USER MOD reduce.3.24.130724 H: found=0, std=0, add=1090, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1085 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 88 SER OG : rot 160:sc= -1.37! USER MOD Set 1.2: A 89 HIS : no HE2:sc= -2.59! C(o=-3.5!,f=-18!) USER MOD Set 1.3: A 142 CYS SG : rot 160:sc= -0.164 USER MOD Set 1.4: A 187 SER OG : rot 18:sc= 0.66! USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=-0.099) USER MOD Single : A 71 THR OG1 : rot -5:sc= -0.247 USER MOD Single : A 73 GLN : amide:sc= -0.0982 X(o=-0.098,f=0) USER MOD Single : A 79 MET CE :methyl -151:sc= -0.0735 (180deg=-0.81) USER MOD Single : A 80 THR OG1 : rot -170:sc= -0.254! USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ -161:sc= 0.162 (180deg=-0.92) USER MOD Single : A 92 LYS NZ :NH3+ 164:sc= 0.128 (180deg=-0.475) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 HIS : no HE2:sc= -2.66! C(o=-2.7!,f=-8.2!) USER MOD Single : A 103 SER OG : rot 180:sc=-0.00531 USER MOD Single : A 104 GLN : amide:sc= -0.0196 K(o=-0.02,f=-1.2!) USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 115 TYR OH : rot 180:sc= 0 USER MOD Single : A 116 HIS : no HD1:sc= -0.102 X(o=-0.1,f=-0.22) USER MOD Single : A 117 THR OG1 : rot 3:sc= -0.227 USER MOD Single : A 118 GLN : amide:sc= -7.37! C(o=-7.4!,f=-9.9!) USER MOD Single : A 120 TYR OH : rot 180:sc= -0.355 USER MOD Single : A 125 GLN : amide:sc= -1.4 K(o=-1.4,f=-4.7!) USER MOD Single : A 126 ASN : amide:sc= -2.57! C(o=-2.6!,f=-3.1!) USER MOD Single : A 127 TYR OH : rot 180:sc= 0.199 USER MOD Single : A 128 THR OG1 : rot 180:sc= -0.0844 USER MOD Single : A 135 TYR OH : rot 180:sc= 0 USER MOD Single : A 138 THR OG1 : rot -138:sc= 0.351 USER MOD Single : A 143 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 LYS NZ :NH3+ -171:sc= -2.14 (180deg=-2.39) USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 157 ASN : amide:sc=-0.00628 X(o=-0.0063,f=-0.018) USER MOD Single : A 158 LYS NZ :NH3+ 153:sc= -1.26 (180deg=-2.1) USER MOD Single : A 192 HIS : no HD1:sc= -0.0674 X(o=-0.067,f=-0.084) USER MOD Single : A 193 HIS : no HE2:sc= -1.47! C(o=-1.5!,f=-6.9!) USER MOD Single : A 194 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 199 HIS : no HD1:sc= -2.98! C(o=-3!,f=-3.6!) USER MOD Single : A 202 TYR OH : rot 180:sc= 0 USER MOD Single : A 204 LYS