOM 0 HG2 GLU A 64 -9.103 -27.602 -9.576 1.00 42.54 H new ATOM 0 HG3 GLU A 64 -10.342 -27.189 -8.407 1.00 42.54 H new ATOM 970 N LYS A 65 -7.034 -27.716 -4.978 1.00 0.43 N ATOM 971 CA LYS A 65 -6.010 -27.626 -3.941 1.00 4.21 C ATOM 972 C LYS A 65 -5.208 -28.918 -3.877 1.00 63.22 C ATOM 973 O LYS A 65 -3.988 -28.907 -4.024 1.00 64.34 O ATOM 974 CB LYS A 65 -6.628 -27.349 -2.565 1.00 2.10 C ATOM 975 CG LYS A 65 -5.611 -27.427 -1.424 1.00 73.25 C ATOM 976 CD LYS A 65 -6.234 -27.119 -0.066 1.00 53.43 C ATOM 977 CE LYS A 65 -5.185 -27.092 1.046 1.00 74.54 C ATOM 978 NZ LYS A 65 -4.471 -28.391 1.190 1.00 62.51 N1+ ATOM 0 H LYS A 65 -7.986 -27.567 -4.644 1.00 0.43 H new ATOM 0 HA LYS A 65 -5.353 -26.796 -4.202 1.00 4.21 H new ATOM 0 HB2 LYS A 65 -7.084 -26.359 -2.571 1.00 2.10 H new ATOM 0 HB3 LYS A 65 -7.427 -28.067 -2.381 1.00 2.10 H new ATOM 0 HG2 LYS A 65 -5.171 -28.424 -1.401 1.00 73.25 H new ATOM 0 HG3 LYS A 65 -4.800 -26.725 -1.616 1.00 73.25 H new ATOM 0 HD2 LYS A 65 -6.743 -26.156 -0.109 1.00 53.43 H new ATOM 0 HD3 LYS A 65 -6.990 -27.869 0.166 1.00 53.43 H new ATOM 0 HE2 LYS A 65 -4.461 -26.304 0.838 1.00 74.54 H new ATOM 0 HE3 LYS A 65 -5.668 -26.840 1.990 1.00 74.54 H new ATOM 0 HZ1 LYS A 65 -3.897 -28.377 2.057 1.00 62.51 H new ATOM 0 HZ2 LYS A 65 -5.165 -29.164 1.246 1.00 62.51 H new ATOM 0 HZ3 LYS A 65 -3.852 -28.540 0.368 1.00 62.51 H new ATOM 992 N LEU A 66 -5.909 -30.030 -3.664 1.00 12.42 N ATOM 993 CA LEU A 66 -5.253 -31.327 -3.527 1.00 2.43 C ATOM 994 C LEU A 66 -4.533 -31.696 -4.821 1.00 60.12 C ATOM 995 O LEU A 66 -3.482 -32.338 -4.798 1.00 51.14 O ATOM 996 CB LEU A 66 -6.272 -32.415 -3.137 1.00 45.35 C ATOM 997 CG LEU A 66 -7.157 -32.065 -1.929 1.00 74.51 C ATOM 998 CD1 LEU A 66 -8.155 -33.180 -1.642 1.00 61.45 C ATOM 999 CD2 LEU A 66 -6.299 -31.773 -0.698 1.00 41.11 C ATOM 0 H LEU A 66 -6.925 -30.059 -3.583 1.00 12.42 H new ATOM 0 HA LEU A 66 -4.513 -31.258 -2.730 1.00 2.43 H new ATOM 0 HB2 LEU A 66 -6.914 -32.616 -3.994 1.00 45.35 H new ATOM 0 HB3 LEU A 66 -5.733 -33.337 -2.920 1.00 45.35 H new ATOM 0 HG LEU A 66 -7.721 -31.165 -2.173 1.00 74.51 H new ATOM 0 HD11 LEU A 66 -8.768 -32.907 -0.783 1.00 61.45 H new ATOM 0 HD12 LEU A 66 -8.795 -33.329 -2.512 1.00 61.45 H new ATOM 0 HD13 LEU A 66 -7.617 -34.103 -1.425 1.00 61.45 H new ATOM 0 HD21 LEU A 66 -6.944 -31.528 0.145 1.00 41.11 H new ATOM 0 HD22 LEU A 66 -5.702 -32.651 -0.454 1.00 41.11 H new ATOM 0 HD23 LEU A 66 -5.638 -30.931 -0.906 1.00 41.11 H new ATOM 1011 N ALA A 67 -5.092 -31.258 -5.945 1.00 43.32 N ATOM 1012 CA ALA A 67 -4.492 -31.501 -7.251 1.00 1.23 C ATOM 1013 C ALA A 67 -3.145 -30.785 -7.373 1.00 3.40 C ATOM 1014 O ALA A 67 -2.185 -31.348 -7.882 1.00 21.23 O ATOM 1015 CB ALA A 67 -5.441 -31.061 -8.361 1.00 34.31 C ATOM 0 H ALA A 67 -5.964 -30.730 -5.976 1.00 43.32 H new ATOM 0 HA ALA A 67 -4.314 -32.571 -7.354 1.00 1.23 H new ATOM 0 HB1 ALA A 67 -4.979 -31.249 -9.330 1.00 34.31 H new ATOM 0 HB2 ALA A 67 -6.372 -31.623 -8.288 1.00 34.31 H new ATOM 0 HB3 ALA A 67 -5.651 -29.996 -8.259 1.00 34.31 H new ATOM 1021 N GLN A 68 -3.087 -29.543 -6.898 1.00 30.24 N ATOM 1022 CA GLN A 68 -1.851 -28.749 -6.929 1.00 34.53 C ATOM 1023 C GLN A 68 -0.867 -29.234 -5.867 1.00 14.40 C ATOM 1024 O GLN A 68 0.342 -29.297 -6.099 1.00 34.01 O ATOM 1025 CB GLN A 68 -2.167 -27.259 -6.710 1.00 73.12 C ATOM 1026 CG GLN A 68 -2.643 -26.531 -7.965 1.00 63.23 C ATOM 1027 CD GLN A 68 -1.528 -26.315 -8.983 1.00 72.52 C ATOM 1028 OE1 GLN A 68 -0.358 -26.173 -8.622 1.00 74.13 O ATOM 1029 NE2 GLN A 68 -1.879 -26.284 -10.259 1.00 35.24 N ATOM 0 H GLN A 68 -3.883 -29.059 -6.484 1.00 30.24 H new ATOM 0 HA GLN A 68 -1.392 -28.875 -7.910 1.00 34.53 H new ATOM 0 HB2 GLN A 68 -2.933 -27.171 -5.939 1.00 73.12 H new ATOM 0 HB3 GLN A 68 -1.274 -26.761 -6.331 1.00 73.12 H new ATOM 0 HG2 GLN A 68 -3.446 -27.104 -8.429 1.00 63.23 H new ATOM 0 HG3 GLN A 68 -3.062 -25.565 -7.682 1.00 63.23 H new ATOM 0 HE21 GLN A 68 -2.857 -26.405 -10.522 1.00 35.24 H new ATOM 0 HE22 GLN A 68 -1.171 -26.139 -10.979 1.00 35.24 H new ATOM 1038 N GLN A 69 -1.400 -29.581 -4.708 1.00 23.22 N ATOM 1039 CA GLN A 69 -0.596 -30.018 -3.571 1.00 22.40 C ATOM 1040 C GLN A 69 0.070 -31.362 -3.862 1.00 3.21 C ATOM 1041 O GLN A 69 1.223 -31.598 -3.497 1.00 75.41 O ATOM 1042 CB GLN A 69 -1.496 -30.130 -2.334 1.00 11.52 C ATOM 1043 CG GLN A 69 -0.777 -30.542 -1.056 1.00 32.44 C ATOM 1044 CD GLN A 69 -1.732 -30.715 0.114 1.00 50.30 C ATOM 1045 OE1 GLN A 69 -2.777 -30.064 0.180 1.00 65.51 O ATOM 1046 NE2 GLN A 69 -1.382 -31.592 1.043 1.00 31.30 N ATOM 0 H GLN A 69 -2.403 -29.569 -4.525 1.00 23.22 H new ATOM 0 HA GLN A 69 0.191 -29.286 -3.388 1.00 22.40 H new ATOM 0 HB2 GLN A 69 -1.982 -29.169 -2.167 1.00 11.52 H new ATOM 0 HB3 GLN A 69 -2.284 -30.854 -2.540 1.00 11.52 H new ATOM 0 HG2 GLN A 69 -0.243 -31.477 -1.227 1.00 32.44 H new ATOM 0 HG3 GLN A 69 -0.030 -29.790 -0.804 1.00 32.44 H new ATOM 0 HE21 GLN A 69 -0.509 -32.111 0.951 1.00 31.30 H new ATOM 0 HE22 GLN A 69 -1.986 -31.748 1.850 1.00 31.30 H new ATOM 1055 N TYR A 70 -0.674 -32.235 -4.527 1.00 14.41 N ATOM 1056 CA TYR A 70 -0.237 -33.602 -4.799 1.00 60.14 C ATOM 1057 C TYR A 70 0.185 -33.792 -6.265 1.00 40.42 C ATOM 1058 O TYR A 70 0.496 -34.903 -6.676 1.00 75.22 O ATOM 1059 CB TYR A 70 -1.339 -34.602 -4.418 1.00 23.30 C ATOM 1060 CG TYR A 70 -1.684 -34.620 -2.938 1.00 14.04 C ATOM 1061 CD1 TYR A 70 -2.983 -34.378 -2.495 1.00 64.52 C ATOM 1062 CD2 TYR A 70 -0.709 -34.886 -1.981 1.00 13.23 C ATOM 1063 CE1 TYR A 70 -3.296 -34.405 -1.149 1.00 62.24 C ATOM 1064 CE2 TYR A 70 -1.017 -34.912 -0.634 1.00 4.24 C ATOM 1065 CZ TYR A 70 -2.311 -34.670 -0.223 1.00 51.45 C ATOM 1066 OH TYR A 70 -2.627 -34.703 1.116 1.00 12.52 O ATOM 0 H TYR A 70 -1.600 -32.017 -4.895 1.00 14.41 H new ATOM 0 HA TYR A 70 0.642 -33.793 -4.184 1.00 60.14 H new ATOM 0 HB2 TYR A 70 -2.239 -34.366 -4.986 1.00 23.30 H new ATOM 0 HB3 TYR A 70 -1.025 -35.602 -4.718 1.00 23.30 H new ATOM 0 HD1 TYR A 70 -3.759 -34.166 -3.216 1.00 64.52 H new ATOM 0 HD2 TYR A 70 0.306 -35.075 -2.297 1.00 13.23 H new ATOM 0 HE1 TYR A 70 -4.309 -34.219 -0.824 1.00 62.24 H new ATOM 0 HE2 TYR A 70 -0.247 -35.121 0.094 1.00 4.24 H new ATOM 0 HH TYR A 70 -1.822 -34.904 1.637 1.00 12.52 H new ATOM 1076 N THR A 71 0.206 -32.705 -7.044 1.00 61.35 N ATOM 1077 CA THR A 71 0.411 -32.779 -8.506 1.00 51.44 C ATOM 1078 C THR A 71 1.671 -33.574 -8.891 1.00 2.11 C ATOM 1079 O THR A 71 1.808 -34.014 -10.039 1.00 63.31 O ATOM 1080 CB THR A 71 0.515 -31.365 -9.141 1.00 32.42 C ATOM 1081 OG1 THR A 71 0.629 -31.471 -10.571 1.00 20.15 O ATOM 1082 CG2 THR A 71 1.711 -30.591 -8.592 1.00 4.22 C ATOM 0 H THR A 71 0.083 -31.756 -6.690 1.00 61.35 H new ATOM 0 HA THR A 71 -0.465 -33.299 -8.893 1.00 51.44 H new ATOM 0 HB THR A 71 -0.393 -30.821 -8.883 1.00 32.42 H new ATOM 0 HG1 THR A 71 0.692 -30.574 -10.961 1.00 20.15 H new ATOM 0 HG21 THR A 71 1.753 -29.607 -9.058 1.00 4.22 H new ATOM 0 HG22 THR A 71 1.607 -30.477 -7.513 1.00 4.22 H new ATOM 0 HG23 THR A 71 2.629 -31.136 -8.812 1.00 4.22 H new ATOM 1090 N GLU A 72 2.593 -33.743 -7.948 1.00 51.24 N ATOM 1091 CA GLU A 72 3.837 -34.466 -8.209 1.00 74.02 C ATOM 1092 C GLU A 72 3.593 -35.969 -8.374 1.00 60.10 C ATOM 1093 O GLU A 72 4.353 -36.655 -9.064 1.00 53.34 O ATOM 1094 CB GLU A 72 4.846 -34.195 -7.087 1.00 21.44 C ATOM 1095 CG GLU A 72 5.226 -32.721 -6.960 1.00 35.12 C ATOM 1096 CD GLU A 72 5.856 -32.163 -8.232 1.00 32.11 C ATOM 1097 OE1 GLU A 72 5.110 -31.758 -9.148 1.00 53.51 O ATOM 1098 OE2 GLU A 72 7.100 -32.130 -8.322 1.00 0.13 O1- ATOM 0 H GLU A 72 2.504 -33.390 -6.995 1.00 51.24 H new ATOM 0 