USER MOD reduce.3.24.130724 H: found=0, std=0, add=786, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 619 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 -77:sc= 0.449 USER MOD Set 1.2: A 22 GLN :FLIP amide:sc= -0.242 F(o=-0.64,f=0.21) USER MOD Single : A 1 MET CE :methyl 157:sc= -0.103 (180deg=-0.563) USER MOD Single : A 1 MET N :NH3+ 154:sc= 0.541 (180deg=0.269) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 LYS NZ :NH3+ -178:sc= 0.436 (180deg=0.43) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ -160:sc= -0.0851 (180deg=-0.447) USER MOD Single : A 43 LYS NZ :NH3+ -146:sc= -0.192 (180deg=-0.745) USER MOD Single : A 45 GLN : amide:sc= -0.154 K(o=-0.15,f=-2.4!) USER MOD Single : A 49 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 GLN : amide:sc= -0.43 X(o=-0.43,f=-0.26) USER MOD Single : A 57 HIS : no HD1:sc= -1.02 X(o=-1,f=-0.67) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.0863) USER MOD Single : A 66 ASN :FLIP amide:sc= -0.431 F(o=-2.1,f=-0.43) USER MOD Single : A 70 GLN : amide:sc= -1.67 X(o=-1.7,f=-1.2) USER MOD Single : A 73 SER OG : rot 170:sc= 0.578 USER MOD Single : A 77 GLN : amide:sc= 0 K(o=0,f=-0.77) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ 159:sc= 0 (180deg=-0.339) USER MOD Single : A 90 ASN : amide:sc= -0.0169 X(o=-0.017,f=-0.4) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot -91:sc= 1.2 USER MOD Single : A 101 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0.00759 USER MOD Single : A 108 LYS NZ :NH3+ 144:sc= -0.0427 (180deg=-0.889) USER MOD Single : A 109 LYS NZ :NH3+ -126:sc= -0.267 (180deg=-2.04!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -7.035 32.248 26.968 1.00 21.41 N ATOM 2 CA MET A 1 -6.988 31.608 28.278 1.00 1.32 C ATOM 3 C MET A 1 -8.352 31.037 28.653 1.00 51.35 C ATOM 4 O MET A 1 -8.472 29.856 28.979 1.00 53.31 O ATOM 5 CB MET A 1 -6.532 32.609 29.342 1.00 40.23 C ATOM 6 CG MET A 1 -5.031 32.852 29.343 1.00 30.14 C ATOM 7 SD MET A 1 -4.520 34.053 28.099 1.00 33.34 S ATOM 8 CE MET A 1 -5.198 35.562 28.787 1.00 53.30 C ATOM 0 H1 MET A 1 -6.297 32.979 26.912 1.00 21.41 H new ATOM 0 H2 MET A 1 -6.874 31.536 26.228 1.00 21.41 H new ATOM 0 H3 MET A 1 -7.968 32.686 26.829 1.00 21.41 H new ATOM 0 HA MET A 1 -6.271 30.788 28.229 1.00 1.32 H new ATOM 0 HB2 MET A 1 -7.045 33.557 29.181 1.00 40.23 H new ATOM 0 HB3 MET A 1 -6.834 32.246 30.324 1.00 40.23 H new ATOM 0 HG2 MET A 1 -4.725 33.203 30.328 1.00 30.14 H new ATOM 0 HG3 MET A 1 -4.514 31.909 29.166 1.00 30.14 H new ATOM 0 HE1 MET A 1 -4.652 36.419 28.393 1.00 53.30 H new ATOM 0 HE2 MET A 1 -6.250 35.646 28.514 1.00 53.30 H new ATOM 0 HE3 MET A 1 -5.105 35.541 29.873 1.00 53.30 H new ATOM 16 N SER A 2 -9.376 31.882 28.607 1.00 11.03 N ATOM 17 CA SER A 2 -10.730 31.462 28.945 1.00 64.24 C ATOM 18 C SER A 2 -11.741 32.039 27.960 1.00 72.11 C ATOM 19 O SER A 2 -11.656 33.206 27.578 1.00 53.42 O ATOM 20 CB SER A 2 -11.081 31.899 30.370 1.00 34.14 C ATOM 21 OG SER A 2 -11.517 33.248 30.395 1.00 72.05 O ATOM 0 H SER A 2 -9.294 32.863 28.339 1.00 11.03 H new ATOM 0 HA SER A 2 -10.772 30.374 28.885 1.00 64.24 H new ATOM 0 HB2 SER A 2 -11.862 31.253 30.770 1.00 34.14 H new ATOM 0 HB3 SER A 2 -10.210 31.783 31.015 1.00 34.14 H new ATOM 0 HG SER A 2 -11.737 33.504 31.315 1.00 72.05 H new ATOM 26 N ASP A 3 -12.698 31.213 27.552 1.00 62.44 N ATOM 27 CA ASP A 3 -13.728 31.640 26.612 1.00 73.14 C ATOM 28 C ASP A 3 -15.100 31.130 27.040 1.00 72.51 C ATOM 29 O ASP A 3 -15.803 30.482 26.264 1.00 4.14 O ATOM 30 CB ASP A 3 -13.400 31.139 25.204 1.00 32.45 C ATOM 31 CG ASP A 3 -12.263 31.911 24.565 1.00 62.11 C ATOM 32 OD1 ASP A 3 -12.456 33.106 24.256 1.00 70.45 O ATOM 33 OD2 ASP A 3 -11.179 31.320 24.372 1.00 31.43 O ATOM 0 H ASP A 3 -12.782 30.243 27.858 1.00 62.44 H new ATOM 0 HA ASP A 3 -13.752 32.730 26.606 1.00 73.14 H new ATOM 0 HB2 ASP A 3 -13.137 30.082 25.250 1.00 32.45 H new ATOM 0 HB3 ASP A 3 -14.288 31.220 24.577 1.00 32.45 H new ATOM 37 N ALA A 4 -15.476 31.426 28.280 1.00 24.12 N ATOM 38 CA ALA A 4 -16.764 30.999 28.811 1.00 32.32 C ATOM 39 C ALA A 4 -17.703 32.187 28.996 1.00 3.41 C ATOM 40 O ALA A 4 -18.670 32.114 29.752 1.00 53.12 O ATOM 41 CB ALA A 4 -16.574 30.264 30.129 1.00 22.21 C ATOM 0 H ALA A 4 -14.906 31.960 28.936 1.00 24.12 H new ATOM 0 HA ALA A 4 -17.219 30.319 28.091 1.00 32.32 H new ATOM 0 HB1 ALA A 4 -17.544 29.951 30.514 1.00 22.21 H new ATOM 0 HB2 ALA A 4 -15.947 29.387 29.969 1.00 22.21 H new ATOM 0 HB3 ALA A 4 -16.094 30.927 30.849 1.00 22.21 H new ATOM 47 N GLY A 5 -17.408 33.282 28.300 1.00 62.53 N ATOM 48 CA GLY A 5 -18.236 34.470 28.403 1.00 42.30 C ATOM 49 C GLY A 5 -19.469 34.396 27.525 1.00 43.42 C ATOM 50 O GLY A 5 -19.388 34.591 26.312 1.00 12.32 O ATOM 0 H GLY A 5 -16.612 33.367 27.668 1.00 62.53 H new ATOM 0 HA2 GLY A 5 -18.540 34.608 29.440 1.00 42.30 H new ATOM 0 HA3 GLY A 5 -17.648 35.344 28.125 1.00 42.30 H new ATOM 53 N ARG A 6 -20.613 34.112 28.137 1.00 33.31 N ATOM 54 CA ARG A 6 -21.868 34.010 27.403 1.00 13.23 C ATOM 55 C ARG A 6 -22.762 35.214 27.681 1.00 3.34 C ATOM 56 O ARG A 6 -23.935 35.232 27.307 1.00 10.43 O ATOM 57 CB ARG A 6 -22.601 32.720 27.779 1.00 13.55 C ATOM 58 CG ARG A 6 -21.830 31.458 27.428 1.00 33.15 C ATOM 59 CD ARG A 6 -22.180 30.961 26.034 1.00 51.50 C ATOM 60 NE ARG A 6 -23.195 29.912 26.065 1.00 40.20 N ATOM 61 CZ ARG A 6 -23.947 29.587 25.020 1.00 73.42 C ATOM 62 NH1 ARG A 6 -23.800 30.225 23.867 1.00 4.50 N ATOM 63 NH2 ARG A 6 -24.851 28.619 25.127 1.00 1.43 N ATOM 0 H ARG A 6 -20.697 33.948 29.140 1.00 33.31 H new ATOM 0 HA ARG A 6 -21.635 33.991 26.338 1.00 13.23 H new ATOM 0 HB2 ARG A 6 -22.804 32.726 28.850 1.00 13.55 H new ATOM 0 HB3 ARG A 6 -23.566 32.699 27.272 1.00 13.55 H new ATOM 0 HG2 ARG A 6 -20.760 31.656 27.487 1.00 33.15 H new ATOM 0 HG3 ARG A 6 -22.051 30.680 28.159 1.00 33.15 H new ATOM 0 HD2 ARG A 6 -22.539 31.795 25.432 1.00 51.50 H new ATOM 0 HD3 ARG A 6 -21.281 30.581 25.548 1.00 51.50 H new ATOM 0 HE ARG A 6 -23.334 29.401 26.937 1.00 40.20 H new ATOM 0 HH11 ARG A 6 -23.107 30.969 23.780 1.00 4.50 H new ATOM 0 HH12 ARG A 6 -24.380 29.972 23.067 1.00 4.50 H new ATOM 0 HH21 ARG A 6 -24.967 28.125 26.012 1.00 1.43 H new ATOM 0 HH22 ARG A 6 -25.429 28.370 24.324 1.00 1.43 H new ATOM 74 N LYS A 7 -22.199 36.221 28.342 1.00 21.02 N ATOM 75 CA LYS A 7 -22.944 37.431 28.671 1.00 2.21 C ATOM 76 C LYS A 7 -23.204 38.267 27.422 1.00 70.24 C ATOM 77 O LYS A 7 -24.057 39.153 27.424 1.00 43.31 O ATOM 78 CB LYS A 7 -22.176 38.262 29.702 1.00 63.14 C ATOM 79 CG LYS A 7 -21.617 37.441 30.852 1.00 74.22 C ATOM 80 CD LYS A 7 -20.126 37.197 30.690 1.00 41.20 C ATOM 81 CE LYS A 7 -19.444 37.010 32.037 1.00 42.52 C ATOM 82 NZ LYS A 7 -19.172 38.312 32.706 1.00 71.42 N ATOM 0 H LYS A 7 -21.230 36.223 28.660 1.00 21.02 H new ATOM 0 HA LYS A 7 -23.904 37.133 29.094 1.00 2.21 H new ATOM 0 HB2 LYS A 7 -21.356 38.777 29.202 1.00 63.14 H new ATOM 0 HB3 LYS A 7 -22.838 39.030 30.103 1.00 63.14 H new ATOM 0 HG2 LYS A 7 -21.802 37.959 31.793 1.00 74.22 H new ATOM 0 HG3 LYS A 7 -22.139 36.486 30.906 1.00 74.22 H new ATOM 0 HD2 LYS A 7 -19.966 36.313 30.073 1.00 41.20 H new ATOM 0 HD3 LYS A 7 -19.673 38.038 30.165 1.00 41.20 H new ATOM 0 HE2 LYS A 7 -20.073 36.395 32.681 1.00 42.52 H new ATOM 0 HE3 LYS A 7 -18.507 36.470 31.898 1.00 42.52 H new ATOM 0 HZ1 LYS A 7 -18.707 38.142 33.621 1.00 71.42 H new ATOM 0 HZ2 LYS A 7 -18.551 38.889 32.104 1.00 71.42 H new ATOM 0 HZ3 LYS A 7 -20.068 38.816 32.862 1.00 71.42 H new ATOM 92 N GLY A 8 -22.465 37.975 26.356 1.00 20.32 N ATOM 93 CA GLY A 8 -22.633 38.709 25.114 1.00 63.34 C ATOM 94 C GLY A 8 -21.645 39.850 24.977 1.00 70.32 C ATOM 95 O GLY A 8 -21.431 40.366 23.880 1.00 24.52 O ATOM 0 H GLY A 8 -21.754 37.244 26.330 1.00 20.32 H new ATOM 0 HA2 GLY A 8 -22.514 38.026 24.273 1.00 63.34 H new ATOM 0 HA3 GLY A 8 -23.648 39.103 25.063 1.00 63.34 H new ATOM 98 N PHE A 9 -21.042 40.246 26.093 1.00 31.23 N ATOM 99 CA PHE A 9 -20.073 41.336 26.092 1.00 72.04 C ATOM 100 C PHE A 9 -18.744 40.883 25.494 1.00 72.21 C ATOM 101 O PHE A 9 -17.835 41.686 25.294 1.00 32.33 O ATOM 102 CB PHE A 9 -19.854 41.852 27.516 1.00 23.10 C ATOM 103 CG PHE A 9 -20.546 43.156 27.794 1.00 33.34 C ATOM 104 CD1 PHE A 9 -20.279 44.276 27.023 1.00 42.42 C ATOM 105 CD2 PHE A 9 -21.465 43.261 28.825 1.00 64.34 C ATOM 106 CE1 PHE A 9 -20.914 45.477 27.276 1.00 1.10 C ATOM 107 CE2 PHE A 9 -22.104 44.459 29.082 1.00 64.11 C ATOM 108 CZ PHE A 9 -21.828 45.569 28.308 1.00 11.42 C ATOM 0 H PHE A 9 -21.207 39.829 27.009 1.00 31.23 H new ATOM 0 HA PHE A 9 -20.472 42.143 25.477 1.00 72.04 H new ATOM 0 HB2 PHE A 9 -20.209 41.103 28.224 1.00 23.10 H new ATOM 0 HB3 PHE A 9 -18.785 41.973 27.690 1.00 23.10 H new ATOM 0 HD1 PHE A 9 -19.566 44.209 26.215 1.00 42.42 H new ATOM 0 HD2 PHE A 9 -21.685 42.397 29.435 1.00 64.34 H new ATOM 0 HE1 PHE A 9 -20.696 46.343 26.668 1.00 1.10 H new ATOM 0 HE2 PHE A 9 -22.819 44.527 29.888 1.00 64.11 H new ATOM 0 HZ PHE A 9 -22.325 46.506 28.509 1.00 11.42 H new ATOM 117 N GLY A 10 -18.641 39.587 25.211 1.00 24.01 N ATOM 118 CA GLY A 10 -17.420 39.048 24.639 1.00 21.54 C ATOM 119 C GLY A 10 -17.441 39.051 23.124 1.00 3.52 C ATOM 120 O GLY A 10 -16.419 39.303 22.485 1.00 32.14 O ATOM 0 H GLY A 10 -19.380 38.902 25.367 1.00 24.01 H new ATOM 0 HA2 GLY A 10 -16.569 39.633 24.989 1.00 21.54 H new ATOM 0 HA3 GLY A 10 -17.274 38.028 24.996 1.00 21.54 H new ATOM 123 N GLU A 11 -18.604 38.768 22.548 1.00 34.34 N ATOM 124 CA GLU A 11 -18.751 38.736 21.097 1.00 2.42 C ATOM 125 C GLU A 11 -18.158 39.992 20.464 1.00 33.31 C ATOM 126 O GLU A 11 -17.719 39.974 19.314 1.00 33.32 O ATOM 127 CB GLU A 11 -20.226 38.606 20.714 1.00 53.15 C ATOM 128 CG GLU A 11 -20.913 37.403 21.339 1.00 12.34 C ATOM 129 CD GLU A 11 -20.980 36.215 20.397 1.00 65.24 C ATOM 130 OE1 GLU A 11 -20.230 36.208 19.399 1.00 30.53 O ATOM 131 OE2 GLU A 11 -21.782 35.295 20.660 1.00 41.54 O ATOM 0 H GLU A 11 -19.459 38.557 23.063 1.00 34.34 H new ATOM 0 HA GLU A 11 -18.209 37.869 20.721 1.00 2.42 H new ATOM 0 HB2 GLU A 11 -20.752 39.512 21.016 1.00 53.15 H new ATOM 0 HB3 GLU A 11 -20.306 38.537 19.629 1.00 53.15 H new ATOM 0 HG2 GLU A 11 -20.379 37.114 22.245 1.00 12.34 H new ATOM 0 HG3 GLU A 11 -21.923 37.681 21.639 1.00 12.34 H new ATOM 136 N LYS A 12 -18.150 41.083 21.222 1.00 74.31 N ATOM 137 CA LYS A 12 -17.613 42.348 20.737 1.00 24.41 C ATOM 138 C LYS A 12 -16.172 42.540 21.199 1.00 44.12 C ATOM 139 O LYS A 12 -15.260 42.665 20.383 1.00 75.11 O ATOM 140 CB LYS A 12 -18.475 43.514 21.228 1.00 33.33 C ATOM 141 CG LYS A 12 -19.967 43.264 21.094 1.00 23.40 C ATOM 142 CD LYS A 12 -20.522 42.541 22.310 1.00 72.31 C ATOM 143 CE LYS A 12 -21.995 42.856 22.523 1.00 31.42 C ATOM 144 NZ LYS A 12 -22.876 41.818 21.920 1.00 74.21 N ATOM 0 H LYS A 12 -18.510 41.116 22.176 1.00 74.31 H new ATOM 0 HA LYS A 12 -17.628 42.326 19.647 1.00 24.41 H new ATOM 0 HB2 LYS A 12 -18.241 43.713 22.274 1.00 33.33 H new ATOM 0 HB3 LYS A 12 -18.213 44.411 20.666 1.00 33.33 H new ATOM 0 HG2 LYS A 12 -20.486 44.214 20.966 1.00 23.40 H new ATOM 0 HG3 LYS A 12 -20.159 42.673 20.199 1.00 23.40 H new ATOM 0 HD2 LYS A 12 -20.393 41.466 22.185 1.00 72.31 H new ATOM 0 HD3 LYS A 12 -19.956 42.829 23.196 1.00 72.31 H new ATOM 0 HE2 LYS A 12 -22.200 42.931 23.591 1.00 31.42 H new ATOM 0 HE3 LYS A 12 -22.226 43.827 22.086 1.00 31.42 H new ATOM 0 HZ1 LYS A 12 -23.872 42.086 22.057 1.00 74.21 H new ATOM 0 HZ2 LYS A 12 -22.675 41.740 20.903 1.00 74.21 H new ATOM 0 HZ3 LYS A 12 -22.698 40.902 22.379 1.00 74.21 H new ATOM 154 N ALA A 13 -15.974 42.559 22.513 1.00 22.43 N ATOM 155 CA ALA A 13 -14.644 