NZ :NH3+ -164:sc=-0.00966 (180deg=-0.278) USER MOD Single : A 205 ASN :FLIP amide:sc= -0.271 F(o=-1.4,f=-0.27) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 56 9.874 13.032 -1.971 1.00 4.61 N ATOM 2 CA ALA A 56 8.780 14.043 -1.949 1.00 3.98 C ATOM 3 C ALA A 56 7.498 13.422 -2.510 1.00 3.15 C ATOM 4 O ALA A 56 6.660 14.103 -3.070 1.00 3.23 O ATOM 5 CB ALA A 56 9.186 15.251 -2.804 1.00 4.70 C ATOM 0 HA ALA A 56 8.603 14.368 -0.924 1.00 3.98 H new ATOM 0 HB1 ALA A 56 8.387 15.992 -2.789 1.00 4.70 H new ATOM 0 HB2 ALA A 56 10.098 15.692 -2.401 1.00 4.70 H new ATOM 0 HB3 ALA A 56 9.362 14.928 -3.830 1.00 4.70 H new ATOM 11 N TRP A 57 7.337 12.135 -2.365 1.00 2.75 N ATOM 12 CA TRP A 57 6.109 11.479 -2.893 1.00 2.31 C ATOM 13 C TRP A 57 4.909 11.865 -2.016 1.00 1.71 C ATOM 14 O TRP A 57 3.787 11.939 -2.475 1.00 2.05 O ATOM 15 CB TRP A 57 6.308 9.951 -2.903 1.00 2.59 C ATOM 16 CG TRP A 57 6.059 9.374 -1.542 1.00 2.15 C ATOM 17 CD1 TRP A 57 6.966 9.313 -0.540 1.00 2.38 C ATOM 18 CD2 TRP A 57 4.836 8.780 -1.025 1.00 1.56 C ATOM 19 NE1 TRP A 57 6.373 8.718 0.561 1.00 2.03 N ATOM 20 CE2 TRP A 57 5.059 8.372 0.310 1.00 1.45 C ATOM 21 CE3 TRP A 57 3.564 8.559 -1.584 1.00 1.38 C ATOM 22 CZ2 TRP A 57 4.053 7.765 1.065 1.00 1.05 C ATOM 23 CZ3 TRP A 57 2.552 7.949 -0.828 1.00 1.05 C ATOM 24 CH2 TRP A 57 2.795 7.553 0.493 1.00 0.77 C ATOM 0 H TRP A 57 8.001 11.512 -1.905 1.00 2.75 H new ATOM 0 HA TRP A 57 5.918 11.812 -3.913 1.00 2.31 H new ATOM 0 HB2 TRP A 57 5.631 9.496 -3.626 1.00 2.59 H new ATOM 0 HB3 TRP A 57 7.322 9.714 -3.224 1.00 2.59 H new ATOM 0 HD1 TRP A 57 7.984 9.669 -0.590 1.00 2.38 H new ATOM 0 HE1 TRP A 57 6.848 8.555 1.449 1.00 2.03 H new ATOM 0 HE3 TRP A 57 3.365 8.861 -2.602 1.00 1.38 H new ATOM 0 HZ2 TRP A 57 4.245 7.462 2.083 1.00 1.05 H new ATOM 0 HZ3 TRP A 57 1.579 7.784 -1.268 1.00 1.05 H new ATOM 0 HH2 TRP A 57 2.011 7.084 1.070 1.00 0.77 H new ATOM 35 N LEU A 58 5.145 12.111 -0.755 1.00 1.60 N ATOM 36 CA LEU A 58 4.028 12.491 0.157 1.00 1.99 C ATOM 37 C LEU A 58 3.707 13.975 -0.027 1.00 2.51 C ATOM 38 O LEU A 58 2.709 14.337 -0.617 1.00 3.09 O ATOM 39 CB LEU A 58 4.451 12.228 1.609 1.00 2.55 C ATOM 40 CG LEU A 58 3.263 12.445 2.567 1.00 2.63 C ATOM 41 CD1 LEU A 58 2.344 11.217 2.570 1.00 2.73 C ATOM 42 CD2 LEU A 58 3.791 12.673 3.988 1.00 3.22 C ATOM 0 H LEU A 