HA GLU A 72 4.250 -34.102 -9.150 1.00 74.02 H new ATOM 0 HB2 GLU A 72 4.428 -34.538 -6.141 1.00 21.44 H new ATOM 0 HB3 GLU A 72 5.747 -34.781 -7.268 1.00 21.44 H new ATOM 0 HG2 GLU A 72 4.336 -32.141 -6.715 1.00 35.12 H new ATOM 0 HG3 GLU A 72 5.923 -32.600 -6.131 1.00 35.12 H new ATOM 1105 N ASN A 73 2.537 -36.477 -7.742 1.00 54.34 N ATOM 1106 CA ASN A 73 2.167 -37.893 -7.845 1.00 53.33 C ATOM 1107 C ASN A 73 0.664 -38.060 -8.076 1.00 50.23 C ATOM 1108 O ASN A 73 0.146 -39.173 -8.025 1.00 40.15 O ATOM 1109 CB ASN A 73 2.603 -38.669 -6.585 1.00 52.25 C ATOM 1110 CG ASN A 73 2.227 -37.978 -5.282 1.00 60.25 C ATOM 1111 OD1 ASN A 73 1.266 -37.215 -5.215 1.00 52.33 O ATOM 1112 ND2 ASN A 73 2.988 -38.250 -4.231 1.00 3.30 N ATOM 0 H ASN A 73 1.916 -35.927 -7.148 1.00 54.34 H new ATOM 0 HA ASN A 73 2.691 -38.306 -8.707 1.00 53.33 H new ATOM 0 HB2 ASN A 73 2.150 -39.660 -6.604 1.00 52.25 H new ATOM 0 HB3 ASN A 73 3.683 -38.811 -6.612 1.00 52.25 H new ATOM 0 HD21 ASN A 73 2.784 -37.821 -3.329 1.00 3.30 H new ATOM 0 HD22 ASN A 73 3.778 -38.889 -4.325 1.00 3.30 H new ATOM 1119 N VAL A 74 -0.028 -36.955 -8.357 1.00 42.24 N ATOM 1120 CA VAL A 74 -1.477 -36.975 -8.559 1.00 72.51 C ATOM 1121 C VAL A 74 -1.876 -36.135 -9.769 1.00 33.41 C ATOM 1122 O VAL A 74 -1.296 -35.079 -10.029 1.00 74.22 O ATOM 1123 CB VAL A 74 -2.229 -36.453 -7.304 1.00 15.53 C ATOM 1124 CG1 VAL A 74 -3.712 -36.206 -7.590 1.00 23.10 C ATOM 1125 CG2 VAL A 74 -2.066 -37.425 -6.140 1.00 50.05 C ATOM 0 H VAL A 74 0.394 -36.031 -8.450 1.00 42.24 H new ATOM 0 HA VAL A 74 -1.759 -38.013 -8.736 1.00 72.51 H new ATOM 0 HB VAL A 74 -1.784 -35.496 -7.031 1.00 15.53 H new ATOM 0 HG11 VAL A 74 -4.201 -35.842 -6.687 1.00 23.10 H new ATOM 0 HG12 VAL A 74 -3.811 -35.463 -8.381 1.00 23.10 H new ATOM 0 HG13 VAL A 74 -4.182 -37.137 -7.906 1.00 23.10 H new ATOM 0 HG21 VAL A 74 -2.599 -37.043 -5.270 1.00 50.05 H new ATOM 0 HG22 VAL A 74 -2.474 -38.397 -6.418 1.00 50.05 H new ATOM 0 HG23 VAL A 74 -1.008 -37.531 -5.900 1.00 50.05 H new ATOM 1135 N LYS A 75 -2.865 -36.623 -10.507 1.00 71.33 N ATOM 1136 CA LYS A 75 -3.454 -35.887 -11.614 1.00 20.41 C ATOM 1137 C LYS A 75 -4.941 -36.219 -11.693 1.00 63.15 C ATOM 1138 O LYS A 75 -5.312 -37.381 -11.858 1.00 32.02 O ATOM 1139 CB LYS A 75 -2.752 -36.245 -12.933 1.00 33.32 C ATOM 1140 CG LYS A 75 -3.248 -35.448 -14.137 1.00 15.44 C ATOM 1141 CD LYS A 75 -2.963 -33.954 -14.001 1.00 32.33 C ATOM 1142 CE LYS A 75 -3.523 -33.160 -15.178 1.00 62.53 C ATOM 1143 NZ LYS A 75 -2.977 -33.632 -16.482 1.00 41.05 N1+ ATOM 0 H LYS A 75 -3.281 -37.542 -10.353 1.00 71.33 H new ATOM 0 HA LYS A 75 -3.328 -34.817 -11.448 1.00 20.41 H new ATOM 0 HB2 LYS A 75 -1.680 -36.081 -12.818 1.00 33.32 H new ATOM 0 HB3 LYS A 75 -2.893 -37.308 -13.131 1.00 33.32 H new ATOM 0 HG2 LYS A 75 -2.771 -35.826 -15.041 1.00 15.44 H new ATOM 0 HG3 LYS A 75 -4.321 -35.602 -14.255 1.00 15.44 H new ATOM 0 HD2 LYS A 75 -3.399 -33.584 -13.073 1.00 32.33 H new ATOM 0 HD3 LYS A 75 -1.887 -33.794 -13.934 1.00 32.33 H new ATOM 0 HE2 LYS A 75 -4.610 -33.245 -15.188 1.00 62.53 H new ATOM 0 HE3 LYS A 75 -3.287 -32.104 -15.047 1.00 62.53 H new ATOM 0 HZ1 LYS A 75 -3.159 -32.916 -17.214 1.00 41.05 H new ATOM 0 HZ2 LYS A 75 -1.952 -33.785 -16.394 1.00 41.05 H new ATOM 0 HZ3 LYS A 75 -3.439 -34.525 -16.749 1.00 41.05 H new ATOM 1157 N ILE A 76 -5.790 -35.206 -11.555 1.00 10.31 N ATOM 1158 CA ILE A 76 -7.234 -35.415 -11.557 1.00 43.12 C ATOM 1159 C ILE A 76 -7.831 -35.019 -12.906 1.00 51.15 C ATOM 1160 O ILE A 76 -7.560 -33.931 -13.417 1.00 60.02 O ATOM 1161 CB ILE A 76 -7.930 -34.603 -10.428 1.00 3.10 C ATOM 1162 CG1 ILE A 76 -7.225 -34.847 -9.079 1.00 3.44 C ATOM 1163 CG2 ILE A 76 -9.412 -34.977 -10.332 1.00 13.44 C ATOM 1164 CD1 ILE A 76 -7.820 -34.073 -7.917 1.00 73.14 C ATOM 0 H ILE A 76 -5.504 -34.234 -11.441 1.00 10.31 H new ATOM 0 HA ILE A 76 -7.408 -36.476 -11.378 1.00 43.12 H new ATOM 0 HB ILE A 76 -7.858 -33.543 -10.671 1.00 3.10 H new ATOM 0 HG12 ILE A 76 -7.263 -35.912 -8.849 1.00 3.44 H new ATOM 0 HG13 ILE A 76 -6.173 -34.580 -9.178 1.00 3.44 H new ATOM 0 HG21 ILE A 76 -9.882 -34.399 -9.537 1.00 13.44 H new ATOM 0 HG22 ILE A 76 -9.905 -34.758 -11.280 1.00 13.44 H new ATOM 0 HG23 ILE A 76 -9.505 -36.040 -10.111 1.00 13.44 H new ATOM 0 HD11 ILE A 76 -7.266 -34.301 -7.006 1.00 73.14 H new ATOM 0 HD12 ILE A 76 -7.757 -33.004 -8.122 1.00 73.14 H new ATOM 0 HD13 ILE A 76 -8.864 -34.357 -7.788 1.00 73.14 H new ATOM 1176 N TYR A 77 -8.621 -35.916 -13.480 1.00 3.34 N ATOM 1177 CA TYR A 77 -9.328 -35.657 -14.730 1.00 12.22 C ATOM 1178 C TYR A 77 -10.828 -35.683 -14.478 1.00 34.33 C ATOM 1179 O TYR A 77 -11.267 -36.010 -13.378 1.00 1.44 O ATOM 1180 CB TYR A 77 -8.983 -36.716 -15.786 1.00 23.15 C ATOM 1181 CG TYR A 77 -7.501 -36.895 -16.034 1.00 51.23 C ATOM 1182 CD1 TYR A 77 -6.830 -38.019 -15.567 1.00 62.14 C ATOM 1183 CD2 TYR A 77 -6.775 -35.946 -16.738 1.00 61.02 C ATOM 1184 CE1 TYR A 77 -5.480 -38.191 -15.797 1.00 25.40 C ATOM 1185 CE2 TYR A 77 -5.425 -36.113 -16.969 1.00 34.01 C ATOM 1186 CZ TYR A 77 -4.784 -37.234 -16.499 1.00 2.40 C ATOM 1187 OH TYR A 77 -3.440 -37.401 -16.732 1.00 22.34 O ATOM 0 H TYR A 77 -8.791 -36.844 -13.093 1.00 3.34 H new ATOM 0 HA TYR A 77 -9.022 -34.678 -15.100 1.00 12.22 H new ATOM 0 HB2 TYR A 77 -9.405 -37.672 -15.475 1.00 23.15 H new ATOM 0 HB3 TYR A 77 -9.466 -36.445 -16.725 1.00 23.15 H new ATOM 0 HD1 TYR A 77 -7.374 -38.771 -15.015 1.00 62.14 H new ATOM 0 HD2 TYR A 77 -7.274 -35.063 -17.111 1.00 61.02 H new ATOM 0 HE1 TYR A 77 -4.973 -39.071 -15.428 1.00 25.40 H new ATOM 0 HE2 TYR A 77 -4.873 -35.364 -17.518 1.00 34.01 H new ATOM 0 HH TYR A 77 -3.099 -36.637 -17.242 1.00 22.34 H new ATOM 1197 N LYS A 78 -11.607 -35.340 -15.494 1.00 10.01 N ATOM 1198 CA LYS A 78 -13.059 -35.459 -15.423 1.00 3.41 C ATOM 1199 C LYS A 78 -13.638 -35.595 -16.822 1.00 25.15 C ATOM 1200 O LYS A 78 -13.220 -34.892 -17.752 1.00 45.21 O ATOM 1201 CB LYS A 78 -13.683 -34.256 -14.691 1.00 53.32 C ATOM 1202 CG LYS A 78 -13.470 -32.911 -15.379 1.00 32.43 C ATOM 1203 CD LYS A 78 -13.978 -31.754 -14.520 1.00 31.14 C ATOM 1204 CE LYS A 78 -13.750 -30.407 -15.194 1.00 3.31 C ATOM 1205 NZ LYS A 78 -13.966 -29.270 -14.261 1.00 62.33 N1+ ATOM 0 H LYS A 78 -11.258 -34.976 -16.380 1.00 10.01 H new ATOM 0 HA LYS A 78 -13.302 -36.355 -14.851 1.00 3.41 H new ATOM 0 HB2 LYS A 78 -14.754 -34.429 -14.584 1.00 53.32 H new ATOM 0 HB3 LYS A 78 -13.267 -34.204 -13.685 1.00 53.32 H new ATOM 0 HG2 LYS A 78 -12.409 -32.772 -15.587 1.00 32.43 H new ATOM 0 HG3 LYS A 78 -13.987 -32.907 -16.339 1.00 32.43 H new ATOM 0 HD2 LYS A 78 -15.042 -31.887 -14.324 1.00 31.14 H new ATOM 0 HD3 LYS A 78 -13.472 -31.768 -13.555 1.00 31.14 H new ATOM 0 HE2 LYS A 78 -12.734 -30.366 -15.586 1.00 3.31 H new ATOM 0 HE3 LYS A 78 -14.424 -30.310 -16.045 1.00 3.31 H new ATOM 0 HZ1 LYS A 78 -14.366 -28.464 -14.783 1.00 62.33 H new ATOM 0 HZ2 LYS A 78 -14.625 -29.558 -13.510 1.00 62.33 H new ATOM 0 HZ3 LYS A 78 -13.058 -28.992 -13.837 1.00 62.33 H new ATOM 1219 N ILE A 79 -14.581 -36.517 -16.979 1.00 35.25 N ATOM 1220 CA ILE A 79 -15.243 -36.721 -18.259 1.00 51.22 C ATOM 1221 C ILE A 79 -16.317 -35.652 -18.441 1.00 13.33 C ATOM 1222 O ILE A 79 -17.502 -35.889 -18.196 1.00 3.23 O ATOM 1223 CB ILE A 79 -15.872 -38.137 -18.368 1.00 11.23 C ATOM 1224 CG1 ILE A 79 -14.822 -39.217 -18.047 1.00 75.13 C ATOM 1225 CG2 ILE A 79 -16.462 -38.361 -19.765 1.00 32.21 C ATOM 1226 CD1 ILE A 79 -15.372 -40.629 -18.059 1.00 50.20 C ATOM 0 H ILE A 79 -14.903 -37.135 -16.234 1.00 35.25 H new ATOM 0 HA ILE A 79 -14.495 -36.640 -19.048 1.00 51.22 H new ATOM 