42.732 23.083 1.00 43.43 C ATOM 156 C ALA A 13 -13.697 41.633 22.610 1.00 1.34 C ATOM 157 O ALA A 13 -12.594 41.911 22.140 1.00 0.43 O ATOM 158 CB ALA A 13 -14.718 42.748 24.602 1.00 25.33 C ATOM 0 H ALA A 13 -16.718 42.457 23.203 1.00 22.43 H new ATOM 0 HA ALA A 13 -14.251 43.689 22.739 1.00 43.43 H new ATOM 0 HB1 ALA A 13 -13.717 42.878 25.014 1.00 25.33 H new ATOM 0 HB2 ALA A 13 -15.354 43.572 24.927 1.00 25.33 H new ATOM 0 HB3 ALA A 13 -15.136 41.806 24.956 1.00 25.33 H new ATOM 164 N SER A 14 -14.136 40.385 22.738 1.00 20.24 N ATOM 165 CA SER A 14 -13.326 39.245 22.327 1.00 74.11 C ATOM 166 C SER A 14 -12.992 39.323 20.840 1.00 71.44 C ATOM 167 O SER A 14 -11.873 39.020 20.429 1.00 43.42 O ATOM 168 CB SER A 14 -14.059 37.936 22.629 1.00 60.01 C ATOM 169 OG SER A 14 -13.145 36.866 22.792 1.00 40.30 O ATOM 0 H SER A 14 -15.048 40.138 23.123 1.00 20.24 H new ATOM 0 HA SER A 14 -12.394 39.270 22.892 1.00 74.11 H new ATOM 0 HB2 SER A 14 -14.655 38.050 23.534 1.00 60.01 H new ATOM 0 HB3 SER A 14 -14.751 37.707 21.818 1.00 60.01 H new ATOM 0 HG SER A 14 -13.638 36.041 22.986 1.00 40.30 H new ATOM 174 N GLU A 15 -13.973 39.730 20.041 1.00 61.13 N ATOM 175 CA GLU A 15 -13.784 39.846 18.600 1.00 2.24 C ATOM 176 C GLU A 15 -13.075 41.152 18.248 1.00 33.24 C ATOM 177 O GLU A 15 -12.459 41.270 17.190 1.00 52.55 O ATOM 178 CB GLU A 15 -15.131 39.774 17.879 1.00 52.15 C ATOM 179 CG GLU A 15 -15.780 41.130 17.664 1.00 10.35 C ATOM 180 CD GLU A 15 -17.038 41.049 16.822 1.00 34.33 C ATOM 181 OE1 GLU A 15 -17.075 40.222 15.886 1.00 12.10 O ATOM 182 OE2 GLU A 15 -17.988 41.811 17.100 1.00 13.24 O ATOM 0 H GLU A 15 -14.905 39.985 20.367 1.00 61.13 H new ATOM 0 HA GLU A 15 -13.160 39.014 18.273 1.00 2.24 H new ATOM 0 HB2 GLU A 15 -14.991 39.291 16.912 1.00 52.15 H new ATOM 0 HB3 GLU A 15 -15.809 39.144 18.455 1.00 52.15 H new ATOM 0 HG2 GLU A 15 -16.023 41.570 18.631 1.00 10.35 H new ATOM 0 HG3 GLU A 15 -15.066 41.797 17.181 1.00 10.35 H new ATOM 187 N ALA A 16 -13.170 42.129 19.143 1.00 24.31 N ATOM 188 CA ALA A 16 -12.538 43.425 18.929 1.00 32.10 C ATOM 189 C ALA A 16 -11.077 43.403 19.364 1.00 61.43 C ATOM 190 O ALA A 16 -10.274 44.227 18.925 1.00 15.00 O ATOM 191 CB ALA A 16 -13.297 44.513 19.675 1.00 70.33 C ATOM 0 H ALA A 16 -13.679 42.048 20.023 1.00 24.31 H new ATOM 0 HA ALA A 16 -12.568 43.643 17.862 1.00 32.10 H new ATOM 0 HB1 ALA A 16 -12.814 45.475 19.506 1.00 70.33 H new ATOM 0 HB2 ALA A 16 -14.324 44.554 19.312 1.00 70.33 H new ATOM 0 HB3 ALA A 16 -13.298 44.290 20.742 1.00 70.33 H new ATOM 197 N LEU A 17 -10.739 42.455 20.232 1.00 65.11 N ATOM 198 CA LEU A 17 -9.373 42.326 20.729 1.00 4.52 C ATOM 199 C LEU A 17 -8.655 41.165 20.048 1.00 45.45 C ATOM 200 O LEU A 17 -7.426 41.085 20.067 1.00 62.05 O ATOM 201 CB LEU A 17 -9.378 42.120 22.245 1.00 74.22 C ATOM 202 CG LEU A 17 -10.265 43.071 23.049 1.00 51.31 C ATOM 203 CD1 LEU A 17 -10.801 42.379 24.292 1.00 21.10 C ATOM 204 CD2 LEU A 17 -9.493 44.327 23.427 1.00 31.32 C ATOM 0 H LEU A 17 -11.391 41.765 20.606 1.00 65.11 H new ATOM 0 HA LEU A 17 -8.838 43.247 20.496 1.00 4.52 H new ATOM 0 HB2 LEU A 17 -9.695 41.098 22.451 1.00 74.22 H new ATOM 0 HB3 LEU A 17 -8.355 42.216 22.608 1.00 74.22 H new ATOM 0 HG LEU A 17 -11.112 43.361 22.427 1.00 51.31 H new ATOM 0 HD11 LEU A 17 -11.430 43.072 24.851 1.00 21.10 H new ATOM 0 HD12 LEU A 17 -11.390 41.510 23.999 1.00 21.10 H new ATOM 0 HD13 LEU A 17 -9.968 42.059 24.918 1.00 21.10 H new ATOM 0 HD21 LEU A 17 -10.139 44.993 23.999 1.00 31.32 H new ATOM 0 HD22 LEU A 17 -8.628 44.054 24.031 1.00 31.32 H new ATOM 0 HD23 LEU A 17 -9.159 44.835 22.522 1.00 31.32 H new ATOM 215 N LYS A 18 -9.428 40.269 19.446 1.00 70.12 N ATOM 216 CA LYS A 18 -8.866 39.113 18.756 1.00 63.53 C ATOM 217 C LYS A 18 -7.634 39.508 17.950 1.00 14.45 C ATOM 218 O LYS A 18 -7.724 40.185 16.925 1.00 12.32 O ATOM 219 CB LYS A 18 -9.914 38.486 17.834 1.00 50.10 C ATOM 220 CG LYS A 18 -10.720 37.381 18.493 1.00 60.31 C ATOM 221 CD LYS A 18 -10.686 36.101 17.675 1.00 62.31 C ATOM 222 CE LYS A 18 -12.072 35.490 17.537 1.00 63.35 C ATOM 223 NZ LYS A 18 -12.445 34.685 18.734 1.00 63.25 N ATOM 0 H LYS A 18 -10.446 40.320 19.421 1.00 70.12 H new ATOM 0 HA LYS A 18 -8.567 38.381 19.507 1.00 63.53 H new ATOM 0 HB2 LYS A 18 -10.595 39.264 17.489 1.00 50.10 H new ATOM 0 HB3 LYS A 18 -9.416 38.084 16.952 1.00 50.10 H new ATOM 0 HG2 LYS A 18 -10.325 37.187 19.490 1.00 60.31 H new ATOM 0 HG3 LYS A 18 -11.753 37.707 18.617 1.00 60.31 H new ATOM 0 HD2 LYS A 18 -10.280 36.311 16.686 1.00 62.31 H new ATOM 0 HD3 LYS A 18 -10.016 35.383 18.149 1.00 62.31 H new ATOM 0 HE2 LYS A 18 -12.805 36.283 17.390 1.00 63.35 H new ATOM 0 HE3 LYS A 18 -12.103 34.858 16.650 1.00 63.35 H new ATOM 0 HZ1 LYS A 18 -13.396 34.286 18.601 1.00 63.25 H new ATOM 0 HZ2 LYS A 18 -11.760 33.913 18.860 1.00 63.25 H new ATOM 0 HZ3 LYS A 18 -12.440 35.294 19.577 1.00 63.25 H new ATOM 233 N PRO A 19 -6.454 39.074 18.418 1.00 3.21 N ATOM 234 CA PRO A 19 -5.181 39.369 17.753 1.00 41.03 C ATOM 235 C PRO A 19 -5.036 38.631 16.426 1.00 11.13 C ATOM 236 O PRO A 19 -4.207 38.993 15.591 1.00 45.32 O ATOM 237 CB PRO A 19 -4.135 38.876 18.756 1.00 32.21 C ATOM 238 CG PRO A 19 -4.836 37.828 19.550 1.00 54.43 C ATOM 239 CD PRO A 19 -6.273 38.263 19.633 1.00 52.43 C ATOM 0 HA PRO A 19 -5.087 40.426 17.502 1.00 41.03 H new ATOM 0 HB2 PRO A 19 -3.260 38.469 18.248 1.00 32.21 H new ATOM 0 HB3 PRO A 19 -3.785 39.688 19.394 1.00 32.21 H new ATOM 0 HG2 PRO A 19 -4.751 36.853 19.071 1.00 54.43 H new ATOM 0 HG3 PRO A 19 -4.399 37.734 20.544 1.00 54.43 H new ATOM 0 HD2 PRO A 19 -6.951 37.410 19.651 1.00 52.43 H new ATOM 0 HD3 PRO A 19 -6.466 38.843 20.536 1.00 52.43 H new ATOM 244 N ASP A 20 -5.848 37.598 16.237 1.00 72.35 N ATOM 245 CA ASP A 20 -5.810 36.810 15.011 1.00 31.52 C ATOM 246 C ASP A 20 -4.425 36.210 14.791 1.00 64.21 C ATOM 247 O ASP A 20 -4.072 35.828 13.675 1.00 24.21 O ATOM 248 CB ASP A 20 -6.201 37.676 13.811 1.00 62.43 C ATOM 249 CG ASP A 20 -6.348 36.867 12.537 1.00 65.11 C ATOM 250 OD1 ASP A 20 -6.428 35.624 12.629 1.00 3.34 O ATOM 251 OD2 ASP A 20 -6.385 37.477 11.449 1.00 1.44 O ATOM 0 H ASP A 20 -6.541 37.286 16.917 1.00 72.35 H new ATOM 0 HA ASP A 20 -6.526 35.995 15.111 1.00 31.52 H new ATOM 0 HB2 ASP A 20 -7.141 38.185 14.025 1.00 62.43 H new ATOM 0 HB3 ASP A 20 -5.446 38.448 13.663 1.00 62.43 H new ATOM 255 N SER A 21 -3.644 36.131 15.864 1.00 64.01 N ATOM 256 CA SER A 21 -2.295 35.583 15.788 1.00 51.43 C ATOM 257 C SER A 21 -2.257 34.158 16.332 1.00 50.22 C ATOM 258 O SER A 21 -1.272 33.441 16.155 1.00 41.32 O ATOM 259 CB SER A 21 -1.318 36.465 16.569 1.00 34.53 C ATOM 260 OG SER A 21 -0.926 35.844 17.780 1.00 31.41 O ATOM 0 H SER A 21 -3.922 36.439 16.796 1.00 64.01 H new ATOM 0 HA SER A 21 -1.996 35.562 14.740 1.00 51.43 H new ATOM 0 HB2 SER A 21 -0.438 36.667 15.959 1.00 34.53 H new ATOM 0 HB3 SER A 21 -1.784 37.427 16.784 1.00 34.53 H new ATOM 0 HG SER A 21 -1.649 35.922 18.437 1.00 31.41 H new ATOM 265 N GLN A 22 -3.336 33.755 16.995 1.00 54.31 N ATOM 266 CA GLN A 22 -3.426 32.416 17.565 1.00 42.03 C ATOM 267 C GLN A 22 -4.549 31.619 16.909 1.00 0.31 C ATOM 268 O GLN A 22 -4.306 30.593 16.272 1.00 23.23 O ATOM 269 CB GLN A 22 -3.657 32.496 19.075 1.00 0.22 C ATOM 270 CG GLN A 22 -2.479 33.077 19.840 1.00 20.51 C ATOM 271 CD GLN A 22 -2.780 34.444 20.424 1.00 40.32 C ATOM 272 OE1 GLN A 22 -1.797 35.336 20.380 1.00 65.50 O flip ATOM 273 NE2 GLN A 22 -3.882 34.696 20.908 1.00 41.45 N flip ATOM 0 H GLN A 22 -4.160 34.336 17.151 1.00 54.31 H new ATOM 0 HA GLN A 22 -2.483 31.904 17.375 1.00 42.03 H new ATOM 0 HB2 GLN A 22 -4.540 33.105 19.267 1.00 0.22 H new ATOM 0 HB3 GLN A 22 -3.869 31.497 19.455 1.00 0.22 H new ATOM 0 HG2 GLN A 22 -2.201 32.396 20.644 1.00 20.51 H new ATOM 0 HG3 GLN A 22 -1.619 33.152 19.174 1.00 20.51 H new ATOM 0 HE21 GLN A 22 -4.609 33.981 20.921 1.00 41.45 H new ATOM 0 HE22 GLN A 22 -4.069 35.620 21.296 1.00 41.45 H new ATOM 280 N LYS A 23 -5.778 32.096 17.069 1.00 53.04 N ATOM 281 CA LYS A 23 -6.940 31.429 16.491 1.00 43.13 C ATOM 282 C LYS A 23 -6.621 30.889 15.101 1.00 22.45 C ATOM 283 O LYS A 23 -6.445 29.684 14.918 1.00 22.14 O ATOM 284 CB LYS A 23 -8.124 32.397 16.417 1.00 55.33 C ATOM 285 CG LYS A 23 -7.712 33.849 16.246 1.00 71.04 C ATOM 286 CD LYS A 23 -8.746 34.632 15.454 1.00 73.33 C ATOM 287 CE LYS A 23 -8.808 34.168 14.006 1.00 45.34 C ATOM 288 NZ LYS A 23 -9.599 35.102 13.158 1.00 1.43 N ATOM 0 H LYS A 23 -5.996 32.943 17.594 1.00 53.04 H new ATOM 0 HA LYS A 23 -7.205 30.590 17.134 1.00 43.13 H new ATOM 0 HB2 LYS A 23 -8.766 32.110 15.584 1.00 55.33 H new ATOM 0 HB3 LYS A 23 -8.718 32.301 17.326 1.00 55.33 H new ATOM 0 HG2 LYS A 23 -7.578 34.308 17.226 1.00 71.04 H new ATOM 0 HG3 LYS A 23 -6.749 33.898 15.737 1.00 71.04 H new ATOM 0 HD2 LYS A 23 -9.726 34.515 15.917 1.00 73.33 H new ATOM 0 HD3 LYS A 23 -8.503 35.694 15.487 1.00 73.33 H new ATOM 0 HE2 LYS A 23 -7.797 34.084 13.608 1.00 45.34 H new ATOM 0 HE3 LYS A 23 -9.252 33.173 13.962 1.00 45.34 H new ATOM 0 HZ1 LYS A 23 -9.618 34.751 12.179 1.00 1.43 H new ATOM 0 HZ2 LYS A 23 -10.571 35.163 13.522 1.00 1.43 H new ATOM 0 HZ3 LYS A 23 -9.162 36.045 13.179 1.00 1.43 H new ATOM 298 N SER A 24 -6.548 31.788 14.125 1.00 52.42 N ATOM 299 CA SER A 24 -6.253 31.401 12.751 1.00 14.12 C ATOM 300 C SER A 24 -5.226 30.273 12.712 1.00 74.14 C ATOM 301 O SER A 24 -5.242 29.434 11.810 1.00 45.03 O ATOM 302 CB SER A 24 -5.735 32.604 11.959 1.00 54.43 C ATOM 303 OG SER A 24 -6.593 32.908 10.873 1.00 72.43 O ATOM 0 H SER A 24 -6.689 32.789 14.260 1.00 52.42 H new ATOM 0 HA SER A 24 -7.177 31.045 12.295 1.00 14.12 H new ATOM 0 HB2 SER A 24 -5.656 33.469 12.617 1.00 54.43 H new ATOM 0 HB3 SER A 24 -4.732 32.394 11.587 1.00 54.43 H new ATOM 0 HG SER A 24 -6.241 33.681 10.384 1.00 72.43 H new ATOM 308 N TYR A 25 -4.335 30.258 13.697 1.00 21.44 N ATOM 309 CA TYR A 25 -3.299 29.236 13.776 1.00 73.03 C ATOM 310 C TYR A 25 -3.833 27.970 14.439 1.00 55.13 C ATOM 311 O TYR A 25 -3.790 26.885 13.857 1.00 32.04 O ATOM 312 CB TYR A 25 -2.092 29.761 14.553 1.00 43.14 C ATOM 313 CG TYR A 25 -1.493 31.019 13.965 1.00 20.33 C ATOM 314 CD1 TYR A 25 -2.216 32.206 13.931 1.00 34.41 C ATOM 315 CD2 TYR A 25 -0.206 31.021 13.443 1.00 15.14 C ATOM 316 CE1 TYR A 25 -1.675 33.356 13.394 1.00 4.53 C ATOM 317 CE2 TYR A 25 0.345 32.168 12.905 1.00 30.04 C ATOM 318 CZ TYR A 25 -0.393 33.334 12.882 1.00 73.31 C ATOM 319 OH TYR A 25 0.151 34.478 12.347 1.00 33.12 O ATOM 0 H TYR A 25 -4.310 30.943 14.452 1.00 21.44 H new ATOM 0 HA TYR A 25 -2.989 28.990 12.760 1.00 73.03 H new ATOM 0 HB2 TYR A 25 -2.391 29.958 15.582 1.00 43.14 H new ATOM 0 HB3 TYR A 25 -1.327 28.986 14.586 1.00 43.14 H new ATOM 0 HD1 TYR A 25 -3.219 32.228 14.332 1.00 34.41 H new ATOM 0 HD2 TYR A 25 0.374 30.110 13.458 1.00 15.14 H new ATOM 0 HE1 TYR A 25 -2.252 34.269 13.374 1.00 4.53 H new ATOM 0 HE2 TYR A 25 1.348 32.152 12.505 1.00 30.04 H new ATOM 0 HH TYR A 25 1.060 34.292 12.032 1.00 33.12 H new ATOM 328 N ALA A 26 -4.337 28.116 15.660 1.00 14.24 N ATOM 329 CA ALA A 26 -4.882 26.987 16.401 1.00 61.34 C ATOM 330 C ALA A 26 -6.199 26.515 15.794 1.00 41.35 C ATOM 331 O ALA A 26 -6.391 25.323 15.556 1.00 61.10 O ATOM 332 CB ALA A 26 -5.077 27.360 17.864 1.00 52.25 C ATOM 0 H ALA A 26 -4.379 29.006 16.157 1.00 14.24 H new ATOM 0 HA ALA A 26 -4.168 26.165 16.338 1.00 61.34 H new ATOM 0 HB1 ALA A 26 -5.485 26.507 18.406 1.00 52.25 H new ATOM 0 HB2 ALA A 26 -4.118 27.641 18.299 1.00 52.25 H new ATOM 0 HB3 ALA A 26 -5.768 28.200 17.936 1.00 52.25 H new ATOM 338 N GLU A 27 -7.103 27.458 15.548 1.00 75.01 N ATOM 339 CA GLU