58 6.065 12.065 -0.317 1.00 1.60 H new ATOM 0 HA LEU A 58 3.142 11.900 -0.076 1.00 1.99 H new ATOM 0 HB2 LEU A 58 4.822 11.208 1.706 1.00 2.55 H new ATOM 0 HB3 LEU A 58 5.271 12.893 1.881 1.00 2.55 H new ATOM 0 HG LEU A 58 2.698 13.314 2.230 1.00 2.63 H new ATOM 0 HD11 LEU A 58 1.511 11.388 3.252 1.00 2.73 H new ATOM 0 HD12 LEU A 58 1.961 11.047 1.564 1.00 2.73 H new ATOM 0 HD13 LEU A 58 2.907 10.342 2.897 1.00 2.73 H new ATOM 0 HD21 LEU A 58 2.953 12.827 4.667 1.00 3.22 H new ATOM 0 HD22 LEU A 58 4.362 11.802 4.308 1.00 3.22 H new ATOM 0 HD23 LEU A 58 4.434 13.553 4.000 1.00 3.22 H new ATOM 54 N GLU A 59 4.544 14.837 0.481 1.00 2.68 N ATOM 55 CA GLU A 59 4.286 16.298 0.341 1.00 3.25 C ATOM 56 C GLU A 59 4.591 16.735 -1.094 1.00 3.14 C ATOM 57 O GLU A 59 5.292 17.702 -1.321 1.00 3.52 O ATOM 58 CB GLU A 59 5.184 17.070 1.314 1.00 3.87 C ATOM 59 CG GLU A 59 4.610 16.975 2.729 1.00 4.68 C ATOM 60 CD GLU A 59 3.376 17.870 2.842 1.00 5.43 C ATOM 61 OE1 GLU A 59 3.543 19.078 2.876 1.00 5.81 O ATOM 62 OE2 GLU A 59 2.282 17.332 2.895 1.00 5.92 O ATOM 0 H GLU A 59 5.395 14.593 0.987 1.00 2.68 H new ATOM 0 HA GLU A 59 3.241 16.507 0.569 1.00 3.25 H new ATOM 0 HB2 GLU A 59 6.195 16.663 1.293 1.00 3.87 H new ATOM 0 HB3 GLU A 59 5.255 18.114 1.009 1.00 3.87 H new ATOM 0 HG2 GLU A 59 4.345 15.942 2.956 1.00 4.68 H new ATOM 0 HG3 GLU A 59 5.361 17.279 3.458 1.00 4.68 H new ATOM 69 N ALA A 60 4.068 16.036 -2.063 1.00 3.25 N ATOM 70 CA ALA A 60 4.328 16.420 -3.479 1.00 3.79 C ATOM 71 C ALA A 60 3.548 17.699 -3.808 1.00 3.93 C ATOM 72 O ALA A 60 3.361 18.044 -4.957 1.00 4.34 O ATOM 73 CB ALA A 60 3.880 15.286 -4.407 1.00 4.57 C ATOM 0 H ALA A 60 3.473 15.217 -1.936 1.00 3.25 H new ATOM 0 HA ALA A 60 5.394 16.599 -3.621 1.00 3.79 H new ATOM 0 HB1 ALA A 60 4.070 15.567 -5.443 1.00 4.57 H new ATOM 0 HB2 ALA A 60 4.437 14.380 -4.169 1.00 4.57 H new ATOM 0 HB3 ALA A 60 2.814 15.104 -4.270 1.00 4.57 H new ATOM 79 N GLN A 61 3.095 18.400 -2.805 1.00 4.11 N ATOM 80 CA GLN A 61 2.330 19.653 -3.054 1.00 4.74 C ATOM 81 C GLN A 61 3.294 20.763 -3.483 1.00 4.98 C ATOM 82 O GLN A 61 3.465 21.028 -4.657 1.00 5.45 O ATOM 83 CB GLN A 61 1.605 20.065 -1.770 1.00 5.31 C ATOM 84 CG GLN A 61 0.731 21.294 -2.039 1.00 5.77 C ATOM 85 CD GLN A 61 -0.311 21.437 -0.927 1.00 6.31 C ATOM 86 OE1 GLN A 61 -1.105 20.544 -0.706 