0 HB ILE A 79 -16.680 -38.211 -17.640 1.00 11.23 H new ATOM 0 HG12 ILE A 79 -14.010 -39.147 -18.771 1.00 75.13 H new ATOM 0 HG13 ILE A 79 -14.393 -39.013 -17.066 1.00 75.13 H new ATOM 0 HG21 ILE A 79 -16.898 -39.359 -19.820 1.00 32.21 H new ATOM 0 HG22 ILE A 79 -17.235 -37.617 -19.957 1.00 32.21 H new ATOM 0 HG23 ILE A 79 -15.674 -38.267 -20.512 1.00 32.21 H new ATOM 0 HD11 ILE A 79 -14.573 -41.333 -17.824 1.00 50.20 H new ATOM 0 HD12 ILE A 79 -16.164 -40.717 -17.315 1.00 50.20 H new ATOM 0 HD13 ILE A 79 -15.775 -40.854 -19.046 1.00 50.20 H new ATOM 1238 N ASN A 80 -15.886 -34.459 -18.830 1.00 52.33 N ATOM 1239 CA ASN A 80 -16.787 -33.313 -18.965 1.00 2.04 C ATOM 1240 C ASN A 80 -17.528 -33.372 -20.301 1.00 60.11 C ATOM 1241 O ASN A 80 -17.473 -32.439 -21.109 1.00 23.20 O ATOM 1242 CB ASN A 80 -15.997 -32.001 -18.834 1.00 23.44 C ATOM 1243 CG ASN A 80 -16.896 -30.778 -18.729 1.00 12.41 C ATOM 1244 OD1 ASN A 80 -18.000 -30.845 -18.195 1.00 32.04 O ATOM 1245 ND2 ASN A 80 -16.422 -29.651 -19.237 1.00 24.31 N ATOM 0 H ASN A 80 -14.913 -34.255 -19.060 1.00 52.33 H new ATOM 0 HA ASN A 80 -17.527 -33.350 -18.166 1.00 2.04 H new ATOM 0 HB2 ASN A 80 -15.359 -32.053 -17.952 1.00 23.44 H new ATOM 0 HB3 ASN A 80 -15.340 -31.890 -19.697 1.00 23.44 H new ATOM 0 HD21 ASN A 80 -16.979 -28.798 -19.193 1.00 24.31 H new ATOM 0 HD22 ASN A 80 -15.500 -29.636 -19.673 1.00 24.31 H new ATOM 1252 N ILE A 81 -18.220 -34.483 -20.529 1.00 22.21 N ATOM 1253 CA ILE A 81 -18.972 -34.695 -21.757 1.00 54.13 C ATOM 1254 C ILE A 81 -20.433 -34.985 -21.424 1.00 65.23 C ATOM 1255 O ILE A 81 -20.808 -36.129 -21.172 1.00 21.40 O ATOM 1256 CB ILE A 81 -18.381 -35.862 -22.596 1.00 63.43 C ATOM 1257 CG1 ILE A 81 -16.888 -35.622 -22.879 1.00 0.10 C ATOM 1258 CG2 ILE A 81 -19.155 -36.032 -23.906 1.00 45.20 C ATOM 1259 CD1 ILE A 81 -16.224 -36.738 -23.660 1.00 64.23 C ATOM 0 H ILE A 81 -18.274 -35.259 -19.869 1.00 22.21 H new ATOM 0 HA ILE A 81 -18.903 -33.786 -22.354 1.00 54.13 H new ATOM 0 HB ILE A 81 -18.479 -36.781 -22.019 1.00 63.43 H new ATOM 0 HG12 ILE A 81 -16.779 -34.689 -23.433 1.00 0.10 H new ATOM 0 HG13 ILE A 81 -16.365 -35.494 -21.931 1.00 0.10 H new ATOM 0 HG21 ILE A 81 -18.725 -36.854 -24.478 1.00 45.20 H new ATOM 0 HG22 ILE A 81 -20.200 -36.251 -23.686 1.00 45.20 H new ATOM 0 HG23 ILE A 81 -19.092 -35.113 -24.488 1.00 45.20 H new ATOM 0 HD11 ILE A 81 -15.173 -36.495 -23.820 1.00 64.23 H new ATOM 0 HD12 ILE A 81 -16.300 -37.670 -23.099 1.00 64.23 H new ATOM 0 HD13 ILE A 81 -16.720 -36.853 -24.624 1.00 64.23 H new ATOM 1271 N GLU A 82 -21.245 -33.930 -21.408 1.00 34.03 N ATOM 1272 CA GLU A 82 -22.675 -34.041 -21.118 1.00 12.21 C ATOM 1273 C GLU A 82 -23.377 -34.951 -22.131 1.00 64.13 C ATOM 1274 O GLU A 82 -24.492 -35.418 -21.897 1.00 42.22 O ATOM 1275 CB GLU A 82 -23.325 -32.645 -21.103 1.00 14.33 C ATOM 1276 CG GLU A 82 -23.181 -31.879 -22.411 1.00 12.32 C ATOM 1277 CD GLU A 82 -23.808 -30.496 -22.344 1.00 44.14 C ATOM 1278 OE1 GLU A 82 -23.097 -29.529 -22.002 1.00 64.21 O ATOM 1279 OE2 GLU A 82 -25.015 -30.370 -22.633 1.00 51.21 O1- ATOM 0 H GLU A 82 -20.933 -32.977 -21.595 1.00 34.03 H new ATOM 0 HA GLU A 82 -22.787 -34.492 -20.132 1.00 12.21 H new ATOM 0 HB2 GLU A 82 -24.385 -32.752 -20.872 1.00 14.33 H new ATOM 0 HB3 GLU A 82 -22.881 -32.058 -20.299 1.00 14.33 H new ATOM 0 HG2 GLU A 82 -22.124 -31.784 -22.659 1.00 12.32 H new ATOM 0 HG3 GLU A 82 -23.647 -32.448 -23.215 1.00 12.32 H new ATOM 1286 N ASP A 83 -22.709 -35.176 -23.264 1.00 63.52 N ATOM 1287 CA ASP A 83 -23.234 -36.022 -24.337 1.00 11.04 C ATOM 1288 C ASP A 83 -23.210 -37.500 -23.933 1.00 33.50 C ATOM 1289 O ASP A 83 -24.015 -38.302 -24.419 1.00 21.21 O ATOM 1290 CB ASP A 83 -22.398 -35.811 -25.612 1.00 23.45 C ATOM 1291 CG ASP A 83 -22.876 -36.647 -26.793 1.00 52.42 C ATOM 1292 OD1 ASP A 83 -23.938 -36.322 -27.360 1.00 43.25 O ATOM 1293 OD2 ASP A 83 -22.175 -37.611 -27.180 1.00 25.20 O1- ATOM 0 H ASP A 83 -21.791 -34.778 -23.463 1.00 63.52 H new ATOM 0 HA ASP A 83 -24.270 -35.740 -24.527 1.00 11.04 H new ATOM 0 HB2 ASP A 83 -22.428 -34.757 -25.887 1.00 23.45 H new ATOM 0 HB3 ASP A 83 -21.357 -36.056 -25.400 1.00 23.45 H new ATOM 1298 N ASN A 84 -22.303 -37.856 -23.024 1.00 32.21 N ATOM 1299 CA ASN A 84 -22.140 -39.246 -22.600 1.00 13.34 C ATOM 1300 C ASN A 84 -22.636 -39.425 -21.167 1.00 61.05 C ATOM 1301 O ASN A 84 -21.978 -39.008 -20.214 1.00 23.22 O ATOM 1302 CB ASN A 84 -20.665 -39.675 -22.706 1.00 61.11 C ATOM 1303 CG ASN A 84 -20.456 -41.167 -22.466 1.00 73.53 C ATOM 1304 OD1 ASN A 84 -21.215 -41.818 -21.746 1.00 44.50 O ATOM 1305 ND2 ASN A 84 -19.412 -41.717 -23.068 1.00 3.45 N ATOM 0 H ASN A 84 -21.669 -37.200 -22.567 1.00 32.21 H new ATOM 0 HA ASN A 84 -22.734 -39.878 -23.260 1.00 13.34 H new ATOM 0 HB2 ASN A 84 -20.288 -39.416 -23.695 1.00 61.11 H new ATOM 0 HB3 ASN A 84 -20.076 -39.111 -21.983 1.00 61.11 H new ATOM 0 HD21 ASN A 84 -19.216 -42.710 -22.942 1.00 3.45 H new ATOM 0 HD22 ASN A 84 -18.805 -41.148 -23.657 1.00 3.45 H new ATOM 1312 N GLN A 85 -23.807 -40.035 -21.028 1.00 14.34 N ATOM 1313 CA GLN A 85 -24.390 -40.307 -19.715 1.00 73.43 C ATOM 1314 C GLN A 85 -24.126 -41.756 -19.304 1.00 30.44 C ATOM 1315 O GLN A 85 -23.976 -42.061 -18.114 1.00 11.40 O ATOM 1316 CB GLN A 85 -25.905 -40.045 -19.745 1.00 62.01 C ATOM 1317 CG GLN A 85 -26.609 -40.331 -18.421 1.00 14.43 C ATOM 1318 CD GLN A 85 -28.119 -40.202 -18.517 1.00 52.52 C ATOM 1319 OE1 GLN A 85 -28.682 -39.129 -18.298 1.00 30.11 O ATOM 1320 NE2 GLN A 85 -28.789 -41.296 -18.853 1.00 22.33 N ATOM 0 H GLN A 85 -24.376 -40.353 -21.812 1.00 14.34 H new ATOM 0 HA GLN A 85 -23.925 -39.643 -18.986 1.00 73.43 H new ATOM 0 HB2 GLN A 85 -26.078 -39.005 -20.020 1.00 62.01 H new ATOM 0 HB3 GLN A 85 -26.355 -40.660 -20.525 1.00 62.01 H new ATOM 0 HG2 GLN A 85 -26.355 -41.338 -18.090 1.00 14.43 H new ATOM 0 HG3 GLN A 85 -26.238 -39.643 -17.661 1.00 14.43 H new ATOM 0 HE21 GLN A 85 -28.288 -42.167 -19.027 1.00 22.33 H new ATOM 0 HE22 GLN A 85 -29.805 -41.266 -18.938 1.00 22.33 H new ATOM 1329 N ASP A 86 -24.039 -42.634 -20.307 1.00 11.41 N ATOM 1330 CA ASP A 86 -23.964 -44.083 -20.088 1.00 44.11 C ATOM 1331 C ASP A 86 -22.940 -44.444 -19.015 1.00 63.32 C ATOM 1332 O ASP A 86 -23.239 -45.217 -18.105 1.00 33.14 O ATOM 1333 CB ASP A 86 -23.625 -44.807 -21.396 1.00 54.34 C ATOM 1334 CG ASP A 86 -23.601 -46.320 -21.229 1.00 51.54 C ATOM 1335 OD1 ASP A 86 -22.504 -46.917 -21.282 1.00 24.41 O ATOM 1336 OD2 ASP A 86 -24.682 -46.915 -21.038 1.00 5.23 O1- ATOM 0 H ASP A 86 -24.019 -42.363 -21.290 1.00 11.41 H new ATOM 0 HA ASP A 86 -24.944 -44.408 -19.739 1.00 44.11 H new ATOM 0 HB2 ASP A 86 -24.358 -44.539 -22.157 1.00 54.34 H new ATOM 0 HB3 ASP A 86 -22.653 -44.468 -21.755 1.00 54.34 H new ATOM 1341 N VAL A 87 -21.749 -43.856 -19.116 1.00 53.31 N ATOM 1342 CA VAL A 87 -20.660 -44.131 -18.176 1.00 43.31 C ATOM 1343 C VAL A 87 -21.119 -43.936 -16.726 1.00 71.01 C ATOM 1344 O VAL A 87 -20.801 -44.746 -15.845 1.00 44.23 O ATOM 1345 CB VAL A 87 -19.432 -43.225 -18.459 1.00 24.23 C ATOM 1346 CG1 VAL A 87 -18.306 -43.486 -17.458 1.00 42.44 C ATOM 1347 CG2 VAL A 87 -18.938 -43.423 -19.893 1.00 22.14 C ATOM 0 H VAL A 87 -21.511 -43.182 -19.844 1.00 53.31 H new ATOM 0 HA VAL A 87 -20.369 -45.172 -18.317 1.00 43.31 H new ATOM 0 HB VAL A 87 -19.747 -42.188 -18.341 1.00 24.23 H new ATOM 0 HG11 VAL A 87 -17.461 -42.836 -17.684 1.00 42.44 H new ATOM 0 HG12 VAL A 87 -18.662 -43.281 -16.448 1.00 42.44 H new ATOM 0 HG13 VAL A 87 -17.991 -44.527 -17.528 1.00 42.44 H new ATOM 0 HG21 VAL A 87 -18.077 -42.780 -20.073 1.00 22.14 H new ATOM 0 HG22 VAL A 