A 27 -8.402 27.136 14.970 1.00 22.44 C ATOM 340 C GLU A 27 -8.247 26.232 13.750 1.00 2.14 C ATOM 341 O GLU A 27 -8.811 25.139 13.700 1.00 23.23 O ATOM 342 CB GLU A 27 -9.142 28.417 14.578 1.00 3.13 C ATOM 343 CG GLU A 27 -10.581 28.184 14.150 1.00 73.23 C ATOM 344 CD GLU A 27 -11.583 28.731 15.147 1.00 62.43 C ATOM 345 OE1 GLU A 27 -11.388 29.870 15.620 1.00 64.44 O ATOM 346 OE2 GLU A 27 -12.562 28.020 15.456 1.00 15.20 O ATOM 0 H GLU A 27 -6.960 28.450 15.740 1.00 75.01 H new ATOM 0 HA GLU A 27 -8.984 26.604 15.723 1.00 22.44 H new ATOM 0 HB2 GLU A 27 -9.130 29.106 15.423 1.00 3.13 H new ATOM 0 HB3 GLU A 27 -8.604 28.902 13.764 1.00 3.13 H new ATOM 0 HG2 GLU A 27 -10.748 28.652 13.180 1.00 73.23 H new ATOM 0 HG3 GLU A 27 -10.749 27.115 14.021 1.00 73.23 H new ATOM 351 N GLN A 28 -7.480 26.698 12.770 1.00 55.54 N ATOM 352 CA GLN A 28 -7.251 25.932 11.550 1.00 73.31 C ATOM 353 C GLN A 28 -6.905 24.483 11.875 1.00 73.01 C ATOM 354 O GLN A 28 -7.357 23.560 11.198 1.00 42.02 O ATOM 355 CB GLN A 28 -6.128 26.566 10.728 1.00 50.42 C ATOM 356 CG GLN A 28 -6.619 27.294 9.487 1.00 43.23 C ATOM 357 CD GLN A 28 -5.602 27.284 8.363 1.00 42.55 C ATOM 358 OE1 GLN A 28 -4.494 27.805 8.508 1.00 73.32 O ATOM 359 NE2 GLN A 28 -5.971 26.690 7.235 1.00 43.11 N ATOM 0 H GLN A 28 -7.007 27.601 12.796 1.00 55.54 H new ATOM 0 HA GLN A 28 -8.170 25.944 10.965 1.00 73.31 H new ATOM 0 HB2 GLN A 28 -5.580 27.267 11.357 1.00 50.42 H new ATOM 0 HB3 GLN A 28 -5.425 25.789 10.429 1.00 50.42 H new ATOM 0 HG2 GLN A 28 -7.543 26.830 9.140 1.00 43.23 H new ATOM 0 HG3 GLN A 28 -6.858 28.325 9.746 1.00 43.23 H new ATOM 0 HE21 GLN A 28 -6.898 26.272 7.159 1.00 43.11 H new ATOM 0 HE22 GLN A 28 -5.328 26.652 6.445 1.00 43.11 H new ATOM 366 N GLY A 29 -6.098 24.290 12.914 1.00 53.02 N ATOM 367 CA GLY A 29 -5.705 22.950 13.309 1.00 52.30 C ATOM 368 C GLY A 29 -6.853 22.159 13.902 1.00 21.14 C ATOM 369 O GLY A 29 -7.140 21.044 13.465 1.00 34.54 O ATOM 0 H GLY A 29 -5.710 25.038 13.489 1.00 53.02 H new ATOM 0 HA2 GLY A 29 -5.313 22.420 12.441 1.00 52.30 H new ATOM 0 HA3 GLY A 29 -4.896 23.012 14.037 1.00 52.30 H new ATOM 372 N LYS A 30 -7.514 22.735 14.900 1.00 5.21 N ATOM 373 CA LYS A 30 -8.639 22.077 15.555 1.00 43.24 C ATOM 374 C LYS A 30 -9.738 21.751 14.550 1.00 71.14 C ATOM 375 O LYS A 30 -10.265 20.639 14.534 1.00 20.12 O ATOM 376 CB LYS A 30 -9.198 22.966 16.669 1.00 54.31 C ATOM 377 CG LYS A 30 -8.938 22.427 18.064 1.00 23.41 C ATOM 378 CD LYS A 30 -8.382 23.503 18.983 1.00 34.21 C ATOM 379 CE LYS A 30 -6.864 23.575 18.901 1.00 70.42 C ATOM 380 NZ LYS A 30 -6.213 22.795 19.991 1.00 24.43 N ATOM 0 H LYS A 30 -7.290 23.657 15.274 1.00 5.21 H new ATOM 0 HA LYS A 30 -8.280 21.144 15.989 1.00 43.24 H new ATOM 0 HB2 LYS A 30 -8.758 23.960 16.585 1.00 54.31 H new ATOM 0 HB3 LYS A 30 -10.273 23.080 16.527 1.00 54.31 H new ATOM 0 HG2 LYS A 30 -9.865 22.034 18.482 1.00 23.41 H new ATOM 0 HG3 LYS A 30 -8.235 21.596 18.009 1.00 23.41 H new ATOM 0 HD2 LYS A 30 -8.808 24.469 18.714 1.00 34.21 H new ATOM 0 HD3 LYS A 30 -8.683 23.297 20.010 1.00 34.21 H new ATOM 0 HE2 LYS A 30 -6.534 23.194 17.935 1.00 70.42 H new ATOM 0 HE3 LYS A 30 -6.546 24.616 18.959 1.00 70.42 H new ATOM 0 HZ1 LYS A 30 -5.180 22.869 19.901 1.00 24.43 H new ATOM 0 HZ2 LYS A 30 -6.508 23.174 20.913 1.00 24.43 H new ATOM 0 HZ3 LYS A 30 -6.496 21.797 19.921 1.00 24.43 H new ATOM 390 N GLU A 31 -10.077 22.726 13.712 1.00 71.00 N ATOM 391 CA GLU A 31 -11.113 22.540 12.704 1.00 32.10 C ATOM 392 C GLU A 31 -10.956 21.193 12.003 1.00 64.44 C ATOM 393 O GLU A 31 -11.940 20.572 11.600 1.00 2.30 O ATOM 394 CB GLU A 31 -11.064 23.671 11.675 1.00 42.12 C ATOM 395 CG GLU A 31 -11.426 25.031 12.248 1.00 20.14 C ATOM 396 CD GLU A 31 -12.692 25.602 11.640 1.00 13.25 C ATOM 397 OE1 GLU A 31 -12.696 25.867 10.419 1.00 2.13 O ATOM 398 OE2 GLU A 31 -13.678 25.783 12.383 1.00 31.51 O ATOM 0 H GLU A 31 -9.649 23.652 13.712 1.00 71.00 H new ATOM 0 HA GLU A 31 -12.080 22.558 13.207 1.00 32.10 H new ATOM 0 HB2 GLU A 31 -10.062 23.720 11.249 1.00 42.12 H new ATOM 0 HB3 GLU A 31 -11.746 23.437 10.858 1.00 42.12 H new ATOM 0 HG2 GLU A 31 -11.553 24.944 13.327 1.00 20.14 H new ATOM 0 HG3 GLU A 31 -10.602 25.724 12.078 1.00 20.14 H new ATOM 403 N TYR A 32 -9.712 20.749 11.861 1.00 61.52 N ATOM 404 CA TYR A 32 -9.424 19.478 11.207 1.00 62.00 C ATOM 405 C TYR A 32 -9.677 18.309 12.155 1.00 54.53 C ATOM 406 O TYR A 32 -10.106 17.234 11.731 1.00 43.40 O ATOM 407 CB TYR A 32 -7.976 19.449 10.718 1.00 40.33 C ATOM 408 CG TYR A 32 -7.533 18.093 10.217 1.00 11.45 C ATOM 409 CD1 TYR A 32 -7.306 17.044 11.098 1.00 65.12 C ATOM 410 CD2 TYR A 32 -7.342 17.861 8.860 1.00 10.45 C ATOM 411 CE1 TYR A 32 -6.901 15.804 10.644 1.00 41.00 C ATOM 412 CE2 TYR A 32 -6.938 16.624 8.396 1.00 34.32 C ATOM 413 CZ TYR A 32 -6.720 15.599 9.292 1.00 41.41 C ATOM 414 OH TYR A 32 -6.317 14.365 8.835 1.00 74.33 O ATOM 0 H TYR A 32 -8.887 21.250 12.190 1.00 61.52 H new ATOM 0 HA TYR A 32 -10.091 19.379 10.351 1.00 62.00 H new ATOM 0 HB2 TYR A 32 -7.857 20.179 9.918 1.00 40.33 H new ATOM 0 HB3 TYR A 32 -7.320 19.758 11.532 1.00 40.33 H new ATOM 0 HD1 TYR A 32 -7.449 17.200 12.157 1.00 65.12 H new ATOM 0 HD2 TYR A 32 -7.512 18.662 8.156 1.00 10.45 H new ATOM 0 HE1 TYR A 32 -6.727 15.000 11.343 1.00 41.00 H new ATOM 0 HE2 TYR A 32 -6.794 16.461 7.338 1.00 34.32 H new ATOM 0 HH TYR A 32 -6.238 14.388 7.858 1.00 74.33 H new ATOM 423 N ILE A 33 -9.409 18.527 13.437 1.00 51.14 N ATOM 424 CA ILE A 33 -9.608 17.492 14.445 1.00 22.34 C ATOM 425 C ILE A 33 -11.039 17.508 14.973 1.00 51.15 C ATOM 426 O ILE A 33 -11.765 16.520 14.860 1.00 63.15 O ATOM 427 CB ILE A 33 -8.635 17.662 15.627 1.00 54.13 C ATOM 428 CG1 ILE A 33 -7.228 17.212 15.225 1.00 22.11 C ATOM 429 CG2 ILE A 33 -9.125 16.876 16.833 1.00 54.53 C ATOM 430 CD1 ILE A 33 -6.511 18.199 14.331 1.00 43.22 C ATOM 0 H ILE A 33 -9.054 19.410 13.803 1.00 51.14 H new ATOM 0 HA ILE A 33 -9.412 16.536 13.959 1.00 22.34 H new ATOM 0 HB ILE A 33 -8.595 18.717 15.898 1.00 54.13 H new ATOM 0 HG12 ILE A 33 -6.635 17.052 16.126 1.00 22.11 H new ATOM 0 HG13 ILE A 33 -7.295 16.252 14.713 1.00 22.11 H new ATOM 0 HG21 ILE A 33 -8.427 17.006 17.660 1.00 54.53 H new ATOM 0 HG22 ILE A 33 -10.109 17.239 17.128 1.00 54.53 H new ATOM 0 HG23 ILE A 33 -9.190 15.819 16.576 1.00 54.53 H new ATOM 0 HD11 ILE A 33 -5.521 17.815 14.086 1.00 43.22 H new ATOM 0 HD12 ILE A 33 -7.082 18.341 13.414 1.00 43.22 H new ATOM 0 HD13 ILE A 33 -6.413 19.153 14.848 1.00 43.22 H new ATOM 441 N THR A 34 -11.439 18.637 15.549 1.00 44.33 N ATOM 442 CA THR A 34 -12.782 18.783 16.094 1.00 54.01 C ATOM 443 C THR A 34 -13.790 17.962 15.298 1.00 71.42 C ATOM 444 O THR A 34 -14.603 17.234 15.870 1.00 2.41 O ATOM 445 CB THR A 34 -13.229 20.257 16.101 1.00 60.22 C ATOM 446 OG1 THR A 34 -14.635 20.341 16.355 1.00 34.33 O ATOM 447 CG2 THR A 34 -12.906 20.927 14.774 1.00 31.21 C ATOM 0 H THR A 34 -10.851 19.464 15.650 1.00 44.33 H new ATOM 0 HA THR A 34 -12.748 18.417 17.120 1.00 54.01 H new ATOM 0 HB THR A 34 -12.686 20.775 16.892 1.00 60.22 H new ATOM 0 HG1 THR A 34 -14.911 21.281 16.359 1.00 34.33 H new ATOM 0 HG21 THR A 34 -13.231 21.967 14.803 1.00 31.21 H new ATOM 0 HG22 THR A 34 -11.831 20.887 14.599 1.00 31.21 H new ATOM 0 HG23 THR A 34 -13.424 20.407 13.968 1.00 31.21 H new ATOM 455 N ASP A 35 -13.734 18.084 13.976 1.00 4.10 N ATOM 456 CA ASP A 35 -14.641 17.351 13.101 1.00 64.40 C ATOM 457 C ASP A 35 -14.263 15.875 13.040 1.00 32.42 C ATOM 458 O ASP A 35 -15.077 15.002 13.344 1.00 31.52 O ATOM 459 CB ASP A 35 -14.624 17.953 11.695 1.00 33.43 C ATOM 460 CG ASP A 35 -16.019 18.172 11.142 1.00 22.40 C ATOM 461 OD1 ASP A 35 -16.837 18.817 11.831 1.00 23.11 O ATOM 462 OD2 ASP A 35 -16.293 17.698 10.019 1.00 45.02 O ATOM 0 H ASP A 35 -13.070 18.684 13.487 1.00 4.10 H new ATOM 0 HA ASP A 35 -15.648 17.433 13.511 1.00 64.40 H new ATOM 0 HB2 ASP A 35 -14.091 18.904 11.716 1.00 33.43 H new ATOM 0 HB3 ASP A 35 -14.071 17.293 11.027 1.00 33.43 H new ATOM 466 N LYS A 36 -13.025 15.602 12.645 1.00 72.10 N ATOM 467 CA LYS A 36 -12.538 14.231 12.543 1.00 71.41 C ATOM 468 C LYS A 36 -12.600 13.531 13.897 1.00 44.03 C ATOM 469 O LYS A 36 -13.210 12.470 14.031 1.00 41.00 O ATOM 470 CB LYS A 36 -11.102 14.216 12.013 1.00 62.32 C ATOM 471 CG LYS A 36 -10.831 13.093 11.027 1.00 2.32 C ATOM 472 CD LYS A 36 -11.449 13.383 9.670 1.00 12.32 C ATOM 473 CE LYS A 36 -11.061 12.329 8.644 1.00 51.15 C ATOM 474 NZ LYS A 36 -12.124 12.133 7.620 1.00 12.21 N ATOM 0 H LYS A 36 -12.339 16.313 12.390 1.00 72.10 H new ATOM 0 HA LYS A 36 -13.181 13.693 11.846 1.00 71.41 H new ATOM 0 HB2 LYS A 36 -10.891 15.171 11.531 1.00 62.32 H new ATOM 0 HB3 LYS A 36 -10.414 14.125 12.853 1.00 62.32 H new ATOM 0 HG2 LYS A 36 -9.755 12.956 10.916 1.00 2.32 H new ATOM 0 HG3 LYS A 36 -11.233 12.158 11.419 1.00 2.32 H new ATOM 0 HD2 LYS A 36 -12.534 13.419 9.764 1.00 12.32 H new ATOM 0 HD3 LYS A 36 -11.126 14.365 9.324 1.00 12.32 H new ATOM 0 HE2 LYS A 36 -10.134 12.624 8.153 1.00 51.15 H new ATOM 0 HE3 LYS A 36 -10.866 11.384 9.151 1.00 51.15 H new ATOM 0 HZ1 LYS A 36 -11.821 11.407 6.940 1.00 12.21 H new ATOM 0 HZ2 LYS A 36 -13.002 11.826 8.085 1.00 12.21 H new ATOM 0 HZ3 LYS A 36 -12.292 13.028 7.119 1.00 12.21 H new ATOM 484 N ALA A 37 -11.964 14.131 14.898 1.00 62.21 N ATOM 485 CA ALA A 37 -11.950 13.567 16.242 1.00 60.15 C ATOM 486 C ALA A 37 -13.347 13.127 16.668 1.00 0.22 C ATOM 487 O ALA A 37 -13.548 11.986 17.084 1.00 60.51 O ATOM 488 CB ALA A 37 -11.387 14.575 17.232 1.00 61.43 C ATOM 0 H ALA A 37 -11.452 15.008 14.803 1.00 62.21 H new ATOM 0 HA ALA A 37 -11.308 12.686 16.233 1.00 60.15 H new ATOM 0 HB1 ALA A 37 -11.383 14.140 18.231 1.00 61.43 H new ATOM 0 HB2 ALA A 37 -10.368 14.836 16.946 1.00 61.43 H new ATOM 0 HB3 ALA A 37 -12.006 15.472 17.230 1.00 61.43 H new ATOM 494 N ASP A 38 -14.307 14.039 16.562 1.00 54.21 N ATOM 495 CA ASP A 38 -15.686 13.745 16.935 1.00 65.13 C ATOM 496 C ASP A 38 -16.146 12.427 16.320 1.00 51.44 C ATOM 497 O ASP A 38 -17.046 11.767 16.840 1.00 25.11 O ATOM 498 CB ASP A 38 -16.610 14.879 16.491 1.00 33.21 C ATOM 499 CG ASP A 38 -17.967 14.818 17.164 1.00 65.13 C ATOM 500 OD1 ASP A 38 -18.026 15.005 18.398 1.00 1.51 O ATOM 501 OD2 ASP A 38 -18.969 14.584 16.458 1.00 64.13 O ATOM 0 H ASP A 38 -14.156 14.988 16.221 1.00 54.21 H new ATOM 0 HA ASP A 38 -15.731 13.654 18.020 1.00 65.13 H new ATOM 0 HB2 ASP A 38 -16.139 15.836 16.715 1.00 33.21 H new ATOM 0 HB3 ASP A 38 -16.742 14.834 15.410 1.00 33.21 H new ATOM 505 N LYS A 39 -15.524 12.048 15.209 1.00 5.51 N ATOM 506 CA LYS A 39 -15.867 10.809 14.523 1.00 32.15 C ATOM 507 C LYS A 39 -14.925 9.681 14.931 1.00 31.41 C ATOM 508 O LYS A 39 -15.352 8.542 15.123 1.00 42.51 O ATOM 509 CB LYS A 39 -15.814 11.010 13.007 1.00 53.51 C ATOM 510 CG LYS A 39 -16.598 9.969 12.227 1.00 1.15 C ATOM 511 CD LYS A 39 -17.882 10.551 11.657 1.00 4.20 C ATOM 512 CE LYS A 39 -18.911 10.803 12.747 1.00 60.41 C ATOM 513 NZ LYS A 39 -19.320 9.543 13.426 1.00 72.33 N ATOM 0 H LYS A 39 -14.778 12.583 14.764 1.00 5.51 H new ATOM 0 HA LYS A 39 -16.881 10.532 14.811 1.00 32.15 H new ATOM 0 HB2 LYS A 39 -16.202 12.000 12.767 1.00 53.51 H new ATOM 0 HB3 LYS A 39 -14.774 10.988 12.682 1.00 53.51 H new ATOM 0 HG2 LYS A 39 -15.982 9.580 11.416 1.00 1.15 H new ATOM 0 HG3 LYS A 39 -16.836 9.128 12.878 1.00 1.15 H new ATOM 0 HD2 LYS A 39 -17.661 11.485 11.140 1.00 4.20 H new ATOM 0 HD3 LYS A 39 -18.295 9.867 10.916 1.00 4.20 H new ATOM 0 HE2 LYS A 39 -18.499 11.494 13.482 1.00 60.41 H new ATOM 0 HE3 LYS A 39 -19.788 11.283 12.314 1.00 60.41 H new ATOM 0 HZ1 LYS A 39 -20.232 9.687 13.904 