1.00 6.59 O ATOM 87 NE2 GLN A 61 -0.343 22.528 -0.213 1.00 6.81 N ATOM 0 H GLN A 61 3.222 18.158 -1.822 1.00 4.11 H new ATOM 0 HA GLN A 61 1.599 19.487 -3.846 1.00 4.74 H new ATOM 0 HB2 GLN A 61 0.989 19.241 -1.409 1.00 5.31 H new ATOM 0 HB3 GLN A 61 2.330 20.287 -0.987 1.00 5.31 H new ATOM 0 HG2 GLN A 61 1.350 22.190 -2.088 1.00 5.77 H new ATOM 0 HG3 GLN A 61 0.236 21.196 -3.005 1.00 5.77 H new ATOM 0 HE21 GLN A 61 0.323 23.278 -0.398 1.00 6.81 H new ATOM 0 HE22 GLN A 61 -1.034 22.631 0.530 1.00 6.81 H new ATOM 96 N GLU A 62 3.931 21.412 -2.542 1.00 5.00 N ATOM 97 CA GLU A 62 4.890 22.505 -2.891 1.00 5.58 C ATOM 98 C GLU A 62 6.060 22.485 -1.904 1.00 5.55 C ATOM 99 O GLU A 62 7.210 22.564 -2.289 1.00 5.67 O ATOM 100 CB GLU A 62 4.176 23.857 -2.808 1.00 6.14 C ATOM 101 CG GLU A 62 3.192 23.991 -3.974 1.00 6.74 C ATOM 102 CD GLU A 62 2.616 25.408 -3.997 1.00 7.42 C ATOM 103 OE1 GLU A 62 3.398 26.345 -3.999 1.00 7.69 O ATOM 104 OE2 GLU A 62 1.402 25.534 -4.015 1.00 7.91 O ATOM 0 H GLU A 62 3.828 21.232 -1.543 1.00 5.00 H new ATOM 0 HA GLU A 62 5.263 22.354 -3.904 1.00 5.58 H new ATOM 0 HB2 GLU A 62 3.645 23.942 -1.860 1.00 6.14 H new ATOM 0 HB3 GLU A 62 4.905 24.667 -2.839 1.00 6.14 H new ATOM 0 HG2 GLU A 62 3.697 23.777 -4.916 1.00 6.74 H new ATOM 0 HG3 GLU A 62 2.388 23.262 -3.871 1.00 6.74 H new ATOM 111 N GLU A 63 5.780 22.376 -0.632 1.00 5.72 N ATOM 112 CA GLU A 63 6.880 22.346 0.375 1.00 6.01 C ATOM 113 C GLU A 63 7.529 20.961 0.361 1.00 5.97 C ATOM 114 O GLU A 63 6.859 19.959 0.209 1.00 6.17 O ATOM 115 CB GLU A 63 6.308 22.628 1.768 1.00 6.54 C ATOM 116 CG GLU A 63 7.452 22.894 2.748 1.00 6.72 C ATOM 117 CD GLU A 63 8.093 24.246 2.431 1.00 7.22 C ATOM 118 OE1 GLU A 63 7.364 25.156 2.072 1.00 7.44 O ATOM 119 OE2 GLU A 63 9.303 24.350 2.553 1.00 7.67 O ATOM 0 H GLU A 63 4.838 22.307 -0.248 1.00 5.72 H new ATOM 0 HA GLU A 63 7.623 23.105 0.131 1.00 6.01 H new ATOM 0 HB2 GLU A 63 5.640 23.489 1.731 1.00 6.54 H new ATOM 0 HB3 GLU A 63 5.715 21.779 2.107 1.00 6.54 H new ATOM 0 HG2 GLU A 63 7.077 22.889 3.771 1.00 6.72 H new ATOM 0 HG3 GLU A 63 8.197 22.101 2.678 1.00 6.72 H new ATOM 126 N GLU A 64 8.825 20.890 0.510 1.00 6.07 N ATOM 127 CA GLU A 64 9.490 19.557 0.492 1.00 6.34 C ATOM 128 C GLU A 64 10.967 19.692 0.888 1.00 6.12 C ATOM 129 O GLU A 64 11.819 19.960 0.066 1.00 