87 -18.650 -44.464 -20.038 1.00 22.14 H new ATOM 0 HG23 VAL A 87 -19.735 -43.166 -20.591 1.00 22.14 H new ATOM 1357 N ALA A 88 -21.900 -42.883 -16.489 1.00 74.24 N ATOM 1358 CA ALA A 88 -22.378 -42.577 -15.144 1.00 11.24 C ATOM 1359 C ALA A 88 -23.296 -43.688 -14.647 1.00 40.14 C ATOM 1360 O ALA A 88 -23.201 -44.131 -13.498 1.00 31.23 O ATOM 1361 CB ALA A 88 -23.097 -41.230 -15.125 1.00 44.41 C ATOM 0 H ALA A 88 -22.213 -42.231 -17.208 1.00 74.24 H new ATOM 0 HA ALA A 88 -21.521 -42.512 -14.474 1.00 11.24 H new ATOM 0 HB1 ALA A 88 -23.446 -41.018 -14.114 1.00 44.41 H new ATOM 0 HB2 ALA A 88 -22.410 -40.446 -15.443 1.00 44.41 H new ATOM 0 HB3 ALA A 88 -23.949 -41.263 -15.804 1.00 44.41 H new ATOM 1367 N THR A 89 -24.162 -44.151 -15.540 1.00 43.13 N ATOM 1368 CA THR A 89 -25.105 -45.216 -15.226 1.00 3.03 C ATOM 1369 C THR A 89 -24.370 -46.541 -15.001 1.00 72.34 C ATOM 1370 O THR A 89 -24.786 -47.358 -14.179 1.00 54.24 O ATOM 1371 CB THR A 89 -26.138 -45.383 -16.364 1.00 23.32 C ATOM 1372 OG1 THR A 89 -26.619 -44.094 -16.774 1.00 72.42 O ATOM 1373 CG2 THR A 89 -27.319 -46.246 -15.923 1.00 3.52 C ATOM 0 H THR A 89 -24.230 -43.801 -16.496 1.00 43.13 H new ATOM 0 HA THR A 89 -25.627 -44.941 -14.310 1.00 3.03 H new ATOM 0 HB THR A 89 -25.642 -45.880 -17.198 1.00 23.32 H new ATOM 0 HG1 THR A 89 -27.272 -44.203 -17.496 1.00 72.42 H new ATOM 0 HG21 THR A 89 -28.026 -46.343 -16.747 1.00 3.52 H new ATOM 0 HG22 THR A 89 -26.960 -47.234 -15.635 1.00 3.52 H new ATOM 0 HG23 THR A 89 -27.815 -45.777 -15.073 1.00 3.52 H new ATOM 1381 N GLN A 90 -23.268 -46.734 -15.729 1.00 45.13 N ATOM 1382 CA GLN A 90 -22.461 -47.947 -15.607 1.00 11.14 C ATOM 1383 C GLN A 90 -21.810 -48.022 -14.230 1.00 24.42 C ATOM 1384 O GLN A 90 -21.909 -49.036 -13.536 1.00 33.43 O ATOM 1385 CB GLN A 90 -21.375 -47.994 -16.692 1.00 21.33 C ATOM 1386 CG GLN A 90 -21.911 -48.008 -18.118 1.00 23.40 C ATOM 1387 CD GLN A 90 -22.907 -49.129 -18.365 1.00 32.12 C ATOM 1388 OE1 GLN A 90 -22.530 -50.242 -18.735 1.00 31.51 O ATOM 1389 NE2 GLN A 90 -24.187 -48.843 -18.179 1.00 52.44 N ATOM 0 H GLN A 90 -22.914 -46.063 -16.411 1.00 45.13 H new ATOM 0 HA GLN A 90 -23.125 -48.802 -15.736 1.00 11.14 H new ATOM 0 HB2 GLN A 90 -20.720 -47.131 -16.571 1.00 21.33 H new ATOM 0 HB3 GLN A 90 -20.763 -48.883 -16.538 1.00 21.33 H new ATOM 0 HG2 GLN A 90 -22.388 -47.051 -18.331 1.00 23.40 H new ATOM 0 HG3 GLN A 90 -21.077 -48.110 -18.813 1.00 23.40 H new ATOM 0 HE21 GLN A 90 -24.462 -47.910 -17.872 1.00 52.44 H new ATOM 0 HE22 GLN A 90 -24.898 -49.556 -18.343 1.00 52.44 H new ATOM 1398 N TYR A 91 -21.137 -46.943 -13.844 1.00 23.00 N ATOM 1399 CA TYR A 91 -20.483 -46.873 -12.539 1.00 63.04 C ATOM 1400 C TYR A 91 -21.517 -46.664 -11.434 1.00 53.41 C ATOM 1401 O TYR A 91 -21.234 -46.888 -10.255 1.00 53.15 O ATOM 1402 CB TYR A 91 -19.425 -45.760 -12.527 1.00 50.03 C ATOM 1403 CG TYR A 91 -18.195 -46.086 -13.362 1.00 40.41 C ATOM 1404 CD1 TYR A 91 -17.000 -46.466 -12.759 1.00 1.24 C ATOM 1405 CD2 TYR A 91 -18.234 -46.029 -14.751 1.00 62.23 C ATOM 1406 CE1 TYR A 91 -15.884 -46.770 -13.514 1.00 31.01 C ATOM 1407 CE2 TYR A 91 -17.122 -46.332 -15.512 1.00 43.30 C ATOM 1408 CZ TYR A 91 -15.950 -46.704 -14.889 1.00 51.11 C ATOM 1409 OH TYR A 91 -14.838 -47.006 -15.642 1.00 21.33 O ATOM 0 H TYR A 91 -21.029 -46.105 -14.415 1.00 23.00 H new ATOM 0 HA TYR A 91 -19.976 -47.820 -12.351 1.00 63.04 H new ATOM 0 HB2 TYR A 91 -19.873 -44.839 -12.899 1.00 50.03 H new ATOM 0 HB3 TYR A 91 -19.117 -45.572 -11.498 1.00 50.03 H new ATOM 0 HD1 TYR A 91 -16.944 -46.524 -11.682 1.00 1.24 H new ATOM 0 HD2 TYR A 91 -19.151 -45.742 -15.244 1.00 62.23 H new ATOM 0 HE1 TYR A 91 -14.963 -47.058 -13.029 1.00 31.01 H new ATOM 0 HE2 TYR A 91 -17.170 -46.278 -16.590 1.00 43.30 H new ATOM 0 HH TYR A 91 -15.052 -46.912 -16.594 1.00 21.33 H new ATOM 1419 N GLY A 92 -22.715 -46.231 -11.824 1.00 22.12 N ATOM 1420 CA GLY A 92 -23.817 -46.132 -10.884 1.00 65.55 C ATOM 1421 C GLY A 92 -23.683 -44.945 -9.957 1.00 41.00 C ATOM 1422 O GLY A 92 -23.890 -45.065 -8.747 1.00 12.12 O ATOM 0 H GLY A 92 -22.941 -45.947 -12.777 1.00 22.12 H new ATOM 0 HA2 GLY A 92 -24.754 -46.055 -11.435 1.00 65.55 H new ATOM 0 HA3 GLY A 92 -23.869 -47.046 -10.293 1.00 65.55 H new ATOM 1426 N VAL A 93 -23.334 -43.794 -10.525 1.00 13.51 N ATOM 1427 CA VAL A 93 -23.207 -42.571 -9.744 1.00 13.34 C ATOM 1428 C VAL A 93 -24.527 -42.253 -9.045 1.00 30.02 C ATOM 1429 O VAL A 93 -25.527 -41.930 -9.691 1.00 73.22 O ATOM 1430 CB VAL A 93 -22.781 -41.365 -10.613 1.00 53.43 C ATOM 1431 CG1 VAL A 93 -22.699 -40.100 -9.759 1.00 75.31 C ATOM 1432 CG2 VAL A 93 -21.447 -41.643 -11.309 1.00 13.21 C ATOM 0 H VAL A 93 -23.135 -43.684 -11.519 1.00 13.51 H new ATOM 0 HA VAL A 93 -22.426 -42.743 -9.004 1.00 13.34 H new ATOM 0 HB VAL A 93 -23.535 -41.210 -11.385 1.00 53.43 H new ATOM 0 HG11 VAL A 93 -22.398 -39.259 -10.383 1.00 75.31 H new ATOM 0 HG12 VAL A 93 -23.675 -39.894 -9.319 1.00 75.31 H new ATOM 0 HG13 VAL A 93 -21.966 -40.244 -8.965 1.00 75.31 H new ATOM 0 HG21 VAL A 93 -21.166 -40.782 -11.915 1.00 13.21 H new ATOM 0 HG22 VAL A 93 -20.677 -41.826 -10.560 1.00 13.21 H new ATOM 0 HG23 VAL A 93 -21.546 -42.520 -11.949 1.00 13.21 H new ATOM 1442 N SER A 94 -24.527 -42.383 -7.728 1.00 15.51 N ATOM 1443 CA SER A 94 -25.716 -42.138 -6.926 1.00 63.12 C ATOM 1444 C SER A 94 -25.842 -40.654 -6.573 1.00 52.01 C ATOM 1445 O SER A 94 -26.946 -40.111 -6.507 1.00 33.01 O ATOM 1446 CB SER A 94 -25.645 -42.983 -5.657 1.00 45.35 C ATOM 1447 OG SER A 94 -25.453 -44.352 -5.977 1.00 22.42 O ATOM 0 H SER A 94 -23.708 -42.660 -7.187 1.00 15.51 H new ATOM 0 HA SER A 94 -26.598 -42.417 -7.503 1.00 63.12 H new ATOM 0 HB2 SER A 94 -24.827 -42.634 -5.027 1.00 45.35 H new ATOM 0 HB3 SER A 94 -26.564 -42.864 -5.083 1.00 45.35 H new ATOM 0 HG SER A 94 -25.408 -44.878 -5.151 1.00 22.42 H new ATOM 1453 N ALA A 95 -24.704 -40.002 -6.361 1.00 12.01 N ATOM 1454 CA ALA A 95 -24.683 -38.597 -5.977 1.00 52.44 C ATOM 1455 C ALA A 95 -23.458 -37.916 -6.566 1.00 22.24 C ATOM 1456 O ALA A 95 -22.464 -38.572 -6.871 1.00 22.21 O ATOM 1457 CB ALA A 95 -24.701 -38.461 -4.456 1.00 0.24 C ATOM 0 H ALA A 95 -23.781 -40.427 -6.449 1.00 12.01 H new ATOM 0 HA ALA A 95 -25.574 -38.108 -6.371 1.00 52.44 H new ATOM 0 HB1 ALA A 95 -24.685 -37.405 -4.185 1.00 0.24 H new ATOM 0 HB2 ALA A 95 -25.605 -38.924 -4.060 1.00 0.24 H new ATOM 0 HB3 ALA A 95 -23.826 -38.957 -4.036 1.00 0.24 H new ATOM 1463 N ILE A 96 -23.536 -36.605 -6.720 1.00 40.13 N ATOM 1464 CA ILE A 96 -22.458 -35.829 -7.317 1.00 41.53 C ATOM 1465 C ILE A 96 -21.870 -34.866 -6.283 1.00 24.21 C ATOM 1466 O ILE A 96 -22.600 -34.356 -5.432 1.00 22.54 O ATOM 1467 CB ILE A 96 -22.931 -35.036 -8.574 1.00 44.03 C ATOM 1468 CG1 ILE A 96 -24.122 -34.101 -8.254 1.00 70.20 C ATOM 1469 CG2 ILE A 96 -23.289 -35.991 -9.710 1.00 72.40 C ATOM 1470 CD1 ILE A 96 -25.454 -34.806 -8.058 1.00 75.51 C ATOM 0 H ILE A 96 -24.343 -36.049 -6.437 1.00 40.13 H new ATOM 0 HA ILE A 96 -21.691 -36.532 -7.642 1.00 41.53 H new ATOM 0 HB ILE A 96 -22.100 -34.407 -8.893 1.00 44.03 H new ATOM 0 HG12 ILE A 96 -23.890 -33.537 -7.351 1.00 70.20 H new ATOM 0 HG13 ILE A 96 -24.226 -33.378 -9.063 1.00 70.20 H new ATOM 0 HG21 ILE A 96 -23.617 -35.418 -10.577 1.00 72.40 H new ATOM 0 HG22 ILE A 96 -22.414 -36.584 -9.976 1.00 72.40 H new ATOM 0 HG23 ILE A 96 -24.092 -36.654 -9.389 1.00 72.40 H new ATOM 0 HD11 ILE A 96 -26.227 -34.069 -7.838 1.00 75.51 H new ATOM 0 HD12 ILE A 96 -25.716 -35.347 -8.967 1.00 75.51 H new ATOM 0 HD13 ILE A 96 -25.375 -35.508 -7.228 1.00 75.51 H new ATOM 1482 N PRO A 97 -20.543 -34.611 -6.323 