1.00 72.33 H new ATOM 0 HZ2 LYS A 39 -19.414 8.784 12.722 1.00 72.33 H new ATOM 0 HZ3 LYS A 39 -18.600 9.277 14.128 1.00 72.33 H new ATOM 523 N VAL A 40 -13.643 10.006 15.062 1.00 72.22 N ATOM 524 CA VAL A 40 -12.641 9.020 15.449 1.00 61.32 C ATOM 525 C VAL A 40 -12.934 8.454 16.834 1.00 4.41 C ATOM 526 O VAL A 40 -12.260 7.533 17.295 1.00 51.24 O ATOM 527 CB VAL A 40 -11.225 9.626 15.444 1.00 14.44 C ATOM 528 CG1 VAL A 40 -11.066 10.598 14.284 1.00 21.12 C ATOM 529 CG2 VAL A 40 -10.934 10.312 16.769 1.00 42.22 C ATOM 0 H VAL A 40 -13.274 10.944 14.906 1.00 72.22 H new ATOM 0 HA VAL A 40 -12.687 8.217 14.713 1.00 61.32 H new ATOM 0 HB VAL A 40 -10.503 8.820 15.314 1.00 14.44 H new ATOM 0 HG11 VAL A 40 -10.060 11.017 14.296 1.00 21.12 H new ATOM 0 HG12 VAL A 40 -11.229 10.072 13.343 1.00 21.12 H new ATOM 0 HG13 VAL A 40 -11.795 11.403 14.381 1.00 21.12 H new ATOM 0 HG21 VAL A 40 -9.929 10.734 16.747 1.00 42.22 H new ATOM 0 HG22 VAL A 40 -11.659 11.109 16.933 1.00 42.22 H new ATOM 0 HG23 VAL A 40 -11.005 9.585 17.578 1.00 42.22 H new ATOM 539 N ALA A 41 -13.944 9.012 17.494 1.00 5.11 N ATOM 540 CA ALA A 41 -14.327 8.562 18.826 1.00 61.31 C ATOM 541 C ALA A 41 -15.482 7.569 18.759 1.00 35.32 C ATOM 542 O ALA A 41 -15.792 6.893 19.738 1.00 63.23 O ATOM 543 CB ALA A 41 -14.702 9.751 19.698 1.00 22.33 C ATOM 0 H ALA A 41 -14.511 9.776 17.128 1.00 5.11 H new ATOM 0 HA ALA A 41 -13.471 8.055 19.271 1.00 61.31 H new ATOM 0 HB1 ALA A 41 -14.986 9.400 20.690 1.00 22.33 H new ATOM 0 HB2 ALA A 41 -13.849 10.424 19.782 1.00 22.33 H new ATOM 0 HB3 ALA A 41 -15.540 10.282 19.248 1.00 22.33 H new ATOM 549 N GLY A 42 -16.119 7.486 17.594 1.00 15.51 N ATOM 550 CA GLY A 42 -17.233 6.574 17.420 1.00 72.31 C ATOM 551 C GLY A 42 -16.797 5.218 16.900 1.00 23.33 C ATOM 552 O GLY A 42 -17.575 4.263 16.904 1.00 41.24 O ATOM 0 H GLY A 42 -15.882 8.035 16.768 1.00 15.51 H new ATOM 0 HA2 GLY A 42 -17.746 6.446 18.373 1.00 72.31 H new ATOM 0 HA3 GLY A 42 -17.952 7.011 16.727 1.00 72.31 H new ATOM 555 N LYS A 43 -15.551 5.133 16.448 1.00 32.13 N ATOM 556 CA LYS A 43 -15.013 3.885 15.920 1.00 40.43 C ATOM 557 C LYS A 43 -13.741 3.485 16.663 1.00 14.11 C ATOM 558 O LYS A 43 -13.504 2.303 16.915 1.00 63.13 O ATOM 559 CB LYS A 43 -14.719 4.024 14.425 1.00 53.15 C ATOM 560 CG LYS A 43 -13.248 4.233 14.110 1.00 44.02 C ATOM 561 CD LYS A 43 -12.856 5.697 14.225 1.00 54.13 C ATOM 562 CE LYS A 43 -13.215 6.470 12.965 1.00 42.30 C ATOM 563 NZ LYS A 43 -12.052 7.235 12.434 1.00 63.31 N ATOM 0 H LYS A 43 -14.894 5.914 16.437 1.00 32.13 H new ATOM 0 HA LYS A 43 -15.761 3.105 16.066 1.00 40.43 H new ATOM 0 HB2 LYS A 43 -15.068 3.129 13.910 1.00 53.15 H new ATOM 0 HB3 LYS A 43 -15.290 4.864 14.028 1.00 53.15 H new ATOM 0 HG2 LYS A 43 -12.641 3.638 14.792 1.00 44.02 H new ATOM 0 HG3 LYS A 43 -13.037 3.877 13.102 1.00 44.02 H new ATOM 0 HD2 LYS A 43 -13.359 6.143 15.083 1.00 54.13 H new ATOM 0 HD3 LYS A 43 -11.784 5.775 14.408 1.00 54.13 H new ATOM 0 HE2 LYS A 43 -13.573 5.777 12.203 1.00 42.30 H new ATOM 0 HE3 LYS A 43 -14.034 7.157 13.181 1.00 42.30 H new ATOM 0 HZ1 LYS A 43 -12.386 8.123 12.007 1.00 63.31 H new ATOM 0 HZ2 LYS A 43 -11.394 7.450 13.210 1.00 63.31 H new ATOM 0 HZ3 LYS A 43 -11.563 6.667 11.713 1.00 63.31 H new ATOM 573 N VAL A 44 -12.928 4.476 17.013 1.00 72.11 N ATOM 574 CA VAL A 44 -11.683 4.228 17.730 1.00 14.42 C ATOM 575 C VAL A 44 -11.626 2.796 18.251 1.00 42.22 C ATOM 576 O VAL A 44 -12.321 2.444 19.203 1.00 24.51 O ATOM 577 CB VAL A 44 -11.512 5.200 18.911 1.00 3.11 C ATOM 578 CG1 VAL A 44 -12.868 5.617 19.460 1.00 42.44 C ATOM 579 CG2 VAL A 44 -10.656 4.569 20.000 1.00 24.44 C ATOM 0 H VAL A 44 -13.109 5.459 16.811 1.00 72.11 H new ATOM 0 HA VAL A 44 -10.871 4.386 17.020 1.00 14.42 H new ATOM 0 HB VAL A 44 -11.002 6.094 18.553 1.00 3.11 H new ATOM 0 HG11 VAL A 44 -12.727 6.304 20.294 1.00 42.44 H new ATOM 0 HG12 VAL A 44 -13.442 6.111 18.676 1.00 42.44 H new ATOM 0 HG13 VAL A 44 -13.408 4.735 19.804 1.00 42.44 H new ATOM 0 HG21 VAL A 44 -10.545 5.270 20.827 1.00 24.44 H new ATOM 0 HG22 VAL A 44 -11.136 3.658 20.358 1.00 24.44 H new ATOM 0 HG23 VAL A 44 -9.673 4.327 19.596 1.00 24.44 H new ATOM 589 N GLN A 45 -10.792 1.975 17.621 1.00 3.45 N ATOM 590 CA GLN A 45 -10.644 0.582 18.021 1.00 64.44 C ATOM 591 C GLN A 45 -10.407 0.469 19.525 1.00 23.25 C ATOM 592 O GLN A 45 -9.339 0.808 20.036 1.00 60.42 O ATOM 593 CB GLN A 45 -9.487 -0.070 17.261 1.00 71.42 C ATOM 594 CG GLN A 45 -9.937 -0.914 16.080 1.00 55.20 C ATOM 595 CD GLN A 45 -9.622 -2.386 16.260 1.00 21.03 C ATOM 596 OE1 GLN A 45 -8.489 -2.757 16.568 1.00 44.13 O ATOM 597 NE2 GLN A 45 -10.626 -3.234 16.069 1.00 51.23 N ATOM 0 H GLN A 45 -10.209 2.251 16.831 1.00 3.45 H new ATOM 0 HA GLN A 45 -11.570 0.061 17.777 1.00 64.44 H new ATOM 0 HB2 GLN A 45 -8.812 0.708 16.905 1.00 71.42 H new ATOM 0 HB3 GLN A 45 -8.918 -0.696 17.949 1.00 71.42 H new ATOM 0 HG2 GLN A 45 -11.011 -0.791 15.939 1.00 55.20 H new ATOM 0 HG3 GLN A 45 -9.453 -0.551 15.174 1.00 55.20 H new ATOM 0 HE21 GLN A 45 -11.549 -2.882 15.815 1.00 51.23 H new ATOM 0 HE22 GLN A 45 -10.474 -4.237 16.177 1.00 51.23 H new ATOM 604 N PRO A 46 -11.426 -0.016 20.251 1.00 10.53 N ATOM 605 CA PRO A 46 -11.352 -0.183 21.705 1.00 41.21 C ATOM 606 C PRO A 46 -10.400 -1.303 22.111 1.00 42.21 C ATOM 607 O PRO A 46 -9.920 -1.340 23.244 1.00 41.21 O ATOM 608 CB PRO A 46 -12.789 -0.536 22.094 1.00 65.31 C ATOM 609 CG PRO A 46 -13.377 -1.141 20.867 1.00 13.05 C ATOM 610 CD PRO A 46 -12.727 -0.438 19.707 1.00 11.02 C ATOM 0 HA PRO A 46 -10.969 0.710 22.200 1.00 41.21 H new ATOM 0 HB2 PRO A 46 -12.812 -1.235 22.930 1.00 65.31 H new ATOM 0 HB3 PRO A 46 -13.344 0.350 22.404 1.00 65.31 H new ATOM 0 HG2 PRO A 46 -13.186 -2.213 20.830 1.00 13.05 H new ATOM 0 HG3 PRO A 46 -14.459 -1.009 20.847 1.00 13.05 H new ATOM 0 HD2 PRO A 46 -12.608 -1.101 18.850 1.00 11.02 H new ATOM 0 HD3 PRO A 46 -13.318 0.414 19.371 1.00 11.02 H new ATOM 615 N GLU A 47 -10.132 -2.213 21.181 1.00 54.31 N ATOM 616 CA GLU A 47 -9.237 -3.334 21.444 1.00 12.31 C ATOM 617 C GLU A 47 -7.797 -2.978 21.084 1.00 1.33 C ATOM 618 O GLU A 47 -6.864 -3.706 21.419 1.00 4.21 O ATOM 619 CB GLU A 47 -9.682 -4.567 20.655 1.00 44.22 C ATOM 620 CG GLU A 47 -11.073 -5.054 21.021 1.00 65.25 C ATOM 621 CD GLU A 47 -11.092 -6.517 21.423 1.00 33.23 C ATOM 622 OE1 GLU A 47 -10.460 -7.332 20.718 1.00 73.13 O ATOM 623 OE2 GLU A 47 -11.738 -6.846 22.438 1.00 25.34 O ATOM 0 H GLU A 47 -10.522 -2.196 20.238 1.00 54.31 H new ATOM 0 HA GLU A 47 -9.281 -3.558 22.510 1.00 12.31 H new ATOM 0 HB2 GLU A 47 -9.656 -4.335 19.590 1.00 44.22 H new ATOM 0 HB3 GLU A 47 -8.968 -5.373 20.824 1.00 44.22 H new ATOM 0 HG2 GLU A 47 -11.461 -4.450 21.842 1.00 65.25 H new ATOM 0 HG3 GLU A 47 -11.741 -4.905 20.173 1.00 65.25 H new ATOM 628 N ASP A 48 -7.627 -1.853 20.397 1.00 10.14 N ATOM 629 CA ASP A 48 -6.302 -1.399 19.991 1.00 32.43 C ATOM 630 C ASP A 48 -5.757 -0.365 20.971 1.00 64.43 C ATOM 631 O ASP A 48 -4.771 0.314 20.689 1.00 34.11 O ATOM 632 CB ASP A 48 -6.353 -0.806 18.582 1.00 31.02 C ATOM 633 CG ASP A 48 -5.005 -0.842 17.889 1.00 34.02 C ATOM 634 OD1 ASP A 48 -4.214 -1.764 18.177 1.00 75.45 O ATOM 635 OD2 ASP A 48 -4.741 0.051 17.057 1.00 63.24 O ATOM 0 H ASP A 48 -8.390 -1.239 20.110 1.00 10.14 H new ATOM 0 HA ASP A 48 -5.634 -2.261 19.991 1.00 32.43 H new ATOM 0 HB2 ASP A 48 -7.080 -1.357 17.985 1.00 31.02 H new ATOM 0 HB3 ASP A 48 -6.702 0.225 18.637 1.00 31.02 H new ATOM 639 N ASN A 49 -6.407 -0.252 22.125 1.00 71.21 N ATOM 640 CA ASN A 49 -5.989 0.701 23.148 1.00 51.44 C ATOM 641 C ASN A 49 -5.325 -0.017 24.320 1.00 11.52 C ATOM 642 O ASN A 49 -4.565 0.584 25.080 1.00 31.23 O ATOM 643 CB ASN A 49 -7.189 1.508 23.644 1.00 21.22 C ATOM 644 CG ASN A 49 -7.333 2.834 22.921 1.00 72.04 C ATOM 645 OD1 ASN A 49 -7.475 2.874 21.699 1.00 13.32 O ATOM 646 ND2 ASN A 49 -7.297 3.926 23.675 1.00 54.32 N ATOM 0 H ASN A 49 -7.225 -0.808 22.375 1.00 71.21 H new ATOM 0 HA ASN A 49 -5.263 1.381 22.702 1.00 51.44 H new ATOM 0 HB2 ASN A 49 -8.098 0.923 23.508 1.00 21.22 H new ATOM 0 HB3 ASN A 49 -7.084 1.690 24.714 1.00 21.22 H new ATOM 0 HD21 ASN A 49 -7.389 4.846 23.245 1.00 54.32 H new ATOM 0 HD22 ASN A 49 -7.177 3.845 24.685 1.00 54.32 H new ATOM 652 N LYS A 50 -5.617 -1.306 24.460 1.00 10.33 N ATOM 653 CA LYS A 50 -5.047 -2.106 25.536 1.00 60.44 C ATOM 654 C LYS A 50 -3.747 -2.770 25.093 1.00 21.23 C ATOM 655 O LYS A 50 -2.937 -3.184 25.921 1.00 73.35 O ATOM 656 CB LYS A 50 -6.047 -3.173 25.990 1.00 0.21 C ATOM 657 CG LYS A 50 -5.533 -4.046 27.121 1.00 75.34 C ATOM 658 CD LYS A 50 -5.162 -5.435 26.629 1.00 74.41 C ATOM 659 CE LYS A 50 -6.020 -6.507 27.285 1.00 51.41 C ATOM 660 NZ LYS A 50 -5.359 -7.841 27.254 1.00 63.52 N ATOM 0 H LYS A 50 -6.245 -1.818 23.841 1.00 10.33 H new ATOM 0 HA LYS A 50 -4.828 -1.441 26.371 1.00 60.44 H new ATOM 0 HB2 LYS A 50 -6.967 -2.684 26.309 1.00 0.21 H new ATOM 0 HB3 LYS A 50 -6.301 -3.806 25.140 1.00 0.21 H new ATOM 0 HG2 LYS A 50 -4.662 -3.576 27.578 1.00 75.34 H new ATOM 0 HG3 LYS A 50 -6.295 -4.125 27.896 1.00 75.34 H new ATOM 0 HD2 LYS A 50 -5.283 -5.483 25.547 1.00 74.41 H new ATOM 0 HD3 LYS A 50 -4.111 -5.629 26.842 1.00 74.41 H new ATOM 0 HE2 LYS A 50 -6.224 -6.227 28.318 1.00 51.41 H new ATOM 0 HE3 LYS A 50 -6.981 -6.566 26.774 1.00 51.41 H new ATOM 0 HZ1 LYS A 50 -5.975 -8.544 27.710 1.00 63.52 H new ATOM 0 HZ2 LYS A 50 -5.187 -8.120 26.267 1.00 63.52 H new ATOM 0 HZ3 LYS A 50 -4.453 -7.792 27.763 1.00 63.52 H new ATOM 670 N GLY A 51 -3.553 -2.863 23.781 1.00 71.10 N ATOM 671 CA GLY A 51 -2.348 -3.475 23.251 1.00 34.50 C ATOM 672 C GLY A 51 -1.140 -2.568 23.364 1.00 11.24 C ATOM 673 O GLY A 51 -0.009 -3.040 23.485 1.00 43.21 O ATOM 0 H GLY A 51 -4.208 -2.526 23.076 1.00 71.10 H new ATOM 0 HA2 GLY A 51 -2.152 -4.405 23.785 1.00 34.50 H new ATOM 0 HA3 GLY A 51 -2.506 -3.735 22.204 1.00 34.50 H new ATOM 676 N VAL A 52 -1.377 -1.261 23.321 1.00 3.35 N ATOM 677 CA VAL A 52 -0.299 -0.284 23.419 1.00 53.44 C ATOM 678 C VAL A 52 0.380 -0.350 24.782 1.00 42.23 C ATOM 679 O VAL A 52 1.599 -0.204 24.888 1.00 41.05 O ATOM 680 CB VAL A 52 -0.814 1.148 23.183 1.00 34.32 C ATOM 681 CG1 VAL A 52 -1.467 1.261 21.814 1.00 35.34 C ATOM 682 CG2 VAL A 52 -1.787 1.551 24.281 1.00 50.43 C ATOM 0 H VAL A 52 -2.307 -0.854 23.219 1.00 3.35 H new ATOM 0 HA VAL A 52 0.425 -0.533 22.643 1.00 53.44 H new ATOM 0 HB VAL A 52 0.035 1.831 23.212 1.00 34.32 H new ATOM 0 HG11 VAL A 52 -1.825 2.280 21.665 1.00 35.34 H new ATOM 0 HG12 VAL A 52 -0.738 1.016 21.042 1.00 35.34 H new ATOM 0 HG13 VAL A 52 -2.307 0.569 21.753 1.00 35.34 H new ATOM 0 HG21 VAL A 52 -2.141 2.566 24.099 1.00 50.43 H new ATOM 0 HG22 VAL A 52 -2.635 0.866 24.285 1.00 50.43 H new ATOM 0 HG23 VAL A 52 -1.283 1.511 25.247 1.00 50.43 H new ATOM 692 N PHE A 53 -0.415 -0.569 25.823 1.00 43.13 N ATOM 693 CA PHE A 53 0.110 -0.654 27.181 1.00 30.33 C ATOM 694 C PHE A 53 0.515 -2.086 27.520 1.00 21.21 C ATOM 695 O PHE A 53 1.035 -2.355 28.603 1.00 11.24 O ATOM 696 CB PHE A 53 -0.934 -0.157 28.185 1.00 12.22 C ATOM 697 CG PHE A 53 -0.698 1.254 28.644 1.00 31.01 C ATOM 698 CD1 PHE A 53 -0.263 2.222 27.755 1.00 4.12 C ATOM 699 CD2 PHE A 53 -0.913 1.611 29.966 1.00 50.20 C ATOM 700 CE1 PHE A 53 -0.045 3.521 28.175 1.00 33.14 C ATOM 701 CE2 PHE A 53 -0.698 2.908 30.391 1.00 3.33 C ATOM 702 CZ PHE A 53 -0.263 3.864 29.494 1.00 10.02 C ATOM 0 H PHE A 53 -1.425 -0.691 25.753 1.00 43.13 H new ATOM 0 HA PHE A 53 0.995 -0.021 27.242 1.00 30.33 H new ATOM 0 HB2 PHE A 53 -1.923 -0.223 27.732 1.00 12.22 H new ATOM 0 HB3 PHE A 53 -0.936 -0.817 29.052 1.00 12.22 H new ATOM 0 HD1 PHE A 53 -0.092 1.959 26.721 1.00 4.12 H new ATOM 0 HD2 PHE A 53 -1.252 0.867 30.672 1.00 50.20 H new ATOM 0 HE1 PHE A 53 0.296 4.267 27.472 1.00 33.14 H new ATOM 0 HE2 PHE A 53 -0.870 3.174 31.424 1.00 3.33 H new ATOM 0 HZ PHE A 53 -0.094 4.878 29.824 1.00 10.02 H new ATOM 711 N GLN A 54 0.273 -2.999 26.585 1.00 71.33 N ATOM 712 CA GLN A 54 0.612 -4.403 26.784 1.00 42.24 C ATOM 713 C GLN A 54 2.091 -4.564 27.120 1.00 13.22 C ATOM 714 O GLN A 54 2.492 -5.541 27.751 1.00 3.14 O ATOM 715 CB GLN A 54 0.269 -5.215 25.535 1.00 12.12 C ATOM 716 CG GLN A 54 -0.176 -6.637 25.836 1.00 71.23 C ATOM 717 CD GLN A 54 0.984 -7.553 26.171 1.00 44.24 C ATOM 718 OE1 GLN A 54 1.004 -8.187 27.226 1.00 40.45 O ATOM 719 NE2 GLN A 54 1.959 -7.628 25.272 1.00 22.22 N ATOM 0 H GLN A 54 -0.156 -2.792 25.683 1.00 71.33 H new ATOM 0 HA GLN A 54 0.025 -4.776 27.623 1.00 42.24 H new ATOM 0 HB2 GLN A 54 -0.522 -4.704 24.986 1.00 12.12 H new ATOM 0 HB3 GLN A 54 1.141 -5.247 24.882 1.00 12.12 H new ATOM 0 HG2 GLN A 54 -0.877 -6.625 26.670 1.00 71.23 H new ATOM 0 HG3 GLN A 54 -0.712 -7.036 24.975 1.00 71.23 H new ATOM 0 HE21 GLN A 54 1.901 -7.085 24.411 1.00 22.22 H new ATOM 0 HE22 GLN A 54 2.765 -8.229 25.443 1.00 22.22 H new ATOM 726 N GLY A 55 2.899 -3.598 26.691 1.00 34.53 N ATOM 727 CA GLY A 55 4.325 -3.652 26.954 1.00 64.40 C ATOM 728 C GLY A 55 4.704 -2.941 28.238 1.00 71.33 C ATOM 729 O GLY A 55 5.411 -3.498 29.079 1.00 11.42 O ATOM 0 H GLY A 55 2.591 -2.779 26.166 1.00 34.53 H new ATOM 0 HA2 GLY A 55 4.642 -4.693 27.012 1.00 64.40 H new ATOM 0 HA3 GLY A 55 4.863 -3.201 26.120 1.00 64.40 H new ATOM 732 N VAL A 56 4.236 -1.708 28.391 1.00 32.25 N ATOM 733 CA VAL A 56 4.530 -0.919 29.581 1.00 61.14 C ATOM 734 C VAL A 56 3.955 -1.576 30.831 1.00 44.21 C ATOM 735 O VAL A 56 4.552 -1.519 31.906 1.00 41.41 O ATOM 736 CB VAL A 56 3.970 0.510 29.461 1.00 32.25 C ATOM 737 CG1 VAL A 56 4.612 1.239 28.290 1.00 22.13 C ATOM 738 CG2 VAL A 56 2.456 0.478 29.314 1.00 22.34 C ATOM 0 H VAL A 56 3.650 -1.232 27.705 1.00 32.25 H new ATOM 0 HA VAL A 56 5.615 -0.868 29.667 1.00 61.14 H new ATOM 0 HB VAL A 56 4.212 1.054 30.374 1.00 32.25 H new ATOM 0 HG11 VAL A 56 4.204 2.247 28.221 1.00 22.13 H new ATOM 0 HG12 VAL A 56 5.690 1.294 28.442 1.00 22.13 H new ATOM 0 HG13 VAL A 56 4.403 0.699 27.367 1.00 22.13 H new ATOM 0 HG21 VAL A 56 2.077 1.497 29.230 1.00 22.34 H new ATOM 0 HG22 VAL A 56 2.189 -0.083 28.418 1.00 22.34 H new ATOM 0 HG23 VAL A 56 2.016 -0.002 30.188 1.00 22.34 H new ATOM 748 N HIS A 57 2.790 -2.199 30.683 1.00 52.34 N ATOM 749 CA HIS A 57 2.134 -2.868 31.800 1.00 22.42 C ATOM 750 C HIS A 57 3.106 -3.789 32.530 1.00 53.41 C ATOM 751 O HIS A 57 3.299 -3.672 33.740 1.00 52.13 O ATOM 752 CB HIS A 57 0.929 -3.668 31.305 1.00 62.54 C ATOM 753 CG HIS A 57 -0.368 -2.925 31.408 1.00 44.11 C ATOM 754 ND1 HIS A 57 -0.698 -2.134 32.489 1.00 0.03 N ATOM 755 CD2 HIS A 57 -1.417 -2.854 30.557 1.00 3.04 C ATOM 756 CE1 HIS A 57 -1.896 -1.610 32.298 1.00 4.35 C ATOM 757 NE2 HIS A 57 -2.354 -2.030 31.133 1.00 61.12 N ATOM 0 H HIS A 57 2.281 -2.254 29.801 1.00 52.34 H new ATOM 0 HA HIS A 57 1.792 -2.104 32.499 1.00 22.42 H new ATOM 0 HB2 HIS A 57 1.094 -3.952 30.266 1.00 62.54 H new ATOM 0 HB3 HIS A 57 0.856 -4.591 31.880 1.00 62.54 H new ATOM 0 HD2 HIS A 57 -1.502 -3.352 29.603 1.00 3.04 H new ATOM 0 HE1 HIS A 57 -2.413 -0.950 32.979 1.00 4.35 H new ATOM 0 HE2 HIS A 57 -3.256 -1.783 30.727 1.00 61.12 H new ATOM 764 N ASP A 58 3.717 -4.706 31.786 1.00 24.42 N ATOM 765 CA ASP A 58 4.670 -5.647 32.362 1.00 32.21 C ATOM 766 C ASP A 58 5.932 -4.927 32.826 1.00 1.24 C ATOM 767 O ASP A 58 6.700 -5.454 33.631 1.00 35.21 O ATOM 768 CB ASP A 58 5.030 -6.728 31.341 1.00 44.22 C ATOM 769 CG ASP A 58 5.399 -8.044 31.999 1.00 11.13 C ATOM 770 OD1 ASP A 58 6.253 -8.034 32.910 1.00 32.04 O ATOM 771 OD2 ASP A 58 4.833 -9.085 31.601 1.00 43.22 O ATOM 0 H ASP A 58 3.569 -4.817 30.783 1.00 24.42 H new ATOM 0 HA ASP A 58 4.203 -6.116 33.228 1.00 32.21 H new ATOM 0 HB2 ASP A 58 4.186 -6.885 30.669 1.00 44.22 H new ATOM 0 HB3 ASP A 58 5.864 -6.384 30.730 1.00 44.22 H new ATOM 775 N SER A 59 6.141 -3.719 32.312 1.00 11.14 N ATOM 776 CA SER A 59 7.313 -2.928 32.670 1.00 13.25 C ATOM 777 C SER A 59 7.107 -2.226 34.008 1.00 61.33 C ATOM 778 O SER A 59 8.055 -2.016 34.763 1.00 3.54 O ATOM 779 CB SER A 59 7.610 -1.896 31.580 1.00 24.51 C ATOM 780 OG SER A 59 8.807 -1.191 31.858 1.00 62.30 O ATOM 0 H SER A 59 5.514 -3.267 31.646 1.00 11.14 H new ATOM 0 HA SER A 59 8.163 -3.604 32.762 1.00 13.25 H new ATOM 0 HB2 SER A 59 7.694 -2.396 30.615 1.00 24.51 H new ATOM 0 HB3 SER A 59 6.780 -1.194 31.504 1.00 24.51 H new ATOM 0 HG SER A 59 8.975 -0.539 31.146 1.00 62.30 H new ATOM 785 N ALA A 60 5.859 -1.868 34.295 1.00 51.14 N ATOM 786 CA ALA A 60 5.527 -1.193 35.543 1.00 20.12 C ATOM 787 C ALA A 60 5.196 -2.199 36.641 1.00 0.54 C ATOM 788 O ALA A 60 4.711 -1.827 37.709 1.00 70.02 O ATOM 789 CB ALA A 60 4.362 -0.237 35.332 1.00 35.14 C ATOM 0 H ALA A 60 5.062 -2.034 33.680 1.00 51.14 H new ATOM 0 HA ALA A 60 6.399 -0.622 35.861 1.00 20.12 H new ATOM 0 HB1 ALA A 60 4.125 0.260 36.272 1.00 35.14 H new ATOM 0 HB2 ALA A 60 4.634 0.509 34.585 1.00 35.14 H new ATOM 0 HB3 ALA A 60 3.492 -0.795 34.987 1.00 35.14 H new ATOM 795 N GLU A 61 5.461 -3.472 36.370 1.00 53.30 N ATOM 796 CA GLU A 61 5.189 -4.531 37.335 1.00 54.12 C ATOM 797 C GLU A 61 5.807 -4.202 38.692 1.00 35.54 C ATOM 798 O GLU A 61 5.289 -4.599 39.735 1.00 72.44 O ATOM 799 CB GLU A 61 5.733 -5.868 36.826 1.00 4.25 C ATOM 800 CG GLU A 61 5.058 -7.077 37.451 1.00 3.32 C ATOM 801 CD GLU A 61 3.720 -7.393 36.812 1.00 70.32 C ATOM 802 OE1 GLU A 61 3.539 -7.064 35.621 1.00 50.40 O ATOM 803 OE2 GLU A 61 2.854 -7.971 37.501 1.00 63.43 O ATOM 0 H GLU A 61 5.864 -3.796 35.491 1.00 53.30 H new ATOM 0 HA GLU A 61 4.108 -4.609 37.456 1.00 54.12 H new ATOM 0 HB2 GLU A 61 5.610 -5.913 35.744 1.00 4.25 H new ATOM 0 HB3 GLU A 61 6.803 -5.915 37.027 1.00 4.25 H new ATOM 0 HG2 GLU A 61 5.714 -7.943 37.359 1.00 3.32 H new ATOM 0 HG3 GLU A 61 4.914 -6.898 38.517 1.00 3.32 H new ATOM 808 N LYS A 62 6.917 -3.473 38.668 1.00 50.23 N ATOM 809 CA LYS A 62 7.607 -3.089 39.894 1.00 73.42 C ATOM 810 C LYS A 62 6.824 -2.017 40.645 1.00 20.30 C ATOM 811 O LYS A 62 6.616 -2.118 41.853 1.00 41.43 O ATOM 812 CB LYS A 62 9.013 -2.578 39.574 1.00 72.31 C ATOM 813 CG LYS A 62 10.080 -3.657 39.632 1.00 74.12 C ATOM 814 CD LYS A 62 11.418 -3.094 40.081 1.00 64.14 C ATOM 815 CE LYS A 62 11.488 -2.965 41.595 1.00 4.42 C ATOM 816 NZ LYS A 62 12.506 -1.964 42.020 1.00 2.55 N ATOM 0 H LYS A 62 7.359 -3.136 37.813 1.00 50.23 H new ATOM 0 HA LYS A 62 7.684 -3.971 40.530 1.00 73.42 H new ATOM 0 HB2 LYS A 62 9.011 -2.134 38.579 1.00 72.31 H new ATOM 0 HB3 LYS A 62 9.271 -1.785 40.276 1.00 72.31 H new ATOM 0 HG2 LYS A 62 9.766 -4.444 40.318 1.00 74.12 H new ATOM 0 HG3 LYS A 62 10.189 -4.116 38.649 1.00 74.12 H new ATOM 0 HD2 LYS A 62 12.222 -3.742 39.732 1.00 64.14 H new ATOM 0 HD3 LYS A 62 11.575 -2.117 39.624 1.00 64.14 H new ATOM 0 HE2 LYS A 62 10.511 -2.675 41.980 1.00 4.42 H new ATOM 0 HE3 LYS A 62 11.728 -3.935 42.031 1.00 4.42 H new ATOM 0 HZ1 LYS A 62 12.523 -1.905 43.058 1.00 2.55 H new ATOM 0 HZ2 LYS A 62 13.443 -2.254 41.674 1.00 2.55 H new ATOM 0 HZ3 LYS A 62 12.264 -1.033 41.625 1.00 2.55 H new ATOM 826 N GLY A 63 6.389 -0.990 39.921 1.00 14.03 N ATOM 827 CA GLY A 63 5.632 0.085 40.536 1.00 51.33 C ATOM 828 C GLY A 63 4.143 -0.198 40.565 1.00 54.10 C ATOM 829 O GLY A 63 3.341 0.689 40.857 1.00 55.01 O ATOM 0 H GLY A 63 6.547 -0.883 38.919 1.00 14.03 H new ATOM 0 HA2 GLY A 63 5.989 0.241 41.554 1.00 51.33 H new ATOM 0 HA3 GLY A 63 5.812 1.011 39.990 1.00 51.33 H new ATOM 832 N LYS A 64 3.771 -1.437 40.260 1.00 2.03 N ATOM 833 CA LYS A 64 2.369 -1.834 40.252 1.00 74.22 C ATOM 834 C LYS A 64 2.113 -2.948 41.262 1.00 45.42 C ATOM 835 O LYS A 64 1.223 -3.778 41.075 1.00 11.34 O ATOM 836 CB LYS A 64 1.956 -2.297 38.852 1.00 45.32 C ATOM 837 CG LYS A 64 0.456 -2.269 38.620 1.00 55.24 C ATOM 838 CD LYS A 64 0.104 -2.693 37.203 1.00 61.41 C ATOM 839 CE LYS A 64 -0.263 -4.168 37.138 1.00 65.33 C ATOM 840 NZ LYS A 64 0.917 -5.019 36.820 1.00 73.42 N ATOM 0 H LYS A 64 4.422 -2.183 40.015 1.00 2.03 H new ATOM 0 HA LYS A 64 1.771 -0.967 40.533 1.00 74.22 H new ATOM 0 HB2 LYS A 64 2.442 -1.662 38.111 1.00 45.32 H new ATOM 0 HB3 LYS A 64 2.321 -3.311 38.692 1.00 45.32 H new ATOM 0 HG2 LYS A 64 -0.036 -2.932 39.332 1.00 55.24 H new ATOM 0 HG3 LYS A 64 0.077 -1.264 38.805 1.00 55.24 H new ATOM 0 HD2 LYS A 64 -0.730 -2.093 36.839 1.00 61.41 H new ATOM 0 HD3 LYS A 64 0.949 -2.498 36.543 1.00 61.41 H new ATOM 0 HE2 LYS A 64 -0.689 -4.479 38.092 1.00 65.33 H new ATOM 0 HE3 LYS A 64 -1.033 -4.318 36.382 1.00 65.33 H new ATOM 0 HZ1 LYS A 64 0.598 -5.981 36.585 1.00 73.42 H new ATOM 0 HZ2 LYS A 64 1.428 -4.615 36.009 1.00 73.42 H new ATOM 0 HZ3 LYS A 64 1.550 -5.056 37.644 1.00 73.42 H new ATOM 850 N ASP A 65 2.898 -2.960 42.334 1.00 14.11 N ATOM 851 CA ASP A 65 2.756 -3.970 43.376 1.00 34.42 C ATOM 852 C ASP A 65 2.138 -3.369 44.635 1.00 34.12 C ATOM 853 O ASP A 65 2.161 -3.981 45.702 1.00 35.14 O ATOM 854 CB ASP A 65 4.114 -4.590 43.704 1.00 42.43 C ATOM 855 CG ASP A 65 4.606 -5.520 42.613 1.00 73.14 C ATOM 856 OD1 ASP A 65 3.815 -6.377 42.164 1.00 14.14 O ATOM 857 OD2 ASP A 65 5.780 -5.394 42.209 1.00 2.32 O ATOM 0 H ASP A 65 3.640 -2.281 42.504 1.00 14.11 H new ATOM 0 HA ASP A 65 2.091 -4.749 43.004 1.00 34.42 H new ATOM 0 HB2 ASP A 65 4.845 -3.796 43.857 1.00 42.43 H new ATOM 0 HB3 ASP A 65 4.041 -5.141 44.641 1.00 42.43 H new ATOM 861 N ASN A 66 1.589 -2.166 44.501 1.00 72.35 N ATOM 862 CA ASN A 66 0.967 -1.481 45.628 1.00 64.23 C ATOM 863 C ASN A 66 0.010 -2.411 46.370 1.00 11.54 C ATOM 864 O ASN A 66 -0.257 -2.225 47.556 1.00 54.12 O ATOM 865 CB ASN A 66 0.217 -0.238 45.147 1.00 10.13 C ATOM 866 CG ASN A 66 -0.187 -0.336 43.688 1.00 21.30 C ATOM 867 OD1 ASN A 66 -0.886 -1.410 43.339 1.00 32.31 O flip ATOM 868 ND2 ASN A 66 0.125 0.544 42.885 1.00 54.30 N flip ATOM 0 H ASN A 66 1.562 -1.646 43.624 1.00 72.35 H new ATOM 0 HA ASN A 66 1.756 -1.177 46.315 1.00 64.23 H new ATOM 0 HB2 ASN A 66 -0.673 -0.095 45.759 1.00 10.13 H new ATOM 0 HB3 ASN A 66 0.846 0.641 45.289 1.00 10.13 H new ATOM 0 HD21 ASN A 66 0.663 1.352 43.198 1.00 54.30 H new ATOM 0 HD22 ASN A 66 -0.155 0.465 41.907 1.00 54.30 H new ATOM 874 N ALA A 67 -0.502 -3.411 45.660 1.00 53.14 N ATOM 875 CA ALA A 67 -1.427 -4.371 46.250 1.00 54.12 C ATOM 876 C ALA A 67 -0.855 -4.969 47.531 1.00 3.51 C ATOM 877 O ALA A 67 -1.597 -5.363 48.428 1.00 71.44 O ATOM 878 CB ALA A 67 -1.753 -5.472 45.252 1.00 30.23 C ATOM 0 H ALA A 67 -0.292 -3.577 44.676 1.00 53.14 H new ATOM 0 HA ALA A 67 -2.346 -3.843 46.505 1.00 54.12 H new ATOM 0 HB1 ALA A 67 -2.445 -6.182 45.706 1.00 30.23 H new ATOM 0 HB2 ALA A 67 -2.212 -5.035 44.365 1.00 30.23 H new ATOM 0 HB3 ALA A 67 -0.836 -5.989 44.969 1.00 30.23 H new ATOM 884 N GLU A 68 0.472 -5.033 47.607 1.00 62.33 N ATOM 885 CA GLU A 68 1.143 -5.585 48.779 1.00 71.40 C ATOM 886 C GLU A 68 0.649 -4.911 50.056 1.00 31.31 C ATOM 887 O GLU A 68 0.129 -3.797 50.023 1.00 33.14 O ATOM 888 CB GLU A 68 2.657 -5.415 48.653 1.00 43.54 C ATOM 889 CG GLU A 68 3.135 -3.996 48.913 1.00 15.30 C ATOM 890 CD GLU A 68 4.639 -3.853 48.778 1.00 15.50 C ATOM 891 OE1 GLU A 68 5.190 -4.316 47.756 1.00 61.44 O ATOM 892 OE2 GLU A 68 5.265 -3.278 49.692 1.00 2.44 O ATOM 0 H GLU A 68 1.102 -4.710 46.873 1.00 62.33 H new ATOM 0 HA GLU A 68 0.907 -6.648 48.835 1.00 71.40 H new ATOM 0 HB2 GLU A 68 3.149 -6.089 49.354 1.00 43.54 H new ATOM 0 HB3 GLU A 68 2.966 -5.715 47.652 