1.00 41.14 N ATOM 1483 CA PRO A 97 -19.616 -35.215 -7.294 1.00 50.44 C ATOM 1484 C PRO A 97 -19.239 -36.658 -6.932 1.00 2.04 C ATOM 1485 O PRO A 97 -19.606 -37.170 -5.868 1.00 63.12 O ATOM 1486 CB PRO A 97 -18.373 -34.294 -7.239 1.00 4.13 C ATOM 1487 CG PRO A 97 -18.732 -33.175 -6.307 1.00 64.14 C ATOM 1488 CD PRO A 97 -19.835 -33.695 -5.428 1.00 35.15 C ATOM 0 HA PRO A 97 -20.062 -35.284 -8.286 1.00 50.44 H new ATOM 0 HB2 PRO A 97 -17.500 -34.838 -6.879 1.00 4.13 H new ATOM 0 HB3 PRO A 97 -18.125 -33.913 -8.230 1.00 4.13 H new ATOM 0 HG2 PRO A 97 -17.870 -32.873 -5.712 1.00 64.14 H new ATOM 0 HG3 PRO A 97 -19.059 -32.296 -6.863 1.00 64.14 H new ATOM 0 HD2 PRO A 97 -19.446 -34.207 -4.548 1.00 35.15 H new ATOM 0 HD3 PRO A 97 -20.482 -32.894 -5.071 1.00 35.15 H new ATOM 1496 N THR A 98 -18.516 -37.306 -7.835 1.00 51.24 N ATOM 1497 CA THR A 98 -18.058 -38.679 -7.644 1.00 74.00 C ATOM 1498 C THR A 98 -16.619 -38.820 -8.127 1.00 5.01 C ATOM 1499 O THR A 98 -16.302 -38.454 -9.259 1.00 43.51 O ATOM 1500 CB THR A 98 -18.974 -39.680 -8.392 1.00 21.00 C ATOM 1501 OG1 THR A 98 -20.268 -39.712 -7.774 1.00 33.40 O ATOM 1502 CG2 THR A 98 -18.385 -41.089 -8.412 1.00 73.42 C ATOM 0 H THR A 98 -18.229 -36.895 -8.723 1.00 51.24 H new ATOM 0 HA THR A 98 -18.103 -38.910 -6.580 1.00 74.00 H new ATOM 0 HB THR A 98 -19.060 -39.338 -9.423 1.00 21.00 H new ATOM 0 HG1 THR A 98 -20.679 -38.824 -7.829 1.00 33.40 H new ATOM 0 HG21 THR A 98 -19.060 -41.758 -8.946 1.00 73.42 H new ATOM 0 HG22 THR A 98 -17.418 -41.072 -8.914 1.00 73.42 H new ATOM 0 HG23 THR A 98 -18.256 -41.444 -7.390 1.00 73.42 H new ATOM 1510 N ILE A 99 -15.753 -39.344 -7.262 1.00 33.32 N ATOM 1511 CA ILE A 99 -14.333 -39.472 -7.565 1.00 62.41 C ATOM 1512 C ILE A 99 -13.943 -40.940 -7.754 1.00 30.42 C ATOM 1513 O ILE A 99 -13.965 -41.734 -6.805 1.00 23.12 O ATOM 1514 CB ILE A 99 -13.465 -38.852 -6.440 1.00 11.51 C ATOM 1515 CG1 ILE A 99 -13.783 -37.355 -6.264 1.00 44.42 C ATOM 1516 CG2 ILE A 99 -11.977 -39.059 -6.724 1.00 43.23 C ATOM 1517 CD1 ILE A 99 -13.481 -36.503 -7.481 1.00 13.43 C ATOM 0 H ILE A 99 -16.015 -39.689 -6.339 1.00 33.32 H new ATOM 0 HA ILE A 99 -14.150 -38.932 -8.494 1.00 62.41 H new ATOM 0 HB ILE A 99 -13.707 -39.362 -5.508 1.00 11.51 H new ATOM 0 HG12 ILE A 99 -14.838 -37.247 -6.013 1.00 44.42 H new ATOM 0 HG13 ILE A 99 -13.213 -36.972 -5.417 1.00 44.42 H new ATOM 0 HG21 ILE A 99 -11.388 -38.616 -5.921 1.00 43.23 H new ATOM 0 HG22 ILE A 99 -11.763 -40.126 -6.784 1.00 43.23 H new ATOM 0 HG23 ILE A 99 -11.717 -38.583 -7.670 1.00 43.23 H new ATOM 0 HD11 ILE A 99 -13.734 -35.464 -7.270 1.00 13.43 H new ATOM 0 HD12 ILE A 99 -12.421 -36.576 -7.722 1.00 13.43 H new ATOM 0 HD13 ILE A 99 -14.071 -36.855 -8.327 1.00 13.43 H new ATOM 1529 N LEU A 100 -13.621 -41.289 -8.995 1.00 43.14 N ATOM 1530 CA LEU A 100 -13.116 -42.615 -9.346 1.00 54.31 C ATOM 1531 C LEU A 100 -11.594 -42.619 -9.262 1.00 72.51 C ATOM 1532 O LEU A 100 -10.942 -41.811 -9.912 1.00 11.02 O ATOM 1533 CB LEU A 100 -13.547 -42.990 -10.782 1.00 62.44 C ATOM 1534 CG LEU A 100 -15.041 -43.300 -10.991 1.00 2.41 C ATOM 1535 CD1 LEU A 100 -15.437 -44.562 -10.240 1.00 3.04 C ATOM 1536 CD2 LEU A 100 -15.906 -42.124 -10.568 1.00 53.13 C ATOM 0 H LEU A 100 -13.703 -40.657 -9.792 1.00 43.14 H new ATOM 0 HA LEU A 100 -13.528 -43.344 -8.648 1.00 54.31 H new ATOM 0 HB2 LEU A 100 -13.272 -42.170 -11.446 1.00 62.44 H new ATOM 0 HB3 LEU A 100 -12.971 -43.861 -11.095 1.00 62.44 H new ATOM 0 HG LEU A 100 -15.206 -43.470 -12.055 1.00 2.41 H new ATOM 0 HD11 LEU A 100 -16.496 -44.764 -10.400 1.00 3.04 H new ATOM 0 HD12 LEU A 100 -14.848 -45.403 -10.606 1.00 3.04 H new ATOM 0 HD13 LEU A 100 -15.251 -44.425 -9.175 1.00 3.04 H new ATOM 0 HD21 LEU A 100 -16.956 -42.369 -10.726 1.00 53.13 H new ATOM 0 HD22 LEU A 100 -15.738 -41.910 -9.512 1.00 53.13 H new ATOM 0 HD23 LEU A 100 -15.645 -41.248 -11.162 1.00 53.13 H new ATOM 1548 N MET A 101 -11.027 -43.514 -8.470 1.00 11.43 N ATOM 1549 CA MET A 101 -9.576 -43.612 -8.365 1.00 4.10 C ATOM 1550 C MET A 101 -9.056 -44.640 -9.367 1.00 43.12 C ATOM 1551 O MET A 101 -9.645 -45.714 -9.528 1.00 65.12 O ATOM 1552 CB MET A 101 -9.154 -44.003 -6.937 1.00 31.24 C ATOM 1553 CG MET A 101 -9.602 -43.021 -5.864 1.00 63.31 C ATOM 1554 SD MET A 101 -8.613 -41.519 -5.806 1.00 12.02 S ATOM 1555 CE MET A 101 -9.265 -40.787 -4.309 1.00 54.53 C ATOM 0 H MET A 101 -11.542 -44.179 -7.894 1.00 11.43 H new ATOM 0 HA MET A 101 -9.145 -42.637 -8.591 1.00 4.10 H new ATOM 0 HB2 MET A 101 -9.562 -44.987 -6.706 1.00 31.24 H new ATOM 0 HB3 MET A 101 -8.068 -44.092 -6.902 1.00 31.24 H new ATOM 0 HG2 MET A 101 -10.644 -42.754 -6.040 1.00 63.31 H new ATOM 0 HG3 MET A 101 -9.559 -43.513 -4.892 1.00 63.31 H new ATOM 0 HE1 MET A 101 -9.682 -39.806 -4.535 1.00 54.53 H new ATOM 0 HE2 MET A 101 -10.047 -41.428 -3.901 1.00 54.53 H new ATOM 0 HE3 MET A 101 -8.464 -40.681 -3.577 1.00 54.53 H new ATOM 1565 N PHE A 102 -7.974 -44.291 -10.052 1.00 13.11 N ATOM 1566 CA PHE A 102 -7.254 -45.200 -10.945 1.00 71.35 C ATOM 1567 C PHE A 102 -5.764 -44.935 -10.794 1.00 34.00 C ATOM 1568 O PHE A 102 -5.358 -43.787 -10.619 1.00 61.02 O ATOM 1569 CB PHE A 102 -7.682 -45.005 -12.411 1.00 21.10 C ATOM 1570 CG PHE A 102 -9.133 -45.332 -12.673 1.00 2.32 C ATOM 1571 CD1 PHE A 102 -10.064 -44.324 -12.891 1.00 2.42 C ATOM 1572 CD2 PHE A 102 -9.566 -46.652 -12.702 1.00 24.22 C ATOM 1573 CE1 PHE A 102 -11.391 -44.625 -13.132 1.00 61.40 C ATOM 1574 CE2 PHE A 102 -10.894 -46.957 -12.942 1.00 73.14 C ATOM 1575 CZ PHE A 102 -11.805 -45.942 -13.158 1.00 3.41 C ATOM 0 H PHE A 102 -7.564 -43.358 -10.005 1.00 13.11 H new ATOM 0 HA PHE A 102 -7.488 -46.229 -10.674 1.00 71.35 H new ATOM 0 HB2 PHE A 102 -7.495 -43.971 -12.699 1.00 21.10 H new ATOM 0 HB3 PHE A 102 -7.058 -45.631 -13.048 1.00 21.10 H new ATOM 0 HD1 PHE A 102 -9.746 -43.292 -12.872 1.00 2.42 H new ATOM 0 HD2 PHE A 102 -8.857 -47.450 -12.535 1.00 24.22 H new ATOM 0 HE1 PHE A 102 -12.104 -43.831 -13.300 1.00 61.40 H new ATOM 0 HE2 PHE A 102 -11.218 -47.987 -12.960 1.00 73.14 H new ATOM 0 HZ PHE A 102 -12.842 -46.178 -13.347 1.00 3.41 H new ATOM 1585 N LYS A 103 -4.939 -45.975 -10.842 1.00 14.01 N ATOM 1586 CA LYS A 103 -3.504 -45.790 -10.609 1.00 2.12 C ATOM 1587 C LYS A 103 -2.689 -46.773 -11.436 1.00 22.12 C ATOM 1588 O LYS A 103 -2.940 -47.978 -11.401 1.00 72.21 O ATOM 1589 CB LYS A 103 -3.206 -45.941 -9.108 1.00 74.24 C ATOM 1590 CG LYS A 103 -1.762 -45.646 -8.697 1.00 43.03 C ATOM 1591 CD LYS A 103 -1.657 -45.290 -7.210 1.00 41.12 C ATOM 1592 CE LYS A 103 -2.221 -46.380 -6.303 1.00 53.33 C ATOM 1593 NZ LYS A 103 -1.385 -47.610 -6.307 1.00 71.52 N1+ ATOM 0 H LYS A 103 -5.226 -46.935 -11.035 1.00 14.01 H new ATOM 0 HA LYS A 103 -3.216 -44.787 -10.924 1.00 2.12 H new ATOM 0 HB2 LYS A 103 -3.868 -45.275 -8.554 1.00 74.24 H new ATOM 0 HB3 LYS A 103 -3.452 -46.959 -8.806 1.00 74.24 H new ATOM 0 HG2 LYS A 103 -1.139 -46.515 -8.908 1.00 43.03 H new ATOM 0 HG3 LYS A 103 -1.374 -44.823 -9.297 1.00 43.03 H new ATOM 0 HD2 LYS A 103 -0.612 -45.116 -6.955 1.00 41.12 H new ATOM 0 HD3 LYS A 103 -2.190 -44.357 -7.025 1.00 41.12 H new ATOM 0 HE2 LYS A 103 -2.296 -45.999 -5.285 1.00 53.33 H new ATOM 0 HE3 LYS A 103 -3.232 -46.630 -6.625 1.00 53.33 H new ATOM 0 HZ1 LYS A 103 -1.809 -48.320 -5.677 1.00 71.52 H new ATOM 0 HZ2 LYS A 103 -1.333 -47.992 -7.273 1.00 71.52 H new ATOM 0 HZ3 LYS A 103 -0.427 -47.380 -5.974 1.00 71.52 H new ATOM 1607 N ASN A 104 -1.733 -46.236 -12.199 1.00 41.43 N ATOM 1608 CA ASN A 104 -0.885 -47.038 -13.087 1.00 72.22 C ATOM 1609 C ASN A 104 -1.750 -47.698 -14.166 1.00 0.14 C ATOM 1610 