1.00 43.54 H new ATOM 0 HG2 GLU A 68 2.645 -3.318 48.214 1.00 15.30 H new ATOM 0 HG3 GLU A 68 2.834 -3.693 49.916 1.00 15.30 H new ATOM 897 N GLY A 69 0.816 -5.598 51.182 1.00 65.14 N ATOM 898 CA GLY A 69 0.381 -5.052 52.455 1.00 43.42 C ATOM 899 C GLY A 69 -1.070 -4.620 52.436 1.00 33.42 C ATOM 900 O GLY A 69 -1.912 -5.279 51.826 1.00 63.04 O ATOM 0 H GLY A 69 1.244 -6.522 51.236 1.00 65.14 H new ATOM 0 HA2 GLY A 69 0.524 -5.800 53.235 1.00 43.42 H new ATOM 0 HA3 GLY A 69 1.007 -4.198 52.713 1.00 43.42 H new ATOM 903 N GLN A 70 -1.365 -3.510 53.105 1.00 72.44 N ATOM 904 CA GLN A 70 -2.728 -2.993 53.163 1.00 52.43 C ATOM 905 C GLN A 70 -3.255 -2.688 51.765 1.00 10.44 C ATOM 906 O GLN A 70 -2.543 -2.847 50.774 1.00 64.43 O ATOM 907 CB GLN A 70 -2.780 -1.732 54.027 1.00 65.51 C ATOM 908 CG GLN A 70 -2.208 -0.501 53.344 1.00 33.12 C ATOM 909 CD GLN A 70 -0.729 -0.639 53.036 1.00 35.33 C ATOM 910 OE1 GLN A 70 -0.310 -0.513 51.885 1.00 43.43 O ATOM 911 NE2 GLN A 70 0.068 -0.899 54.065 1.00 32.24 N ATOM 0 H GLN A 70 -0.680 -2.952 53.614 1.00 72.44 H new ATOM 0 HA GLN A 70 -3.362 -3.759 53.611 1.00 52.43 H new ATOM 0 HB2 GLN A 70 -3.815 -1.535 54.305 1.00 65.51 H new ATOM 0 HB3 GLN A 70 -2.231 -1.912 54.951 1.00 65.51 H new ATOM 0 HG2 GLN A 70 -2.753 -0.318 52.418 1.00 33.12 H new ATOM 0 HG3 GLN A 70 -2.363 0.369 53.982 1.00 33.12 H new ATOM 0 HE21 GLN A 70 -0.324 -0.995 55.002 1.00 32.24 H new ATOM 0 HE22 GLN A 70 1.072 -1.003 53.919 1.00 32.24 H new ATOM 918 N GLY A 71 -4.508 -2.247 51.693 1.00 52.44 N ATOM 919 CA GLY A 71 -5.109 -1.927 50.411 1.00 53.44 C ATOM 920 C GLY A 71 -6.543 -1.457 50.546 1.00 13.25 C ATOM 921 O GLY A 71 -6.858 -0.310 50.230 1.00 11.34 O ATOM 0 H GLY A 71 -5.117 -2.106 52.499 1.00 52.44 H new ATOM 0 HA2 GLY A 71 -4.520 -1.152 49.920 1.00 53.44 H new ATOM 0 HA3 GLY A 71 -5.077 -2.807 49.768 1.00 53.44 H new ATOM 924 N GLU A 72 -7.414 -2.344 51.012 1.00 64.35 N ATOM 925 CA GLU A 72 -8.824 -2.013 51.184 1.00 24.32 C ATOM 926 C GLU A 72 -9.135 -1.699 52.645 1.00 2.03 C ATOM 927 O GLU A 72 -9.987 -0.862 52.943 1.00 4.32 O ATOM 928 CB GLU A 72 -9.704 -3.167 50.701 1.00 21.55 C ATOM 929 CG GLU A 72 -9.884 -3.205 49.193 1.00 14.01 C ATOM 930 CD GLU A 72 -10.689 -4.404 48.731 1.00 52.53 C ATOM 931 OE1 GLU A 72 -11.930 -4.291 48.656 1.00 54.51 O ATOM 932 OE2 GLU A 72 -10.078 -5.455 48.444 1.00 40.30 O ATOM 0 H GLU A 72 -7.169 -3.298 51.278 1.00 64.35 H new ATOM 0 HA GLU A 72 -9.038 -1.127 50.586 1.00 24.32 H new ATOM 0 HB2 GLU A 72 -9.266 -4.109 51.030 1.00 21.55 H new ATOM 0 HB3 GLU A 72 -10.683 -3.089 51.173 1.00 21.55 H new ATOM 0 HG2 GLU A 72 -10.381 -2.291 48.867 1.00 14.01 H new ATOM 0 HG3 GLU A 72 -8.905 -3.223 48.714 1.00 14.01 H new ATOM 937 N SER A 73 -8.438 -2.377 53.551 1.00 72.13 N ATOM 938 CA SER A 73 -8.642 -2.174 54.981 1.00 51.44 C ATOM 939 C SER A 73 -8.061 -3.336 55.782 1.00 21.55 C ATOM 940 O SER A 73 -8.176 -4.497 55.388 1.00 20.12 O ATOM 941 CB SER A 73 -10.133 -2.023 55.288 1.00 41.22 C ATOM 942 OG SER A 73 -10.433 -2.478 56.596 1.00 23.21 O ATOM 0 H SER A 73 -7.727 -3.071 53.321 1.00 72.13 H new ATOM 0 HA SER A 73 -8.124 -1.260 55.272 1.00 51.44 H new ATOM 0 HB2 SER A 73 -10.424 -0.977 55.188 1.00 41.22 H new ATOM 0 HB3 SER A 73 -10.716 -2.587 54.561 1.00 41.22 H new ATOM 0 HG SER A 73 -11.351 -2.225 56.828 1.00 23.21 H new ATOM 947 N LEU A 74 -7.437 -3.014 56.910 1.00 1.24 N ATOM 948 CA LEU A 74 -6.837 -4.029 57.769 1.00 22.43 C ATOM 949 C LEU A 74 -7.912 -4.831 58.496 1.00 71.44 C ATOM 950 O LEU A 74 -7.622 -5.849 59.124 1.00 61.11 O ATOM 951 CB LEU A 74 -5.898 -3.376 58.784 1.00 21.11 C ATOM 952 CG LEU A 74 -4.626 -2.749 58.215 1.00 41.51 C ATOM 953 CD1 LEU A 74 -3.907 -3.732 57.304 1.00 21.31 C ATOM 954 CD2 LEU A 74 -4.952 -1.466 57.465 1.00 24.10 C ATOM 0 H LEU A 74 -7.333 -2.058 57.251 1.00 1.24 H new ATOM 0 HA LEU A 74 -6.264 -4.710 57.140 1.00 22.43 H new ATOM 0 HB2 LEU A 74 -6.452 -2.604 59.317 1.00 21.11 H new ATOM 0 HB3 LEU A 74 -5.611 -4.128 59.519 1.00 21.11 H new ATOM 0 HG LEU A 74 -3.964 -2.503 59.045 1.00 41.51 H new ATOM 0 HD11 LEU A 74 -3.004 -3.268 56.908 1.00 21.31 H new ATOM 0 HD12 LEU A 74 -3.638 -4.624 57.871 1.00 21.31 H new ATOM 0 HD13 LEU A 74 -4.563 -4.010 56.479 1.00 21.31 H new ATOM 0 HD21 LEU A 74 -4.034 -1.034 57.067 1.00 24.10 H new ATOM 0 HD22 LEU A 74 -5.634 -1.688 56.644 1.00 24.10 H new ATOM 0 HD23 LEU A 74 -5.422 -0.756 58.146 1.00 24.10 H new ATOM 965 N ALA A 75 -9.154 -4.366 58.404 1.00 54.42 N ATOM 966 CA ALA A 75 -10.272 -5.043 59.049 1.00 21.31 C ATOM 967 C ALA A 75 -10.827 -6.154 58.163 1.00 23.31 C ATOM 968 O ALA A 75 -11.297 -7.178 58.658 1.00 32.42 O ATOM 969 CB ALA A 75 -11.366 -4.043 59.393 1.00 24.12 C ATOM 0 H ALA A 75 -9.411 -3.524 57.889 1.00 54.42 H new ATOM 0 HA ALA A 75 -9.907 -5.498 59.970 1.00 21.31 H new ATOM 0 HB1 ALA A 75 -12.195 -4.562 59.874 1.00 24.12 H new ATOM 0 HB2 ALA A 75 -10.968 -3.288 60.071 1.00 24.12 H new ATOM 0 HB3 ALA A 75 -11.719 -3.562 58.481 1.00 24.12 H new ATOM 975 N ASP A 76 -10.769 -5.943 56.853 1.00 23.22 N ATOM 976 CA ASP A 76 -11.266 -6.926 55.897 1.00 42.25 C ATOM 977 C ASP A 76 -10.597 -8.280 56.115 1.00 12.51 C ATOM 978 O ASP A 76 -11.252 -9.320 56.076 1.00 62.51 O ATOM 979 CB ASP A 76 -11.023 -6.447 54.466 1.00 51.11 C ATOM 980 CG ASP A 76 -11.917 -7.145 53.462 1.00 33.35 C ATOM 981 OD1 ASP A 76 -13.105 -6.771 53.363 1.00 23.14 O ATOM 982 OD2 ASP A 76 -11.431 -8.066 52.773 1.00 40.21 O ATOM 0 H ASP A 76 -10.383 -5.100 56.428 1.00 23.22 H new ATOM 0 HA ASP A 76 -12.338 -7.040 56.055 1.00 42.25 H new ATOM 0 HB2 ASP A 76 -11.192 -5.372 54.412 1.00 51.11 H new ATOM 0 HB3 ASP A 76 -9.980 -6.619 54.201 1.00 51.11 H new ATOM 986 N GLN A 77 -9.287 -8.257 56.340 1.00 51.13 N ATOM 987 CA GLN A 77 -8.529 -9.483 56.561 1.00 33.01 C ATOM 988 C GLN A 77 -8.676 -9.963 58.001 1.00 22.23 C ATOM 989 O GLN A 77 -8.785 -11.161 58.258 1.00 52.15 O ATOM 990 CB GLN A 77 -7.051 -9.261 56.234 1.00 32.54 C ATOM 991 CG GLN A 77 -6.230 -8.789 57.423 1.00 2.24 C ATOM 992 CD GLN A 77 -4.811 -8.414 57.040 1.00 32.40 C ATOM 993 OE1 GLN A 77 -4.356 -8.706 55.934 1.00 75.35 O ATOM 994 NE2 GLN A 77 -4.104 -7.762 57.955 1.00 1.02 N ATOM 0 H GLN A 77 -8.729 -7.404 56.374 1.00 51.13 H new ATOM 0 HA GLN A 77 -8.929 -10.251 55.899 1.00 33.01 H new ATOM 0 HB2 GLN A 77 -6.627 -10.192 55.857 1.00 32.54 H new ATOM 0 HB3 GLN A 77 -6.971 -8.526 55.433 1.00 32.54 H new ATOM 0 HG2 GLN A 77 -6.719 -7.928 57.879 1.00 2.24 H new ATOM 0 HG3 GLN A 77 -6.203 -9.576 58.177 1.00 2.24 H new ATOM 0 HE21 GLN A 77 -4.521 -7.540 58.859 1.00 1.02 H new ATOM 0 HE22 GLN A 77 -3.144 -7.483 57.754 1.00 1.02 H new ATOM 1001 N ALA A 78 -8.680 -9.019 58.937 1.00 53.41 N ATOM 1002 CA ALA A 78 -8.815 -9.345 60.351 1.00 32.30 C ATOM 1003 C ALA A 78 -9.878 -10.417 60.567 1.00 62.11 C ATOM 1004 O ALA A 78 -9.757 -11.253 61.463 1.00 12.23 O ATOM 1005 CB ALA A 78 -9.153 -8.096 61.150 1.00 60.32 C ATOM 0 H ALA A 78 -8.591 -8.022 58.741 1.00 53.41 H new ATOM 0 HA ALA A 78 -7.861 -9.740 60.701 1.00 32.30 H new ATOM 0 HB1 ALA A 78 -9.251 -8.354 62.204 1.00 60.32 H new ATOM 0 HB2 ALA A 78 -8.358 -7.360 61.029 1.00 60.32 H new ATOM 0 HB3 ALA A 78 -10.093 -7.677 60.790 1.00 60.32 H new ATOM 1011 N ARG A 79 -10.919 -10.387 59.742 1.00 33.23 N ATOM 1012 CA ARG A 79 -12.005 -11.355 59.844 1.00 42.24 C ATOM 1013 C ARG A 79 -11.582 -12.708 59.278 1.00 5.03 C ATOM 1014 O ARG A 79 -11.630 -13.725 59.971 1.00 12.42 O ATOM 1015 CB ARG A 79 -13.243 -10.846 59.105 1.00 63.33 C ATOM 1016 CG ARG A 79 -13.742 -9.501 59.608 1.00 32.13 C ATOM 1017 CD ARG A 79 -14.963 -9.034 58.832 1.00 32.42 C ATOM 1018 NE ARG A 79 -14.604 -8.482 57.528 1.00 20.45 N ATOM 1019 CZ ARG A 79 -15.479 -7.913 56.706 1.00 30.43 C ATOM 1020 NH1 ARG A 79 -16.756 -7.822 57.050 1.00 15.21 N ATOM 1021 NH2 ARG A 79 -15.076 -7.434 55.536 1.00 23.03 N ATOM 0 H ARG A 79 -11.034 -9.702 58.995 1.00 33.23 H new ATOM 0 HA ARG A 79 -12.247 -11.481 60.899 1.00 42.24 H new ATOM 0 HB2 ARG A 79 -13.014 -10.765 58.042 1.00 63.33 H new ATOM 0 HB3 ARG A 79 -14.042 -11.581 59.203 1.00 63.33 H new ATOM 0 HG2 ARG A 79 -13.990 -9.576 60.667 1.00 32.13 H new ATOM 0 HG3 ARG A 79 -12.947 -8.760 59.518 1.00 32.13 H new ATOM 0 HD2 ARG A 79 -15.648 -9.871 58.695 1.00 32.42 H new ATOM 0 HD3 ARG A 79 -15.494 -8.279 59.412 1.00 32.42 H new ATOM 0 HE ARG A 79 -13.629 -8.536 57.233 1.00 20.45 H new ATOM 0 HH11 ARG A 79 -17.070 -8.189 57.948 1.00 15.21 H new ATOM 0 HH12 ARG A 79 -17.425 -7.384 56.416 1.00 15.21 H new ATOM 0 HH21 ARG A 79 -14.094 -7.503 55.268 1.00 23.03 H new ATOM 0 HH22 ARG A 79 -15.748 -6.997 54.905 1.00 23.03 H new ATOM 1032 N ASP A 80 -11.169 -12.712 58.016 1.00 20.03 N ATOM 1033 CA ASP A 80 -10.737 -13.939 57.356 1.00 31.24 C ATOM 1034 C ASP A 80 -9.313 -14.302 57.764 1.00 53.30 C ATOM 1035 O ASP A 80 -9.056 -15.408 58.239 1.00 13.42 O ATOM 1036 CB ASP A 80 -10.822 -13.783 55.837 1.00 21.43 C ATOM 1037 CG ASP A 80 -12.223 -14.021 55.308 1.00 1.21 C ATOM 1038 OD1 ASP A 80 -13.191 -13.683 56.022 1.00 55.33 O ATOM 1039 OD2 ASP A 80 -12.352 -14.544 54.182 1.00 33.20 O ATOM 0 H ASP A 80 -11.124 -11.879 57.429 1.00 20.03 H new ATOM 0 HA ASP A 80 -11.402 -14.744 57.668 1.00 31.24 H new ATOM 0 HB2 ASP A 80 -10.497 -12.780 55.559 1.00 21.43 H new ATOM 0 HB3 ASP A 80 -10.134 -14.484 55.364 1.00 21.43 H new ATOM 1043 N TYR A 81 -8.392 -13.365 57.572 1.00 44.52 N ATOM 1044 CA TYR A 81 -6.991 -13.588 57.917 1.00 30.23 C ATOM 1045 C TYR A 81 -6.870 -14.378 59.217 1.00 3.45 C ATOM 1046 O TYR A 81 -6.417 -15.522 59.220 1.00 64.11 O ATOM 1047 CB TYR A 81 -6.257 -12.252 58.048 1.00 21.42 C ATOM 1048 CG TYR A 81 -4.763 -12.361 57.852 1.00 51.21 C ATOM 1049 CD1 TYR A 81 -4.230 -13.130 56.825 1.00 75.23 C ATOM 1050 CD2 TYR A 81 -3.881 -11.694 58.694 1.00 31.21 C ATOM 1051 CE1 TYR A 81 -2.865 -13.233 56.643 1.00 70.35 C ATOM 1052 CE2 TYR A 81 -2.514 -11.790 58.519 1.00 72.23 C ATOM 1053 CZ TYR A 81 -2.011 -12.561 57.492 1.00 63.32 C ATOM 1054 OH TYR A 81 -0.650 -12.660 57.315 1.00 34.43 O ATOM 0 H TYR A 81 -8.589 -12.444 57.180 1.00 44.52 H new ATOM 0 HA TYR A 81 -6.533 -14.169 57.116 1.00 30.23 H new ATOM 0 HB2 TYR A 81 -6.661 -11.552 57.317 1.00 21.42 H new ATOM 0 HB3 TYR A 81 -6.456 -11.833 59.034 1.00 21.42 H new ATOM 0 HD1 TYR A 81 -4.895 -13.657 56.157 1.00 75.23 H new ATOM 0 HD2 TYR A 81 -4.271 -11.090 59.500 1.00 31.21 H new ATOM 0 HE1 TYR A 81 -2.468 -13.837 55.840 1.00 70.35 H new ATOM 0 HE2 TYR A 81 -1.843 -11.264 59.182 1.00 72.23 H new ATOM 0 HH TYR A 81 -0.192 -12.125 57.997 1.00 34.43 H new ATOM 1063 N MET A 82 -7.278 -13.757 60.319 1.00 44.41 N ATOM 1064 CA MET A 82 -7.217 -14.401 61.626 1.00 13.33 C ATOM 1065 C MET A 82 -7.742 -15.831 61.552 1.00 32.53 C ATOM 1066 O MET A 82 -7.017 -16.785 61.831 1.00 31.11 O ATOM 1067 CB MET A 82 -8.022 -13.601 62.651 1.00 71.33 C ATOM 1068 CG MET A 82 -7.548 -12.165 62.810 1.00 74.23 C ATOM 1069 SD MET A 82 -6.156 -12.016 63.946 1.00 62.31 S ATOM 1070 CE MET A 82 -6.821 -10.862 65.145 1.00 54.03 C ATOM 0 H MET A 82 -7.654 -12.809 60.333 1.00 44.41 H new ATOM 0 HA MET A 82 -6.174 -14.432 61.940 1.00 13.33 H new ATOM 0 HB2 MET A 82 -9.071 -13.598 62.355 1.00 71.33 H new ATOM 0 HB3 MET A 82 -7.965 -14.103 63.617 1.00 71.33 H new ATOM 0 HG2 MET A 82 -7.260 -11.771 61.835 1.00 74.23 H new ATOM 0 HG3 MET A 82 -8.374 -11.552 63.171 1.00 74.23 H new ATOM 0 HE1 MET A 82 -6.075 -10.668 65.916 1.00 54.03 H new ATOM 0 HE2 MET A 82 -7.079 -9.928 64.646 1.00 54.03 H new ATOM 0 HE3 MET A 82 -7.714 -11.287 65.603 1.00 54.03 H new ATOM 1078 N GLY A 83 -9.010 -15.972 61.174 1.00 13.21 N ATOM 1079 CA GLY A 83 -9.610 -17.289 61.071 1.00 