O ASN A 104 -1.390 -48.724 -14.744 1.00 72.20 O ATOM 1611 CB ASN A 104 -0.111 -48.094 -12.274 1.00 20.21 C ATOM 1612 CG ASN A 104 1.005 -48.768 -13.063 1.00 24.30 C ATOM 1613 OD1 ASN A 104 2.143 -48.299 -13.074 1.00 10.43 O ATOM 1614 ND2 ASN A 104 0.692 -49.876 -13.719 1.00 31.24 N ATOM 0 H ASN A 104 -1.525 -45.238 -12.219 1.00 41.43 H new ATOM 0 HA ASN A 104 -0.156 -46.391 -13.575 1.00 72.22 H new ATOM 0 HB2 ASN A 104 0.315 -47.620 -11.389 1.00 20.21 H new ATOM 0 HB3 ASN A 104 -0.809 -48.855 -11.924 1.00 20.21 H new ATOM 0 HD21 ASN A 104 1.405 -50.370 -14.256 1.00 31.24 H new ATOM 0 HD22 ASN A 104 -0.262 -50.235 -13.687 1.00 31.24 H new ATOM 1621 N GLY A 105 -2.889 -47.066 -14.449 1.00 32.31 N ATOM 1622 CA GLY A 105 -3.845 -47.615 -15.396 1.00 42.31 C ATOM 1623 C GLY A 105 -4.526 -48.857 -14.857 1.00 34.43 C ATOM 1624 O GLY A 105 -5.087 -49.645 -15.616 1.00 43.11 O ATOM 0 H GLY A 105 -3.167 -46.176 -14.035 1.00 32.31 H new ATOM 0 HA2 GLY A 105 -4.597 -46.862 -15.630 1.00 42.31 H new ATOM 0 HA3 GLY A 105 -3.334 -47.857 -16.328 1.00 42.31 H new ATOM 1628 N LYS A 106 -4.480 -49.026 -13.538 1.00 12.22 N ATOM 1629 CA LYS A 106 -5.056 -50.196 -12.883 1.00 63.04 C ATOM 1630 C LYS A 106 -6.178 -49.781 -11.931 1.00 35.11 C ATOM 1631 O LYS A 106 -6.189 -48.642 -11.429 1.00 44.30 O ATOM 1632 CB LYS A 106 -3.956 -50.971 -12.137 1.00 13.01 C ATOM 1633 CG LYS A 106 -4.455 -52.197 -11.376 1.00 24.15 C ATOM 1634 CD LYS A 106 -3.304 -53.080 -10.897 1.00 53.23 C ATOM 1635 CE LYS A 106 -2.304 -52.315 -10.038 1.00 13.04 C ATOM 1636 NZ LYS A 106 -1.140 -53.160 -9.657 1.00 41.10 N1+ ATOM 0 H LYS A 106 -4.046 -48.361 -12.898 1.00 12.22 H new ATOM 0 HA LYS A 106 -5.488 -50.850 -13.640 1.00 63.04 H new ATOM 0 HB2 LYS A 106 -3.200 -51.287 -12.856 1.00 13.01 H new ATOM 0 HB3 LYS A 106 -3.466 -50.297 -11.435 1.00 13.01 H new ATOM 0 HG2 LYS A 106 -5.047 -51.876 -10.519 1.00 24.15 H new ATOM 0 HG3 LYS A 106 -5.115 -52.779 -12.019 1.00 24.15 H new ATOM 0 HD2 LYS A 106 -3.705 -53.917 -10.325 1.00 53.23 H new ATOM 0 HD3 LYS A 106 -2.789 -53.502 -11.760 1.00 53.23 H new ATOM 0 HE2 LYS A 106 -1.953 -51.438 -10.583 1.00 13.04 H new ATOM 0 HE3 LYS A 106 -2.801 -51.953 -9.138 1.00 13.04 H new ATOM 0 HZ1 LYS A 106 -0.483 -52.603 -9.074 1.00 41.10 H new ATOM 0 HZ2 LYS A 106 -1.471 -53.984 -9.115 1.00 41.10 H new ATOM 0 HZ3 LYS A 106 -0.651 -53.484 -10.515 1.00 41.10 H new ATOM 1650 N LYS A 107 -7.112 -50.713 -11.700 1.00 44.23 N ATOM 1651 CA LYS A 107 -8.295 -50.472 -10.876 1.00 71.41 C ATOM 1652 C LYS A 107 -7.918 -50.001 -9.471 1.00 52.45 C ATOM 1653 O LYS A 107 -6.987 -50.521 -8.854 1.00 11.33 O ATOM 1654 CB LYS A 107 -9.161 -51.740 -10.792 1.00 63.10 C ATOM 1655 CG LYS A 107 -10.496 -51.526 -10.074 1.00 42.24 C ATOM 1656 CD LYS A 107 -11.415 -50.569 -10.841 1.00 71.43 C ATOM 1657 CE LYS A 107 -11.881 -51.166 -12.166 1.00 14.53 C ATOM 1658 NZ LYS A 107 -12.689 -50.205 -12.966 1.00 70.01 N1+ ATOM 0 H LYS A 107 -7.065 -51.657 -12.083 1.00 44.23 H new ATOM 0 HA LYS A 107 -8.869 -49.678 -11.353 1.00 71.41 H new ATOM 0 HB2 LYS A 107 -9.355 -52.104 -11.801 1.00 63.10 H new ATOM 0 HB3 LYS A 107 -8.601 -52.519 -10.274 1.00 63.10 H new ATOM 0 HG2 LYS A 107 -10.997 -52.486 -9.947 1.00 42.24 H new ATOM 0 HG3 LYS A 107 -10.311 -51.129 -9.076 1.00 42.24 H new ATOM 0 HD2 LYS A 107 -12.282 -50.328 -10.226 1.00 71.43 H new ATOM 0 HD3 LYS A 107 -10.888 -49.633 -11.030 1.00 71.43 H new ATOM 0 HE2 LYS A 107 -11.013 -51.479 -12.746 1.00 14.53 H new ATOM 0 HE3 LYS A 107 -12.473 -52.060 -11.971 1.00 14.53 H new ATOM 0 HZ1 LYS A 107 -13.399 -50.725 -13.519 1.00 70.01 H new ATOM 0 HZ2 LYS A 107 -13.168 -49.538 -12.327 1.00 70.01 H new ATOM 0 HZ3 LYS A 107 -12.065 -49.679 -13.611 1.00 70.01 H new ATOM 1672 N LEU A 108 -8.689 -49.041 -8.981 1.00 60.01 N ATOM 1673 CA LEU A 108 -8.412 -48.315 -7.747 1.00 60.42 C ATOM 1674 C LEU A 108 -9.743 -47.889 -7.118 1.00 41.03 C ATOM 1675 O LEU A 108 -10.799 -48.029 -7.746 1.00 12.22 O ATOM 1676 CB LEU A 108 -7.473 -47.113 -7.977 1.00 52.31 C ATOM 1677 CG LEU A 108 -6.090 -47.202 -7.302 1.00 61.41 C ATOM 1678 CD1 LEU A 108 -6.227 -47.394 -5.798 1.00 21.14 C ATOM 1679 CD2 LEU A 108 -5.255 -48.327 -7.902 1.00 11.12 C ATOM 0 H LEU A 108 -9.547 -48.737 -9.441 1.00 60.01 H new ATOM 0 HA LEU A 108 -7.883 -48.974 -7.058 1.00 60.42 H new ATOM 0 HB2 LEU A 108 -7.325 -46.992 -9.050 1.00 52.31 H new ATOM 0 HB3 LEU A 108 -7.973 -46.212 -7.620 1.00 52.31 H new ATOM 0 HG LEU A 108 -5.576 -46.258 -7.485 1.00 61.41 H new ATOM 0 HD11 LEU A 108 -5.236 -47.454 -5.347 1.00 21.14 H new ATOM 0 HD12 LEU A 108 -6.770 -46.550 -5.371 1.00 21.14 H new ATOM 0 HD13 LEU A 108 -6.773 -48.316 -5.597 1.00 21.14 H new ATOM 0 HD21 LEU A 108 -4.285 -48.365 -7.406 1.00 11.12 H new ATOM 0 HD22 LEU A 108 -5.771 -49.277 -7.763 1.00 11.12 H new ATOM 0 HD23 LEU A 108 -5.111 -48.145 -8.967 1.00 11.12 H new ATOM 1691 N SER A 109 -9.695 -47.428 -5.877 1.00 60.43 N ATOM 1692 CA SER A 109 -10.885 -47.245 -5.044 1.00 11.20 C ATOM 1693 C SER A 109 -11.771 -46.078 -5.513 1.00 20.34 C ATOM 1694 O SER A 109 -11.531 -45.480 -6.556 1.00 72.41 O ATOM 1695 CB SER A 109 -10.410 -46.974 -3.617 1.00 32.42 C ATOM 1696 OG SER A 109 -9.874 -48.149 -3.025 1.00 42.25 O ATOM 0 H SER A 109 -8.825 -47.167 -5.412 1.00 60.43 H new ATOM 0 HA SER A 109 -11.494 -48.147 -5.111 1.00 11.20 H new ATOM 0 HB2 SER A 109 -9.653 -46.189 -3.625 1.00 32.42 H new ATOM 0 HB3 SER A 109 -11.243 -46.608 -3.017 1.00 32.42 H new ATOM 0 HG SER A 109 -9.576 -47.949 -2.113 1.00 42.25 H new ATOM 1702 N GLN A 110 -12.844 -45.807 -4.771 1.00 61.23 N ATOM 1703 CA GLN A 110 -13.812 -44.790 -5.174 1.00 74.54 C ATOM 1704 C GLN A 110 -14.400 -44.077 -3.956 1.00 60.21 C ATOM 1705 O GLN A 110 -14.538 -44.675 -2.887 1.00 10.33 O ATOM 1706 CB GLN A 110 -14.939 -45.447 -5.982 1.00 11.44 C ATOM 1707 CG GLN A 110 -15.875 -44.459 -6.671 1.00 71.21 C ATOM 1708 CD GLN A 110 -17.042 -45.144 -7.363 1.00 13.41 C ATOM 1709 OE1 GLN A 110 -16.946 -46.308 -7.762 1.00 25.31 O ATOM 1710 NE2 GLN A 110 -18.131 -44.417 -7.552 1.00 4.42 N ATOM 0 H GLN A 110 -13.064 -46.275 -3.892 1.00 61.23 H new ATOM 0 HA GLN A 110 -13.299 -44.050 -5.788 1.00 74.54 H new ATOM 0 HB2 GLN A 110 -14.497 -46.098 -6.737 1.00 11.44 H new ATOM 0 HB3 GLN A 110 -15.525 -46.081 -5.317 1.00 11.44 H new ATOM 0 HG2 GLN A 110 -16.258 -43.753 -5.934 1.00 71.21 H new ATOM 0 HG3 GLN A 110 -15.312 -43.881 -7.404 1.00 71.21 H new ATOM 0 HE21 GLN A 110 -18.170 -43.458 -7.206 1.00 4.42 H new ATOM 0 HE22 GLN A 110 -18.931 -44.815 -8.043 1.00 4.42 H new ATOM 1719 N VAL A 111 -14.740 -42.799 -4.128 1.00 70.11 N ATOM 1720 CA VAL A 111 -15.430 -42.024 -3.094 1.00 60.35 C ATOM 1721 C VAL A 111 -16.542 -41.184 -3.728 1.00 22.32 C ATOM 1722 O VAL A 111 -16.315 -40.480 -4.715 1.00 33.31 O ATOM 1723 CB VAL A 111 -14.463 -41.098 -2.297 1.00 32.14 C ATOM 1724 CG1 VAL A 111 -13.539 -41.913 -1.394 1.00 22.02 C ATOM 1725 CG2 VAL A 111 -13.638 -40.222 -3.236 1.00 44.03 C ATOM 0 H VAL A 111 -14.547 -42.274 -4.981 1.00 70.11 H new ATOM 0 HA VAL A 111 -15.854 -42.737 -2.387 1.00 60.35 H new ATOM 0 HB VAL A 111 -15.077 -40.450 -1.671 1.00 32.14 H new ATOM 0 HG11 VAL A 111 -12.876 -41.240 -0.850 1.00 22.02 H new ATOM 0 HG12 VAL A 111 -14.136 -42.486 -0.684 1.00 22.02 H new ATOM 0 HG13 VAL A 111 -12.945 -42.595 -2.002 1.00 22.02 H new ATOM 0 HG21 VAL A 111 -12.973 -39.587 -2.651 1.00 44.03 H new ATOM 0 HG22 VAL A 111 -13.046 -40.855 -3.898 1.00 44.03 H new ATOM 0 HG23 VAL A 111 -14.305 -39.598 -3.831 1.00 44.03 H new ATOM 1735 N ILE A 112 -17.750 -41.297 -3.182 1.00 51.33 N ATOM 1736 CA ILE A 112 -18.904 -40.536 -3.661 1.00 62.14 C ATOM 1737 C ILE A 112 -19.383 -39.564 -2.584 1.00 15.21 C ATOM 1738 O ILE A 112 -19.440 -39.914 -1.400 1.00 22.02 O ATOM 1739 CB ILE A 112 -20.084 -41.469 -4.057 1.00 32.24 C ATOM 1740 CG1 ILE A 112 -19.659 -42.439 -5.170 1.00 3.11 C ATOM 1741 CG2 ILE A 112 -21.300 -40.648 -4.497 1.00 52.53 C ATOM 1742 CD1 ILE A 112 -20.747 -43.412 -5.590 1.00 61.34 C ATOM 0 H ILE A 112 -17.958 -41.916 -2.398 1.00 51.33 H new ATOM 0 HA ILE A 112 -18.582 -39.986 -4.545 1.00 62.14 H new ATOM 0 HB ILE A 112 -20.364 -42.053 -3.180 1.00 32.24 H new ATOM 0 HG12 ILE A 112 -19.346 -41.862 -6.040 1.00 3.11 H new ATOM 0 HG13 ILE A 112 -18.790 -43.005 -4.833 1.00 3.11 H new ATOM 0 HG21 ILE A 112 -22.114 -41.320 -4.770 1.00 52.53 H new ATOM 0 HG22 ILE A 112 -21.620 -40.004 -3.678 1.00 52.53 H new ATOM 0 HG23 ILE A 112 -21.033 -40.034 -5.357 1.00 52.53 H new ATOM 0 HD11 ILE A 112 -20.369 -44.062 -6.379 1.00 61.34 H new ATOM 0 HD12 ILE A 112 -21.045 -44.016 -4.733 1.00 61.34 H new ATOM 0 HD13 ILE A 112 -21.609 -42.857 -5.960 1.00 61.34 H new ATOM 1754 N GLY A 113 -19.722 -38.348 -2.998 1.00 41.41 N ATOM 1755 CA GLY A 113 -20.250 -37.360 -2.074 1.00 14.45 C ATOM 1756 C GLY A 113 -19.253 -36.257 -1.783 1.00 3.03 C ATOM 1757 O GLY A 113 -18.050 -36.415 -2.009 1.00 60.32 O ATOM 0 H GLY A 113 -19.640 -38.027 -3.963 1.00 41.41 H new ATOM 0 HA2 GLY A 113 -21.159 -36.925 -2.490 1.00 14.45 H new ATOM 0 HA3 GLY A 113 -20.529 -37.850 -1.141 1.00 14.45 H new ATOM 1761 N ALA A 114 -19.753 -35.139 -1.276 1.00 12.52 N ATOM 1762 CA ALA A 114 -18.913 -33.992 -0.965 1.00 24.52 C ATOM 1763 C ALA A 114 -18.257 -34.163 0.405 1.00 0.33 C ATOM 1764 O ALA A 114 -18.797 -33.727 1.423 1.00 33.13 O ATOM 1765 CB ALA A 114 -19.734 -32.704 -1.019 1.00 15.11 C ATOM 0 H ALA A 114 -20.743 -35.002 -1.070 1.00 12.52 H new ATOM 0 HA ALA A 114 -18.122 -33.926 -1.712 1.00 24.52 H new ATOM 0 HB1 ALA A 114 -19.093 -31.854 -0.784 1.00 15.11 H new ATOM 0 HB2 ALA A 114 -20.150 -32.580 -2.019 1.00 15.11 H new ATOM 0 HB3 ALA A 114 -20.545 -32.759 -0.293 1.00 15.11 H new ATOM 1771 N ASP A 115 -17.111 -34.839 0.426 1.00 64.24 N ATOM 1772 CA ASP A 115 -16.371 -35.067 1.667 1.00 1.22 C ATOM 1773 C ASP A 115 -14.872 -34.895 1.428 1.00 22.24 C ATOM 1774 O ASP A 115 -14.176 -35.835 1.020 1.00 33.32 O ATOM 1775 CB ASP A 115 -16.659 -36.470 2.222 1.00 64.14 C ATOM 1776 CG ASP A 115 -16.217 -36.643 3.673 1.00 52.23 C ATOM 1777 OD1 ASP A 115 -15.086 -36.240 4.015 1.00 51.14 O ATOM 1778 OD2 ASP A 115 -16.996 -37.208 4.469 1.00 30.13 O1- ATOM 0 H ASP A 115 -16.673 -35.240 -0.403 1.00 64.24 H new ATOM 0 HA ASP A 115 -16.699 -34.331 2.401 1.00 1.22 H new ATOM 0 HB2 ASP A 115 -17.728 -36.671 2.148 1.00 64.14 H new ATOM 0 HB3 ASP A 115 -16.152 -37.210 1.603 1.00 64.14 H new ATOM 1783 N ILE A 116 -14.385 -33.684 1.682 1.00 10.14 N ATOM 1784 CA ILE A 116 -12.983 -33.344 1.453 1.00 23.23 C ATOM 1785 C ILE A 116 -12.060 -34.227 2.294 1.00 50.32 C ATOM 1786 O ILE A 116 -10.961 -34.584 1.863 1.00 24.53 O ATOM 1787 CB ILE A 116 -12.709 -31.846 1.768 1.00 35.22 C ATOM 1788 CG1 ILE A 116 -11.260 -31.466 1.417 1.00 23.43 C ATOM 1789 CG2 ILE A 116 -13.013 -31.525 3.234 1.00 34.43 C ATOM 1790 CD1 ILE A 116 -10.925 -31.631 -0.053 1.00 62.15 C ATOM 0 H ILE A 116 -14.946 -32.915 2.050 1.00 10.14 H new ATOM 0 HA ILE A 116 -12.774 -33.522 0.398 1.00 23.23 H new ATOM 0 HB ILE A 116 -13.377 -31.249 1.147 1.00 35.22 H new ATOM 0 HG12 ILE A 116 -11.085 -30.430 1.706 1.00 23.43 H new ATOM 0 HG13 ILE A 116 -10.580 -32.080 2.007 1.00 23.43 H new ATOM 0 HG21 ILE A 116 -12.812 -30.471 3.425 1.00 34.43 H new ATOM 0 HG22 ILE A 116 -14.061 -31.738 3.443 1.00 34.43 H new ATOM 0 HG23 ILE A 116 -12.382 -32.137 3.879 1.00 34.43 H new ATOM 0 HD11 ILE A 116 -9.887 -31.344 -0.224 1.00 62.15 H new ATOM 0 HD12 ILE A 116 -11.067 -32.672 -0.344 1.00 62.15 H new ATOM 0 HD13 ILE A 116 -11.580 -30.996 -0.649 1.00 62.15 H new ATOM 1802 N SER A 117 -12.533 -34.605 3.475 1.00 64.32 N ATOM 1803 CA SER A 117 -11.733 -35.379 4.411 1.00 24.52 C ATOM 1804 C SER A 117 -11.511 -36.790 3.866 1.00 72.20 C ATOM 1805 O SER A 117 -10.387 -37.296 3.851 1.00 63.13 O ATOM 1806 CB SER A 117 -12.426 -35.426 5.783 1.00 2.24 C ATOM 1807 OG SER A 117 -11.572 -35.966 6.780 1.00 54.32 O ATOM 0 H SER A 117 -13.472 -34.386 3.807 1.00 64.32 H new ATOM 0 HA SER A 117 -10.761 -34.900 4.534 1.00 24.52 H new ATOM 0 HB2 SER A 117 -12.733 -34.421 6.071 1.00 2.24 H new ATOM 0 HB3 SER A 117 -13.332 -36.028 5.714 1.00 2.24 H new ATOM 0 HG SER A 117 -12.042 -35.980 7.640 1.00 54.32 H new ATOM 1813 N LYS A 118 -12.583 -37.409 3.393 1.00 24.02 N ATOM 1814 CA LYS A 118 -12.520 -38.763 2.860 1.00 23.25 C ATOM 1815 C LYS A 118 -11.707 -38.784 1.567 1.00 51.14 C ATOM 1816 O LYS A 118 -10.872 -39.670 1.366 1.00 44.54 O ATOM 1817 CB LYS A 118 -13.939 -39.299 2.617 1.00 55.14 C ATOM 1818 CG LYS A 118 -13.997 -40.769 2.205 1.00 21.34 C ATOM 1819 CD LYS A 118 -13.321 -41.675 3.236 1.00 32.24 C ATOM 1820 CE LYS A 118 -13.576 -43.152 2.955 1.00 45.55 C ATOM 1821 NZ LYS A 118 -15.022 -43.485 3.035 1.00 20.35 N1+ ATOM 0 H LYS A 118 -13.513 -36.992 3.367 1.00 24.02 H new ATOM 0 HA LYS A 118 -12.026 -39.408 3.586 1.00 23.25 H new ATOM 0 HB2 LYS A 118 -14.525 -39.166 3.526 1.00 55.14 H new ATOM 0 HB3 LYS A 118 -14.413 -38.698 1.841 1.00 55.14 H new ATOM 0 HG2 LYS A 118 -15.037 -41.071 2.082 1.00 21.34 H new ATOM 0 HG3 LYS A 118 -13.512 -40.895 1.237 1.00 21.34 H new ATOM 0 HD2 LYS A 118 -12.247 -41.486 3.236 1.00 32.24 H new ATOM 0 HD3 LYS A 118 -13.688 -41.427 4.232 1.00 32.24 H new ATOM 0 HE2 LYS A 118 -13.199 -43.404 1.964 1.00 45.55 H new ATOM 0 HE3 LYS A 118 -13.022 -43.760 3.671 1.00 45.55 H new ATOM 0 HZ1 LYS A 118 -15.157 -44.295 3.674 1.00 20.35 H new ATOM 0 HZ2 LYS A 118 -15.547 -42.665 3.400 1.00 20.35 H new ATOM 0 HZ3 LYS A 118 -15.375 -43.729 2.088 1.00 20.35 H new ATOM 1835 N ILE A 119 -11.945 -37.797 0.703 1.00 22.14 N ATOM 1836 CA ILE A 119 -11.220 -37.696 -0.561 1.00 2.21 C ATOM 1837 C ILE A 119 -9.711 -37.588 -0.320 1.00 62.22 C ATOM 1838 O ILE A 119 -8.929 -38.367 -0.871 1.00 24.10 O ATOM 1839 CB ILE A 119 -11.707 -36.488 -1.405 1.00 43.35 C ATOM 1840 CG1 ILE A 119 -13.194 -36.655 -1.766 1.00 44.33 C ATOM 1841 CG2 ILE A 119 -10.865 -36.338 -2.673 1.00 11.44 C ATOM 1842 CD1 ILE A 119 -13.787 -35.484 -2.527 1.00 40.14 C ATOM 0 H ILE A 119 -12.632 -37.059 0.856 1.00 22.14 H new ATOM 0 HA ILE A 119 -11.425 -38.608 -1.121 1.00 2.21 H new ATOM 0 HB ILE A 119 -11.590 -35.583 -0.809 1.00 43.35 H new ATOM 0 HG12 ILE A 119 -13.311 -37.559 -2.364 1.00 44.33 H new ATOM 0 HG13 ILE A 119 -13.764 -36.803 -0.849 1.00 44.33 H new ATOM 0 HG21 ILE A 119 -11.224 -35.485 -3.249 1.00 11.44 H new ATOM 0 HG22 ILE A 119 -9.822 -36.178 -2.400 1.00 11.44 H new ATOM 0 HG23 ILE A 119 -10.948 -37.243 -3.274 1.00 11.44 H new ATOM 0 HD11 ILE A 119 -14.837 -35.684 -2.741 1.00 40.14 H new ATOM 0 HD12 ILE A 119 -13.705 -34.579 -1.924 1.00 40.14 H new ATOM 0 HD13 ILE A 119 -13.245 -35.347 -3.463 1.00 40.14 H new ATOM 1854 N ILE A 120 -9.310 -36.639 0.525 1.00 71.14 N ATOM 1855 CA ILE A 120 -7.892 -36.417 0.814 1.00 1.52 C ATOM 1856 C ILE A 120 -7.290 -37.662 1.482 1.00 44.53 C ATOM 1857 O ILE A 120 -6.156 -38.067 1.172 1.00 2.32 O ATOM 1858 CB ILE A 120 -7.681 -35.135 1.685 1.00 41.41 C ATOM 1859 CG1 ILE A 120 -6.203 -34.672 1.689 1.00 72.14 C ATOM 1860 CG2 ILE A 120 -8.177 -35.343 3.116 1.00 5.22 C ATOM 1861 CD1 ILE A 120 -5.292 -35.439 2.629 1.00 43.13 C ATOM 0 H ILE A 120 -9.944 -36.013 1.021 1.00 71.14 H new ATOM 0 HA ILE A 120 -7.369 -36.248 -0.127 1.00 1.52 H new ATOM 0 HB ILE A 120 -8.276 -34.345 1.226 