10.01 C ATOM 1080 C GLY A 83 -8.756 -18.256 60.275 1.00 51.11 C ATOM 1081 O GLY A 83 -8.305 -19.274 60.800 1.00 23.45 O ATOM 0 H GLY A 83 -9.631 -15.198 60.938 1.00 13.21 H new ATOM 0 HA2 GLY A 83 -9.771 -17.690 62.071 1.00 10.01 H new ATOM 0 HA3 GLY A 83 -10.590 -17.203 60.601 1.00 10.01 H new ATOM 1084 N ALA A 84 -8.534 -17.938 59.004 1.00 34.04 N ATOM 1085 CA ALA A 84 -7.728 -18.786 58.134 1.00 11.21 C ATOM 1086 C ALA A 84 -6.388 -19.121 58.781 1.00 23.44 C ATOM 1087 O ALA A 84 -5.839 -20.201 58.571 1.00 15.04 O ATOM 1088 CB ALA A 84 -7.512 -18.108 56.789 1.00 20.11 C ATOM 0 H ALA A 84 -8.901 -17.099 58.554 1.00 34.04 H new ATOM 0 HA ALA A 84 -8.268 -19.719 57.976 1.00 11.21 H new ATOM 0 HB1 ALA A 84 -6.909 -18.752 56.149 1.00 20.11 H new ATOM 0 HB2 ALA A 84 -8.476 -17.926 56.314 1.00 20.11 H new ATOM 0 HB3 ALA A 84 -6.996 -17.159 56.938 1.00 20.11 H new ATOM 1094 N ALA A 85 -5.868 -18.185 59.570 1.00 55.10 N ATOM 1095 CA ALA A 85 -4.593 -18.383 60.249 1.00 4.32 C ATOM 1096 C ALA A 85 -4.700 -19.470 61.312 1.00 40.54 C ATOM 1097 O ALA A 85 -4.216 -20.587 61.122 1.00 24.21 O ATOM 1098 CB ALA A 85 -4.120 -17.077 60.873 1.00 13.32 C ATOM 0 H ALA A 85 -6.309 -17.284 59.754 1.00 55.10 H new ATOM 0 HA ALA A 85 -3.861 -18.706 59.509 1.00 4.32 H new ATOM 0 HB1 ALA A 85 -3.167 -17.239 61.377 1.00 13.32 H new ATOM 0 HB2 ALA A 85 -3.995 -16.325 60.093 1.00 13.32 H new ATOM 0 HB3 ALA A 85 -4.859 -16.731 61.596 1.00 13.32 H new ATOM 1104 N LYS A 86 -5.335 -19.138 62.431 1.00 13.31 N ATOM 1105 CA LYS A 86 -5.505 -20.087 63.525 1.00 34.02 C ATOM 1106 C LYS A 86 -6.178 -21.365 63.036 1.00 31.31 C ATOM 1107 O LYS A 86 -5.916 -22.452 63.550 1.00 52.23 O ATOM 1108 CB LYS A 86 -6.333 -19.458 64.647 1.00 60.32 C ATOM 1109 CG LYS A 86 -6.386 -20.302 65.910 1.00 34.22 C ATOM 1110 CD LYS A 86 -7.744 -20.962 66.082 1.00 74.22 C ATOM 1111 CE LYS A 86 -8.027 -21.282 67.542 1.00 13.20 C ATOM 1112 NZ LYS A 86 -9.305 -22.028 67.709 1.00 4.44 N ATOM 0 H LYS A 86 -5.741 -18.218 62.604 1.00 13.31 H new ATOM 0 HA LYS A 86 -4.518 -20.342 63.910 1.00 34.02 H new ATOM 0 HB2 LYS A 86 -5.917 -18.480 64.890 1.00 60.32 H new ATOM 0 HB3 LYS A 86 -7.349 -19.292 64.288 1.00 60.32 H new ATOM 0 HG2 LYS A 86 -5.611 -21.067 65.870 1.00 34.22 H new ATOM 0 HG3 LYS A 86 -6.172 -19.676 66.776 1.00 34.22 H new ATOM 0 HD2 LYS A 86 -8.522 -20.303 65.695 1.00 74.22 H new ATOM 0 HD3 LYS A 86 -7.781 -21.879 65.494 1.00 74.22 H new ATOM 0 HE2 LYS A 86 -7.206 -21.872 67.950 1.00 13.20 H new ATOM 0 HE3 LYS A 86 -8.070 -20.356 68.115 1.00 13.20 H new ATOM 0 HZ1 LYS A 86 -9.462 -22.227 68.718 1.00 4.44 H new ATOM 0 HZ2 LYS A 86 -10.092 -21.455 67.343 1.00 4.44 H new ATOM 0 HZ3 LYS A 86 -9.255 -22.924 67.183 1.00 4.44 H new ATOM 1122 N SER A 87 -7.048 -21.227 62.040 1.00 15.40 N ATOM 1123 CA SER A 87 -7.761 -22.372 61.484 1.00 13.34 C ATOM 1124 C SER A 87 -6.834 -23.222 60.621 1.00 43.43 C ATOM 1125 O SER A 87 -6.734 -24.436 60.805 1.00 60.43 O ATOM 1126 CB SER A 87 -8.956 -21.900 60.654 1.00 24.40 C ATOM 1127 OG SER A 87 -9.809 -22.984 60.327 1.00 24.23 O ATOM 0 H SER A 87 -7.276 -20.335 61.602 1.00 15.40 H new ATOM 0 HA SER A 87 -8.120 -22.983 62.312 1.00 13.34 H new ATOM 0 HB2 SER A 87 -9.515 -21.148 61.211 1.00 24.40 H new ATOM 0 HB3 SER A 87 -8.602 -21.423 59.740 1.00 24.40 H new ATOM 0 HG SER A 87 -10.566 -22.656 59.798 1.00 24.23 H new ATOM 1132 N LYS A 88 -6.156 -22.577 59.678 1.00 45.54 N ATOM 1133 CA LYS A 88 -5.234 -23.272 58.786 1.00 24.01 C ATOM 1134 C LYS A 88 -3.901 -23.538 59.480 1.00 34.21 C ATOM 1135 O LYS A 88 -3.106 -24.361 59.025 1.00 61.12 O ATOM 1136 CB LYS A 88 -5.004 -22.449 57.516 1.00 71.24 C ATOM 1137 CG LYS A 88 -4.536 -23.278 56.332 1.00 41.03 C ATOM 1138 CD LYS A 88 -3.763 -22.434 55.332 1.00 64.33 C ATOM 1139 CE LYS A 88 -4.685 -21.819 54.291 1.00 75.23 C ATOM 1140 NZ LYS A 88 -5.355 -20.590 54.799 1.00 13.33 N ATOM 0 H LYS A 88 -6.227 -21.573 59.511 1.00 45.54 H new ATOM 0 HA LYS A 88 -5.681 -24.229 58.517 1.00 24.01 H new ATOM 0 HB2 LYS A 88 -5.931 -21.941 57.250 1.00 71.24 H new ATOM 0 HB3 LYS A 88 -4.264 -21.676 57.723 1.00 71.24 H new ATOM 0 HG2 LYS A 88 -3.906 -24.094 56.685 1.00 41.03 H new ATOM 0 HG3 LYS A 88 -5.397 -23.730 55.840 1.00 41.03 H new ATOM 0 HD2 LYS A 88 -3.228 -21.643 55.858 1.00 64.33 H new ATOM 0 HD3 LYS A 88 -3.013 -23.051 54.836 1.00 64.33 H new ATOM 0 HE2 LYS A 88 -4.112 -21.576 53.396 1.00 75.23 H new ATOM 0 HE3 LYS A 88 -5.440 -22.549 53.998 1.00 75.23 H new ATOM 0 HZ1 LYS A 88 -5.678 -20.013 53.996 1.00 13.33 H new ATOM 0 HZ2 LYS A 88 -6.172 -20.857 55.384 1.00 13.33 H new ATOM 0 HZ3 LYS A 88 -4.684 -20.040 55.372 1.00 13.33 H new ATOM 1150 N LEU A 89 -3.664 -22.838 60.584 1.00 31.20 N ATOM 1151 CA LEU A 89 -2.429 -23.000 61.342 1.00 30.21 C ATOM 1152 C LEU A 89 -2.619 -23.989 62.488 1.00 44.41 C ATOM 1153 O LEU A 89 -1.658 -24.591 62.967 1.00 23.51 O ATOM 1154 CB LEU A 89 -1.963 -21.651 61.890 1.00 42.40 C ATOM 1155 CG LEU A 89 -0.646 -21.660 62.668 1.00 32.50 C ATOM 1156 CD1 LEU A 89 0.377 -22.546 61.974 1.00 42.12 C ATOM 1157 CD2 LEU A 89 -0.110 -20.245 62.826 1.00 1.30 C ATOM 0 H LEU A 89 -4.311 -22.153 60.974 1.00 31.20 H new ATOM 0 HA LEU A 89 -1.668 -23.394 60.669 1.00 30.21 H new ATOM 0 HB2 LEU A 89 -1.864 -20.957 61.055 1.00 42.40 H new ATOM 0 HB3 LEU A 89 -2.743 -21.257 62.541 1.00 42.40 H new ATOM 0 HG LEU A 89 -0.835 -22.068 63.661 1.00 32.50 H new ATOM 0 HD11 LEU A 89 1.308 -22.540 62.541 1.00 42.12 H new ATOM 0 HD12 LEU A 89 -0.005 -23.565 61.914 1.00 42.12 H new ATOM 0 HD13 LEU A 89 0.563 -22.168 60.969 1.00 42.12 H new ATOM 0 HD21 LEU A 89 0.827 -20.271 63.382 1.00 1.30 H new ATOM 0 HD22 LEU A 89 0.064 -19.810 61.842 1.00 1.30 H new ATOM 0 HD23 LEU A 89 -0.836 -19.639 63.368 1.00 1.30 H new ATOM 1168 N ASN A 90 -3.865 -24.152 62.922 1.00 11.54 N ATOM 1169 CA ASN A 90 -4.181 -25.069 64.011 1.00 63.50 C ATOM 1170 C ASN A 90 -4.899 -26.309 63.487 1.00 41.42 C ATOM 1171 O ASN A 90 -4.782 -27.394 64.058 1.00 22.32 O ATOM 1172 CB ASN A 90 -5.049 -24.369 65.058 1.00 43.04 C ATOM 1173 CG ASN A 90 -4.939 -25.016 66.426 1.00 64.04 C ATOM 1174 OD1 ASN A 90 -3.891 -24.958 67.070 1.00 53.15 O ATOM 1175 ND2 ASN A 90 -6.023 -25.637 66.876 1.00 12.32 N ATOM 0 H ASN A 90 -4.672 -23.661 62.536 1.00 11.54 H new ATOM 0 HA ASN A 90 -3.245 -25.381 64.474 1.00 63.50 H new ATOM 0 HB2 ASN A 90 -4.754 -23.322 65.129 1.00 43.04 H new ATOM 0 HB3 ASN A 90 -6.089 -24.386 64.734 1.00 43.04 H new ATOM 0 HD21 ASN A 90 -6.009 -26.091 67.789 1.00 12.32 H new ATOM 0 HD22 ASN A 90 -6.870 -25.660 66.308 1.00 12.32 H new ATOM 1181 N ASP A 91 -5.639 -26.141 62.396 1.00 44.34 N ATOM 1182 CA ASP A 91 -6.373 -27.248 61.793 1.00 5.12 C ATOM 1183 C ASP A 91 -5.589 -27.852 60.634 1.00 14.43 C ATOM 1184 O ASP A 91 -5.831 -28.991 60.234 1.00 71.04 O ATOM 1185 CB ASP A 91 -7.742 -26.772 61.306 1.00 32.43 C ATOM 1186 CG ASP A 91 -8.801 -27.853 61.410 1.00 2.14 C ATOM 1187 OD1 ASP A 91 -8.770 -28.794 60.590 1.00 23.20 O ATOM 1188 OD2 ASP A 91 -9.661 -27.755 62.310 1.00 72.34 O ATOM 0 H ASP A 91 -5.746 -25.250 61.912 1.00 44.34 H new ATOM 0 HA ASP A 91 -6.513 -28.017 62.553 1.00 5.12 H new ATOM 0 HB2 ASP A 91 -8.052 -25.906 61.891 1.00 32.43 H new ATOM 0 HB3 ASP A 91 -7.662 -26.444 60.270 1.00 32.43 H new ATOM 1192 N ALA A 92 -4.649 -27.082 60.095 1.00 60.33 N ATOM 1193 CA ALA A 92 -3.829 -27.543 58.982 1.00 11.42 C ATOM 1194 C ALA A 92 -2.405 -27.845 59.437 1.00 70.13 C ATOM 1195 O ALA A 92 -1.666 -28.563 58.764 1.00 55.12 O ATOM 1196 CB ALA A 92 -3.819 -26.506 57.869 1.00 21.11 C ATOM 0 H ALA A 92 -4.437 -26.136 60.412 1.00 60.33 H new ATOM 0 HA ALA A 92 -4.265 -28.466 58.601 1.00 11.42 H new ATOM 0 HB1 ALA A 92 -3.203 -26.864 57.044 1.00 21.11 H new ATOM 0 HB2 ALA A 92 -4.837 -26.341 57.516 1.00 21.11 H new ATOM 0 HB3 ALA A 92 -3.410 -25.569 58.248 1.00 21.11 H new ATOM 1202 N VAL A 93 -2.025 -27.292 60.584 1.00 22.32 N ATOM 1203 CA VAL A 93 -0.689 -27.502 61.130 1.00 71.24 C ATOM 1204 C VAL A 93 -0.738 -28.380 62.375 1.00 43.31 C ATOM 1205 O VAL A 93 0.101 -29.262 62.557 1.00 43.03 O ATOM 1206 CB VAL A 93 -0.010 -26.166 61.483 1.00 70.33 C ATOM 1207 CG1 VAL A 93 0.522 -26.197 62.908 1.00 73.51 C ATOM 1208 CG2 VAL A 93 1.106 -25.859 60.495 1.00 63.43 C ATOM 0 H VAL A 93 -2.624 -26.695 61.154 1.00 22.32 H new ATOM 0 HA VAL A 93 -0.106 -28.003 60.357 1.00 71.24 H new ATOM 0 HB VAL A 93 -0.753 -25.371 61.416 1.00 70.33 H new ATOM 0 HG11 VAL A 93 0.998 -25.244 63.139 1.00 73.51 H new ATOM 0 HG12 VAL A 93 -0.302 -26.368 63.600 1.00 73.51 H new ATOM 0 HG13 VAL A 93 1.252 -27.001 63.007 1.00 73.51 H new ATOM 0 HG21 VAL A 93 1.575 -24.911 60.759 1.00 63.43 H new ATOM 0 HG22 VAL A 93 1.851 -26.654 60.528 1.00 63.43 H new ATOM 0 HG23 VAL A 93 0.693 -25.791 59.489 1.00 63.43 H new ATOM 1218 N GLU A 94 -1.725 -28.132 63.230 1.00 44.13 N ATOM 1219 CA GLU A 94 -1.881 -28.901 64.460 1.00 35.14 C ATOM 1220 C GLU A 94 -2.744 -30.138 64.223 1.00 0.45 C ATOM 1221 O GLU A 94 -2.512 -31.193 64.813 1.00 4.25 O ATOM 1222 CB GLU A 94 -2.504 -28.033 65.554 1.00 22.43 C ATOM 1223 CG GLU A 94 -1.820 -28.171 66.904 1.00 72.32 C ATOM 1224 CD GLU A 94 -1.511 -26.830 67.541 1.00 43.34 C ATOM 1225 OE1 GLU A 94 -1.082 -25.911 66.812 1.00 72.35 O ATOM 1226 OE2 GLU A 94 -1.698 -26.700 68.769 1.00 31.11 O ATOM 0 H GLU A 94 -2.428 -27.406 63.094 1.00 44.13 H new ATOM 0 HA GLU A 94 -0.892 -29.226 64.783 1.00 35.14 H new ATOM 0 HB2 GLU A 94 -2.467 -26.989 65.243 1.00 22.43 H new ATOM 0 HB3 GLU A 94 -3.556 -28.297 65.661 1.00 22.43 H new ATOM 0 HG2 GLU A 94 -2.458 -28.748 67.573 1.00 72.32 H new ATOM 0 HG3 GLU A 94 -0.894 -28.733 66.782 1.00 72.32 H new ATOM 1231 N TYR A 95 -3.739 -29.999 63.354 1.00 63.41 N ATOM 1232 CA TYR A 95 -4.639 -31.102 63.040 1.00 21.32 C ATOM 1233 C TYR A 95 -4.068 -31.970 61.924 1.00 50.43 C ATOM 1234 O TYR A 95 -4.170 -33.197 61.961 1.00 2.22 O ATOM 1235 CB TYR A 95 -6.014 -30.567 62.634 1.00 55.41 C ATOM 1236 CG TYR A 95 -6.892 -31.601 61.967 1.00 21.22 C ATOM 1237 CD1 TYR A 95 -6.823 -31.820 60.596 1.00 34.04 C ATOM 1238 CD2 TYR A 95 -7.791 -32.359 62.707 1.00 75.10 C ATOM 1239 CE1 TYR A 95 -7.625 -32.762 59.982 1.00 73.14 C ATOM 1240 CE2 TYR A 95 -8.596 -33.305 62.101 1.00 42.55 C ATOM 1241 CZ TYR A 95 -8.509 -33.503 60.739 1.00 54.13 C ATOM 1242 OH TYR A 95 -9.309 -34.444 60.132 1.00 51.11 O ATOM 0 H TYR A 95 -3.943 -29.133 62.855 1.00 63.41 H new ATOM 0 HA TYR A 95 -4.746 -31.716 63.934 1.00 21.32 H new ATOM 0 HB2 TYR A 95 -6.523 -30.187 63.520 1.00 55.41 H new ATOM 0 HB3 TYR A 95 -5.881 -29.724 61.956 1.00 55.41 H new ATOM 0 HD1 TYR A 95 -6.130 -31.244 60.001 1.00 34.04 H new ATOM 0 HD2 TYR A 95 -7.862 -32.206 63.774 1.00 75.10 H new ATOM 0 HE1 TYR A 95 -7.561 -32.918 58.915 1.00 73.14 H new ATOM 0 HE2 TYR A 95 -9.289 -33.886 62.691 1.00 42.55 H new ATOM 0 HH TYR A 95 -9.873 -34.878 60.806 1.00 51.11 H new ATOM 1251 N VAL A 96 -3.465 -31.324 60.930 1.00 61.20 N ATOM 1252 CA VAL A 96 -2.874 -32.035 59.802 1.00 60.45 C ATOM 1253 C VAL A 96 -1.437 -32.444 60.103 1.00 41.30 C ATOM 1254 O VAL A 96 -1.114 -33.631 60.146 1.00 62.45 O ATOM 1255 CB VAL A 96 -2.898 -31.177 58.524 1.00 44.42 C ATOM 1256 CG1 VAL A 96 -1.721 -31.527 57.626 1.00 13.42 C ATOM 1257 CG2 VAL A 96 -4.215 -31.357 57.786 1.00 11.32 C ATOM 0 H VAL A 96 -3.373 -30.309 60.883 1.00 61.20 H new ATOM 0 HA VAL A 96 -3.475 -32.929 59.640 1.00 60.45 H new ATOM 0 HB VAL A 96 -2.809 -30.128 58.808 1.00 44.42 H new ATOM 0 HG11 VAL A 96 -1.753 -30.911 56.727 1.00 13.42 H new ATOM 0 HG12 VAL A 96 -0.789 -31.342 58.159 1.00 13.42 H new ATOM 0 HG13 VAL A 96 -1.776 -32.579 57.347 1.00 13.42 H new ATOM 0 HG21 VAL A 96 -4.214 -30.743 56.885 1.00 11.32 H new ATOM 0 HG22 VAL A 96 -4.338 -32.405 57.511 1.00 11.32 H new ATOM 0 HG23 VAL A 96 -5.039 -31.053 58.432 1.00 11.32 H new ATOM 1267 N SER A 97 -0.577 -31.453 60.308 1.00 5.42 N ATOM 1268 CA SER A 97 0.829 -31.708 60.601 1.00 43.04 C ATOM 1269 C SER A 97 0.987 -32.387 61.958 1.00 70.04 C ATOM 1270 O SER A 97 1.802 -33.294 62.121 1.00 40.31 O ATOM 1271 CB SER A 97 1.623 -30.401 60.577 1.00 1.20 C ATOM 1272 OG SER A 97 2.360 -30.229 61.775 1.00 75.51 O ATOM 0 H SER A 97 -0.829 -30.465 60.277 1.00 5.42 H new ATOM 0 HA SER A 97 1.219 -32.375 59.832 1.00 43.04 H new ATOM 0 HB2 SER A 97 2.303 -30.401 59.725 1.00 1.20 H new ATOM 0 HB3 SER A 97 0.942 -29.561 60.442 1.00 1.20 H new ATOM 0 HG SER A 97 1.818 -29.734 62.424 1.00 75.51 H new ATOM 1277 N GLY A 98 0.198 -31.940 62.931 1.00 64.25 N ATOM 1278 CA GLY A 98 0.265 -32.516 64.262 1.00 25.35 C ATOM 1279 C GLY A 98 -0.141 -33.976 64.285 1.00 11.34 C ATOM 1280 O GLY A 98 0.309 -34.739 65.139 1.00 31.31 O ATOM 0 H GLY A 98 -0.485 -31.191 62.822 1.00 64.25 H new ATOM 0 HA2 GLY A 98 1.281 -32.419 64.645 1.00 25.35 H new ATOM 0 HA3 GLY A 98 -0.384 -31.951 64.932 1.00 25.35 H new ATOM 1283 N ARG A 99 -0.995 -34.365 63.344 1.00 24.02 N ATOM 1284 CA ARG A 99 -1.464 -35.743 63.260 1.00 42.12 C ATOM 1285 C ARG A 99 -0.372 -36.657 62.713 1.00 0.02 C ATOM 1286 O ARG A 99 0.002 -37.644 63.346 1.00 70.13 O ATOM 1287 CB ARG A 99 -2.707 -35.828 62.374 1.00 20.23 C ATOM 1288 CG ARG A 99 -4.010 -35.882 63.155 1.00 60.53 C ATOM 1289 CD ARG A 99 -4.028 -34.859 64.279 1.00 24.40 C ATOM 1290 NE ARG A 99 -3.691 -35.455 65.569 1.00 35.24 N ATOM 1291 CZ ARG A 99 -4.557 -36.134 66.314 1.00 14.32 C ATOM 1292 NH1 ARG A 99 -5.805 -36.301 65.899 1.00 61.50 N ATOM 1293 NH2 ARG A 99 -4.174 -36.647 67.476 1.00 21.32 N ATOM 0 H ARG A 99 -1.376 -33.745 62.629 1.00 24.02 H new ATOM 0 HA ARG A 99 -1.720 -36.075 64.266 1.00 42.12 H new ATOM 0 HB2 ARG A 99 -2.728 -34.965 61.708 1.00 20.23 H new ATOM 0 HB3 ARG A 99 -2.634 -36.715 61.744 1.00 20.23 H new ATOM 0 HG2 ARG A 99 -4.847 -35.699 62.481 1.00 60.53 H new ATOM 0 HG3 ARG A 99 -4.146 -36.881 63.569 1.00 60.53 H new ATOM 0 HD2 ARG A 99 -3.321 -34.060 64.053 1.00 24.40 H new ATOM 0 HD3 ARG A 99 -5.016 -34.403 64.338 1.00 24.40 H new ATOM 0 HE ARG A 99 -2.739 -35.344 65.917 1.00 35.24 H new ATOM 0 HH11 ARG A 99 -6.102 -35.908 65.006 1.00 61.50 H new ATOM 0 HH12 ARG A 99 -6.468 -36.823 66.473 1.00 61.50 H new ATOM 0 HH21 ARG A 99 -3.214 -36.520 67.798 1.00 21.32 H new ATOM 0 HH22 ARG A 99 -4.839 -37.168 68.047 1.00 21.32 H new ATOM 1304 N VAL A 100 0.137 -36.321 61.531 1.00 64.53 N ATOM 1305 CA VAL A 100 1.187 -37.110 60.899 1.00 73.23 C ATOM 1306 C VAL A 100 2.475 -37.062 61.711 1.00 53.31 C ATOM 1307 O VAL A 100 3.319 -37.954 61.610 1.00 45.22 O ATOM 1308 CB VAL A 100 1.475 -36.615 59.469 1.00 74.15 C ATOM 1309 CG1 VAL A 100 2.432 -37.562 58.760 1.00 73.51 C ATOM 1310 CG2 VAL A 100 0.179 -36.468 58.685 1.00 14.30 C ATOM 0 H VAL A 100 -0.161 -35.508 60.993 1.00 64.53 H new ATOM 0 HA VAL A 100 0.828 -38.138 60.855 1.00 73.23 H new ATOM 0 HB VAL A 100 1.949 -35.635 59.530 1.00 74.15 H new ATOM 0 HG11 VAL A 100 2.624 -37.197 57.751 1.00 73.51 H new ATOM 0 HG12 VAL A 100 3.370 -37.612 59.313 1.00 73.51 H new ATOM 0 HG13 VAL A 100 1.988 -38.556 58.708 1.00 73.51 H new ATOM 0 HG21 VAL A 100 0.401 -36.117 57.677 1.00 14.30 H new ATOM 0 HG22 VAL A 100 -0.325 -37.433 58.631 1.00 14.30 H new ATOM 0 HG23 VAL A 100 -0.469 -35.748 59.185 1.00 14.30 H new ATOM 1320 N HIS A 101 2.622 -36.016 62.517 1.00 24.23 N ATOM 1321 CA HIS A 101 3.809 -35.852 63.350 1.00 54.22 C ATOM 1322 C HIS A 101 4.078 -37.112 64.166 1.00 51.02 C ATOM 1323 O HIS A 101 5.227 -37.441 64.459 1.00 12.31 O ATOM 1324 CB HIS A 101 3.643 -34.652 64.282 1.00 20.32 C ATOM 1325 CG HIS A 101 4.868 -34.342 65.084 1.00 63.01 C ATOM 1326 ND1 HIS A 101 5.876 -33.517 64.632 1.00 61.23 N ATOM 1327 CD2 HIS A 101 5.245 -34.751 66.318 1.00 61.31 C ATOM 1328 CE1 HIS A 101 6.820 -33.433 65.552 1.00 40.50 C ATOM 1329 NE2 HIS A 101 6.461 -34.172 66.586 1.00 55.22 N ATOM 0 H HIS A 101 1.934 -35.269 62.612 1.00 24.23 H new ATOM 0 HA HIS A 101 4.661 -35.677 62.694 1.00 54.22 H new ATOM 0 HB2 HIS A 101 3.376 -33.777 63.690 1.00 20.32 H new ATOM 0 HB3 HIS A 101 2.813 -34.843 64.962 1.00 20.32 H new ATOM 0 HD2 HIS A 101 4.692 -35.410 66.971 1.00 61.31 H new ATOM 0 HE1 HIS A 101 7.731 -32.858 65.472 1.00 40.50 H new ATOM 0 HE2 HIS A 101 6.999 -34.293 67.444 1.00 55.22 H new ATOM 1336 N GLY A 102 3.009 -37.814 64.533 1.00 1.44 N ATOM 1337 CA GLY A 102 3.152 -39.029 65.313 1.00 63.44 C ATOM 1338 C GLY A 102 2.772 -38.831 66.768 1.00 52.54 C ATOM 1339 O GLY A 102 3.446 -38.107 67.498 1.00 42.31 O ATOM 0 H GLY A 102 2.047 -37.562 64.304 1.00 1.44 H new ATOM 0 HA2 GLY A 102 2.527 -39.811 64.880 1.00 63.44 H new ATOM 0 HA3 GLY A 102 4.184 -39.376 65.254 1.00 63.44 H new ATOM 1342 N GLU A 103 1.688 -39.476 67.187 1.00 54.04 N ATOM 1343 CA GLU A 103 1.219 -39.366 68.563 1.00 62.55 C ATOM 1344 C GLU A 103 1.662 -40.571 69.388 1.00 54.25 C ATOM 1345 O GLU A 103 1.531 -41.715 68.953 1.00 71.32 O ATOM 1346 CB GLU A 103 -0.305 -39.243 68.597 1.00 72.55 C ATOM 1347 CG GLU A 103 -1.028 -40.536 68.253 1.00 22.35 C ATOM 1348 CD GLU A 103 -2.537 -40.388 68.292 1.00 43.33 C ATOM 1349 OE1 GLU A 103 -3.019 -39.250 68.466 1.00 44.50 O ATOM 1350 OE2 GLU A 103 -3.235 -41.413 68.149 1.00 32.43 O ATOM 0 H GLU A 103 1.119 -40.080 66.594 1.00 54.04 H new ATOM 0 HA GLU A 103 1.659 -38.469 68.999 1.00 62.55 H new ATOM 0 HB2 GLU A 103 -0.613 -38.918 69.591 1.00 72.55 H new ATOM 0 HB3 GLU A 103 -0.614 -38.466 67.897 1.00 72.55 H new ATOM 0 HG2 GLU A 103 -0.724 -40.864 67.259 1.00 22.35 H new ATOM 0 HG3 GLU A 103 -0.725 -41.315 68.953 1.00 22.35 H new ATOM 1355 N GLU A 104 2.187 -40.305 70.579 1.00 43.23 N ATOM 1356 CA GLU A 104 2.651 -41.368 71.464 1.00 31.34 C ATOM 1357 C GLU A 104 1.613 -41.671 72.541 1.00 33.22 C ATOM 1358 O GLU A 104 1.886 -42.402 73.493 1.00 20.45 O ATOM 1359 CB GLU A 104 3.978 -40.976 72.116 1.00 24.30 C ATOM 1360 CG GLU A 104 5.189 -41.236 71.237 1.00 71.12 C ATOM 1361 CD GLU A 104 6.475 -41.351 72.032 1.00 3.24 C ATOM 1362 OE1 GLU A 104 6.801 -40.398 72.771 1.00 44.24 O ATOM 1363 OE2 GLU A 104 7.155 -42.392 71.917 1.00 22.11 O ATOM 0 H GLU A 104 2.302 -39.363 70.954 1.00 43.23 H new ATOM 0 HA GLU A 104 2.800 -42.266 70.864 1.00 31.34 H new ATOM 0 HB2 GLU A 104 3.948 -39.917 72.374 1.00 24.30 H new ATOM 0 HB3 GLU A 104 4.092 -41.528 73.049 1.00 24.30 H new ATOM 0 HG2 GLU A 104 5.032 -42.155 70.672 1.00 71.12 H new ATOM 0 HG3 GLU A 104 5.286 -40.429 70.511 1.00 71.12 H new ATOM 1368 N ASP A 105 0.421 -41.105 72.382 1.00 4.41 N ATOM 1369 CA ASP A 105 -0.658 -41.314 73.339 1.00 63.11 C ATOM 1370 C ASP A 105 -1.156 -42.755 73.290 1.00 62.15 C ATOM 1371 O ASP A 105 -0.937 -43.481 72.320 1.00 61.24 O ATOM 1372 CB ASP A 105 -1.814 -40.353 73.054 1.00 40.12 C ATOM 1373 CG ASP A 105 -1.666 -39.036 73.790 1.00 42.35 C ATOM 1374 OD1 ASP A 105 -0.635 -38.359 73.594 1.00 21.24 O ATOM 1375 OD2 ASP A 105 -2.581 -38.682 74.563 1.00 41.13 O ATOM 0 H ASP A 105 0.178 -40.498 71.599 1.00 4.41 H new ATOM 0 HA ASP A 105 -0.268 -41.116 74.338 1.00 63.11 H new ATOM 0 HB2 ASP A 105 -1.869 -40.163 71.982 1.00 40.12 H new ATOM 0 HB3 ASP A 105 -2.754 -40.824 73.343 1.00 40.12 H new ATOM 1379 N PRO A 106 -1.840 -43.182 74.363 1.00 12.14 N ATOM 1380 CA PRO A 106 -2.381 -44.540 74.466 1.00 63.12 C ATOM 1381 C PRO A 106 -3.544 -44.776 73.508 1.00 4.33 C ATOM 1382 O PRO A 106 -4.013 -45.904 73.349 1.00 21.23 O ATOM 1383 CB PRO A 106 -2.859 -44.621 75.918 1.00 32.55 C ATOM 1384 CG PRO A 106 -3.136 -43.209 76.305 1.00 43.24 C ATOM 1385 CD PRO A 106 -2.138 -42.371 75.555 1.00 41.34 C ATOM 0 HA PRO A 106 -1.640 -45.295 74.203 1.00 63.12 H new ATOM 0 HB2 PRO A 106 -3.753 -45.238 76.007 1.00 32.55 H new ATOM 0 HB3 PRO A 106 -2.099 -45.066 76.561 1.00 32.55 H new ATOM 0 HG2 PRO A 106 -4.156 -42.926 76.046 1.00 43.24 H new ATOM 0 HG3 PRO A 106 -3.031 -43.071 77.381 1.00 43.24 H new ATOM 0 HD2 PRO A 106 -2.551 -41.399 75.287 1.00 41.34 H new ATOM 0 HD3 PRO A 106 -1.243 -42.185 76.148 1.00 41.34 H new ATOM 1390 N THR A 107 -4.006 -43.704 72.871 1.00 72.34 N ATOM 1391 CA THR A 107 -5.114 -43.795 71.929 1.00 24.24 C ATOM 1392 C THR A 107 -4.812 -44.794 70.818 1.00 23.45 C ATOM 1393 O THR A 107 -5.724 -45.341 70.197 1.00 11.11 O ATOM 1394 CB THR A 107 -5.429 -42.425 71.299 1.00 5.34 C ATOM 1395 OG1 THR A 107 -5.419 -41.407 72.308 1.00 15.33 O ATOM 1396 CG2 THR A 107 -6.784 -42.445 70.608 1.00 14.25 C ATOM 0 H THR A 107 -3.630 -42.763 72.991 1.00 72.34 H new ATOM 0 HA THR A 107 -5.981 -44.136 72.494 1.00 24.24 H new ATOM 0 HB THR A 107 -4.662 -42.208 70.555 1.00 5.34 H new ATOM 0 HG1 THR A 107 -5.618 -40.539 71.899 1.00 15.33 H new ATOM 0 HG21 THR A 107 -6.984 -41.467 70.171 1.00 14.25 H new ATOM 0 HG22 THR A 107 -6.780 -43.200 69.822 1.00 14.25 H new ATOM 0 HG23 THR A 107 -7.560 -42.683 71.336 1.00 14.25 H new ATOM 1404 N LYS A 108 -3.528 -45.029 70.573 1.00 24.23 N ATOM 1405 CA LYS A 108 -3.104 -45.965 69.539 1.00 35.33 C ATOM 1406 C LYS A 108 -3.630 -47.368 69.827 1.00 15.33 C ATOM 1407 O LYS A 108 -3.336 -47.950 70.871 1.00 52.21 O ATOM 1408 CB LYS A 108 -1.578 -45.990 69.439 1.00 54.22 C ATOM 1409 CG LYS A 108 -0.961 -44.625 69.192 1.00 23.14 C ATOM 1410 CD LYS A 108 -1.195 -44.156 67.766 1.00 73.52 C ATOM 1411 CE LYS A 108 -0.073 -44.604 66.841 1.00 62.32 C ATOM 1412 NZ LYS A 108 -0.339 -45.948 66.257 1.00 22.44 N ATOM 0 H LYS A 108 -2.762 -44.583 71.077 1.00 24.23 H new ATOM 0 HA LYS A 108 -3.518 -45.629 68.588 1.00 35.33 H new ATOM 0 HB2 LYS A 108 -1.169 -46.403 70.361 1.00 54.22 H new ATOM 0 HB3 LYS A 108 -1.286 -46.662 68.632 1.00 54.22 H new ATOM 0 HG2 LYS A 108 -1.386 -43.902 69.888 1.00 23.14 H new ATOM 0 HG3 LYS A 108 0.110 -44.668 69.391 1.00 23.14 H new ATOM 0 HD2 LYS A 108 -2.145 -44.549 67.404 1.00 73.52 H new ATOM 0 HD3 LYS A 108 -1.271 -43.069 67.747 1.00 73.52 H new ATOM 0 HE2 LYS A 108 0.048 -43.877 66.038 1.00 62.32 H new ATOM 0 HE3 LYS A 108 0.866 -44.628 67.394 1.00 62.32 H new ATOM 0 HZ1 LYS A 108 0.017 -45.979 65.280 1.00 22.44 H new ATOM 0 HZ2 LYS A 108 0.143 -46.675 66.824 1.00 22.44 H new ATOM 0 HZ3 LYS A 108 -1.363 -46.131 66.258 1.00 22.44 H new ATOM 1422 N LYS A 109 -4.407 -47.907 68.893 1.00 70.12 N ATOM 1423 CA LYS A 109 -4.970 -49.243 69.044 1.00 62.44 C ATOM 1424 C LYS A 109 -3.939 -50.311 68.697 1.00 61.41 C ATOM 1425 O LYS A 109 -4.154 -51.498 68.942 1.00 71.34 O ATOM 1426 CB LYS A 109 -6.204 -49.402 68.152 1.00 64.13 C ATOM 1427 CG LYS A 109 -7.239 -50.362 68.712 1.00 74.24 C ATOM 1428 CD LYS A 109 -8.305 -49.630 69.510 1.00 42.41 C ATOM 1429 CE LYS A 109 -7.785 -49.204 70.874 1.00 42.35 C ATOM 1430 NZ LYS A 109 -7.180 -47.843 70.838 1.00 0.23 N ATOM 0 H LYS A 109 -4.661 -47.438 68.023 1.00 70.12 H new ATOM 0 HA LYS A 109 -5.263 -49.371 70.086 1.00 62.44 H new ATOM 0 HB2 LYS A 109 -6.666 -48.425 68.008 1.00 64.13 H new ATOM 0 HB3 LYS A 109 -5.889 -49.753 67.169 1.00 64.13 H new ATOM 0 HG2 LYS A 109 -7.708 -50.910 67.895 1.00 74.24 H new ATOM 0 HG3 LYS A 109 -6.747 -51.097 69.349 1.00 74.24 H new ATOM 0 HD2 LYS A 109 -8.637 -48.752 68.956 1.00 42.41 H new ATOM 0 HD3 LYS A 109 -9.174 -50.276 69.636 1.00 42.41 H new ATOM 0 HE2 LYS A 109 -8.602 -49.219 71.595 1.00 42.35 H new ATOM 0 HE3 LYS A 109 -7.042 -49.923 71.220 1.00 42.35 H new ATOM 0 HZ1 LYS A 109 -6.214 -47.882 71.222 1.00 0.23 H new ATOM 0 HZ2 LYS A 109 -7.148 -47.503 69.856 1.00 0.23 H new ATOM 0 HZ3 LYS A 109 -7.755 -47.192 71.411 1.00 0.23 H new TER 1440 LYS A 109