1.00 41.41 H new ATOM 0 HG12 ILE A 120 -5.809 -34.757 0.676 1.00 72.14 H new ATOM 0 HG13 ILE A 120 -6.170 -33.616 1.957 1.00 72.14 H new ATOM 0 HG21 ILE A 120 -8.015 -34.433 3.693 1.00 5.22 H new ATOM 0 HG22 ILE A 120 -9.241 -35.579 3.102 1.00 5.22 H new ATOM 0 HG23 ILE A 120 -7.629 -36.166 3.575 1.00 5.22 H new ATOM 0 HD11 ILE A 120 -4.280 -35.041 2.560 1.00 43.13 H new ATOM 0 HD12 ILE A 120 -5.654 -35.335 3.652 1.00 43.13 H new ATOM 0 HD13 ILE A 120 -5.287 -36.493 2.352 1.00 43.13 H new ATOM 1873 N SER A 121 -8.070 -38.289 2.372 1.00 33.33 N ATOM 1874 CA SER A 121 -7.655 -39.528 3.019 1.00 32.12 C ATOM 1875 C SER A 121 -7.279 -40.572 1.977 1.00 12.31 C ATOM 1876 O SER A 121 -6.196 -41.151 2.037 1.00 23.30 O ATOM 1877 CB SER A 121 -8.763 -40.067 3.934 1.00 43.12 C ATOM 1878 OG SER A 121 -8.953 -39.221 5.059 1.00 42.33 O ATOM 0 H SER A 121 -8.991 -37.954 2.656 1.00 33.33 H new ATOM 0 HA SER A 121 -6.780 -39.312 3.632 1.00 32.12 H new ATOM 0 HB2 SER A 121 -9.695 -40.147 3.374 1.00 43.12 H new ATOM 0 HB3 SER A 121 -8.505 -41.071 4.270 1.00 43.12 H new ATOM 0 HG SER A 121 -9.672 -38.582 4.870 1.00 42.33 H new ATOM 1884 N GLU A 122 -8.161 -40.788 1.004 1.00 14.44 N ATOM 1885 CA GLU A 122 -7.898 -41.763 -0.045 1.00 72.13 C ATOM 1886 C GLU A 122 -6.695 -41.354 -0.889 1.00 73.04 C ATOM 1887 O GLU A 122 -5.887 -42.200 -1.256 1.00 20.21 O ATOM 1888 CB GLU A 122 -9.133 -41.983 -0.928 1.00 32.23 C ATOM 1889 CG GLU A 122 -10.109 -43.011 -0.362 1.00 71.24 C ATOM 1890 CD GLU A 122 -9.441 -44.356 -0.099 1.00 22.22 C ATOM 1891 OE1 GLU A 122 -9.074 -45.050 -1.070 1.00 61.24 O ATOM 1892 OE2 GLU A 122 -9.275 -44.725 1.086 1.00 70.43 O1- ATOM 0 H GLU A 122 -9.055 -40.305 0.922 1.00 14.44 H new ATOM 0 HA GLU A 122 -7.663 -42.710 0.442 1.00 72.13 H new ATOM 0 HB2 GLU A 122 -9.652 -41.033 -1.057 1.00 32.23 H new ATOM 0 HB3 GLU A 122 -8.810 -42.306 -1.917 1.00 32.23 H new ATOM 0 HG2 GLU A 122 -10.536 -42.632 0.566 1.00 71.24 H new ATOM 0 HG3 GLU A 122 -10.935 -43.148 -1.060 1.00 71.24 H new ATOM 1899 N ILE A 123 -6.554 -40.059 -1.180 1.00 11.43 N ATOM 1900 CA ILE A 123 -5.414 -39.592 -1.967 1.00 32.41 C ATOM 1901 C ILE A 123 -4.100 -40.024 -1.308 1.00 5.24 C ATOM 1902 O ILE A 123 -3.289 -40.734 -1.919 1.00 71.51 O ATOM 1903 CB ILE A 123 -5.415 -38.049 -2.168 1.00 73.41 C ATOM 1904 CG1 ILE A 123 -6.651 -37.601 -2.967 1.00 51.34 C ATOM 1905 CG2 ILE A 123 -4.137 -37.611 -2.880 1.00 71.34 C ATOM 1906 CD1 ILE A 123 -6.839 -36.101 -3.013 1.00 15.35 C ATOM 0 H ILE A 123 -7.203 -39.328 -0.888 1.00 11.43 H new ATOM 0 HA ILE A 123 -5.505 -40.050 -2.952 1.00 32.41 H new ATOM 0 HB ILE A 123 -5.454 -37.575 -1.187 1.00 73.41 H new ATOM 0 HG12 ILE A 123 -6.569 -37.979 -3.986 1.00 51.34 H new ATOM 0 HG13 ILE A 123 -7.539 -38.056 -2.529 1.00 51.34 H new ATOM 0 HG21 ILE A 123 -4.148 -36.530 -3.015 1.00 71.34 H new ATOM 0 HG22 ILE A 123 -3.272 -37.893 -2.280 1.00 71.34 H new ATOM 0 HG23 ILE A 123 -4.078 -38.098 -3.853 1.00 71.34 H new ATOM 0 HD11 ILE A 123 -7.730 -35.864 -3.594 1.00 15.35 H new ATOM 0 HD12 ILE A 123 -6.954 -35.717 -1.999 1.00 15.35 H new ATOM 0 HD13 ILE A 123 -5.969 -35.639 -3.479 1.00 15.35 H new ATOM 1918 N ASN A 124 -3.914 -39.654 -0.041 1.00 61.24 N ATOM 1919 CA ASN A 124 -2.675 -40.003 0.660 1.00 42.31 C ATOM 1920 C ASN A 124 -2.619 -41.508 0.926 1.00 20.40 C ATOM 1921 O ASN A 124 -1.535 -42.090 0.999 1.00 70.22 O ATOM 1922 CB ASN A 124 -2.510 -39.212 1.972 1.00 5.10 C ATOM 1923 CG ASN A 124 -3.465 -39.642 3.075 1.00 40.22 C ATOM 1924 OD1 ASN A 124 -3.195 -40.586 3.817 1.00 31.24 O ATOM 1925 ND2 ASN A 124 -4.573 -38.937 3.210 1.00 15.41 N ATOM 0 H ASN A 124 -4.588 -39.124 0.512 1.00 61.24 H new ATOM 0 HA ASN A 124 -1.843 -39.727 0.012 1.00 42.31 H new ATOM 0 HB2 ASN A 124 -1.486 -39.326 2.327 1.00 5.10 H new ATOM 0 HB3 ASN A 124 -2.661 -38.152 1.767 1.00 5.10 H new ATOM 0 HD21 ASN A 124 -5.238 -39.168 3.948 1.00 15.41 H new ATOM 0 HD22 ASN A 124 -4.764 -38.161 2.576 1.00 15.41 H new ATOM 1932 N ASN A 125 -3.792 -42.131 1.038 1.00 31.14 N ATOM 1933 CA ASN A 125 -3.893 -43.575 1.279 1.00 72.20 C ATOM 1934 C ASN A 125 -3.469 -44.363 0.042 1.00 71.23 C ATOM 1935 O ASN A 125 -2.907 -45.450 0.148 1.00 34.51 O ATOM 1936 CB ASN A 125 -5.335 -43.957 1.665 1.00 65.54 C ATOM 1937 CG ASN A 125 -5.513 -45.445 1.941 1.00 44.14 C ATOM 1938 OD1 ASN A 125 -4.609 -46.111 2.446 1.00 32.44 O ATOM 1939 ND2 ASN A 125 -6.681 -45.981 1.610 1.00 44.23 N ATOM 0 H ASN A 125 -4.692 -41.657 0.966 1.00 31.14 H new ATOM 0 HA ASN A 125 -3.223 -43.825 2.102 1.00 72.20 H new ATOM 0 HB2 ASN A 125 -5.628 -43.393 2.551 1.00 65.54 H new ATOM 0 HB3 ASN A 125 -6.009 -43.661 0.861 1.00 65.54 H new ATOM 0 HD21 ASN A 125 -6.851 -46.974 1.772 1.00 44.23 H new ATOM 0 HD22 ASN A 125 -7.409 -45.400 1.193 1.00 44.23 H new ATOM 1946 N ASN A 126 -3.755 -43.812 -1.133 1.00 24.21 N ATOM 1947 CA ASN A 126 -3.446 -44.485 -2.393 1.00 34.20 C ATOM 1948 C ASN A 126 -2.013 -44.183 -2.825 1.00 61.32 C ATOM 1949 O ASN A 126 -1.378 -44.998 -3.496 1.00 63.21 O ATOM 1950 CB ASN A 126 -4.438 -44.072 -3.496 1.00 71.20 C ATOM 1951 CG ASN A 126 -5.867 -44.571 -3.270 1.00 53.32 C ATOM 1952 OD1 ASN A 126 -6.591 -44.849 -4.222 1.00 60.30 O ATOM 1953 ND2 ASN A 126 -6.293 -44.675 -2.016 1.00 41.12 N ATOM 0 H ASN A 126 -4.201 -42.901 -1.241 1.00 24.21 H new ATOM 0 HA ASN A 126 -3.542 -45.559 -2.234 1.00 34.20 H new ATOM 0 HB2 ASN A 126 -4.452 -42.985 -3.569 1.00 71.20 H new ATOM 0 HB3 ASN A 126 -4.079 -44.451 -4.453 1.00 71.20 H new ATOM 0 HD21 ASN A 126 -7.243 -44.993 -1.825 1.00 41.12 H new ATOM 0 HD22 ASN A 126 -5.670 -44.437 -1.244 1.00 41.12 H new ATOM 1960 N ILE A 127 -1.515 -43.002 -2.452 1.00 24.11 N ATOM 1961 CA ILE A 127 -0.121 -42.632 -2.721 1.00 45.52 C ATOM 1962 C ILE A 127 0.839 -43.457 -1.860 1.00 24.03 C ATOM 1963 O ILE A 127 1.806 -44.033 -2.365 1.00 24.55 O ATOM 1964 CB ILE A 127 0.127 -41.123 -2.456 1.00 23.43 C ATOM 1965 CG1 ILE A 127 -0.614 -40.261 -3.491 1.00 53.10 C ATOM 1966 CG2 ILE A 127 1.622 -40.803 -2.473 1.00 51.22 C ATOM 1967 CD1 ILE A 127 -0.607 -38.783 -3.165 1.00 54.51 C ATOM 0 H ILE A 127 -2.053 -42.286 -1.964 1.00 24.11 H new ATOM 0 HA ILE A 127 0.067 -42.840 -3.774 1.00 45.52 H new ATOM 0 HB ILE A 127 -0.262 -40.889 -1.465 1.00 23.43 H new ATOM 0 HG12 ILE A 127 -0.158 -40.411 -4.470 1.00 53.10 H new ATOM 0 HG13 ILE A 127 -1.646 -40.603 -3.565 1.00 53.10 H new ATOM 0 HG21 ILE A 127 1.769 -39.739 -2.285 1.00 51.22 H new ATOM 0 HG22 ILE A 127 2.127 -41.381 -1.699 1.00 51.22 H new ATOM 0 HG23 ILE A 127 2.038 -41.060 -3.447 1.00 51.22 H new ATOM 0 HD11 ILE A 127 -1.148 -38.237 -3.938 1.00 54.51 H new ATOM 0 HD12 ILE A 127 -1.090 -38.621 -2.201 1.00 54.51 H new ATOM 0 HD13 ILE A 127 0.422 -38.425 -3.120 1.00 54.51 H new ATOM 1979 N ASN A 128 0.563 -43.507 -0.560 1.00 64.33 N ATOM 1980 CA ASN A 128 1.447 -44.173 0.394 1.00 71.43 C ATOM 1981 C ASN A 128 0.870 -45.531 0.785 1.00 23.15 C ATOM 1982 O ASN A 128 0.026 -45.582 1.706 1.00 65.33 O ATOM 1983 CB ASN A 128 1.646 -43.305 1.649 1.00 24.12 C ATOM 1984 CG ASN A 128 2.162 -41.911 1.328 1.00 23.51 C ATOM 1985 OD1 ASN A 128 3.370 -41.677 1.274 1.00 5.34 O ATOM 1986 ND2 ASN A 128 1.247 -40.975 1.118 1.00 22.35 N ATOM 1987 OXT ASN A 128 1.259 -46.545 0.169 1.00 0.00 O1- ATOM 0 H ASN A 128 -0.269 -43.093 -0.141 1.00 64.33 H new ATOM 0 HA ASN A 128 2.417 -44.321 -0.082 1.00 71.43 H new ATOM 0 HB2 ASN A 128 0.699 -43.223 2.182 1.00 24.12 H new ATOM 0 HB3 ASN A 128 2.347 -43.801 2.320 1.00 24.12 H new ATOM 0 HD21 ASN A 128 1.534 -40.020 0.903 1.00 22.35 H new ATOM 0 HD22 ASN A 128 0.256 -41.210 1.172 1.00 22.35 H new TER 1994 ASN A 128