6.31 O ATOM 130 CB GLU A 64 9.386 18.958 -0.918 1.00 6.85 C ATOM 131 CG GLU A 64 9.606 20.051 -1.971 1.00 7.36 C ATOM 132 CD GLU A 64 9.572 19.422 -3.365 1.00 8.01 C ATOM 133 OE1 GLU A 64 8.712 18.588 -3.594 1.00 8.39 O ATOM 134 OE2 GLU A 64 10.407 19.783 -4.177 1.00 8.36 O ATOM 0 H GLU A 64 9.445 21.689 0.642 1.00 6.07 H new ATOM 0 HA GLU A 64 8.995 18.902 1.209 1.00 6.34 H new ATOM 0 HB2 GLU A 64 10.127 18.168 -1.042 1.00 6.85 H new ATOM 0 HB3 GLU A 64 8.406 18.501 -1.056 1.00 6.85 H new ATOM 0 HG2 GLU A 64 8.834 20.816 -1.885 1.00 7.36 H new ATOM 0 HG3 GLU A 64 10.564 20.545 -1.805 1.00 7.36 H new ATOM 141 N GLU A 65 11.280 19.490 2.141 1.00 6.04 N ATOM 142 CA GLU A 65 12.704 19.587 2.571 1.00 6.09 C ATOM 143 C GLU A 65 13.399 18.264 2.255 1.00 5.38 C ATOM 144 O GLU A 65 14.495 17.996 2.704 1.00 5.46 O ATOM 145 CB GLU A 65 12.768 19.860 4.079 1.00 6.80 C ATOM 146 CG GLU A 65 12.486 21.340 4.345 1.00 7.45 C ATOM 147 CD GLU A 65 11.148 21.728 3.713 1.00 7.99 C ATOM 148 OE1 GLU A 65 11.117 21.920 2.508 1.00 8.49 O ATOM 149 OE2 GLU A 65 10.177 21.829 4.444 1.00 8.13 O ATOM 0 H GLU A 65 10.615 19.263 2.880 1.00 6.04 H new ATOM 0 HA GLU A 65 13.200 20.402 2.043 1.00 6.09 H new ATOM 0 HB2 GLU A 65 12.039 19.241 4.602 1.00 6.80 H new ATOM 0 HB3 GLU A 65 13.751 19.591 4.466 1.00 6.80 H new ATOM 0 HG2 GLU A 65 12.461 21.529 5.418 1.00 7.45 H new ATOM 0 HG3 GLU A 65 13.287 21.953 3.932 1.00 7.45 H new ATOM 156 N VAL A 66 12.756 17.439 1.477 1.00 4.95 N ATOM 157 CA VAL A 66 13.346 16.125 1.107 1.00 4.48 C ATOM 158 C VAL A 66 14.296 16.325 -0.077 1.00 4.72 C ATOM 159 O VAL A 66 14.999 17.311 -0.169 1.00 5.03 O ATOM 160 CB VAL A 66 12.208 15.165 0.714 1.00 4.18 C ATOM 161 CG1 VAL A 66 12.673 13.701 0.842 1.00 3.90 C ATOM 162 CG2 VAL A 66 11.007 15.411 1.633 1.00 4.35 C ATOM 0 H VAL A 66 11.836 17.623 1.078 1.00 4.95 H new ATOM 0 HA VAL A 66 13.900 15.705 1.946 1.00 4.48 H new ATOM 0 HB VAL A 66 11.924 15.348 -0.322 1.00 4.18 H new ATOM 0 HG11 VAL A 66 11.858 13.034 0.561 1.00 3.90 H new ATOM 0 HG12 VAL A 66 13.525 13.531 0.183 1.00 3.90 H new ATOM 0 HG13 VAL A 66 12.966 13.501 1.873 1.00 3.90 H new ATOM 0 HG21 VAL A 66 10.196 14.735 1.361 1.00 4.35 H new ATOM 0 HG22 VAL A 66 11.298 15.231 2.668 1.00 4.35 H new ATOM 0 HG23 VAL A 66 10.671 16.442 1.525 1.00 4.35 H new ATOM 172 N GLY A 67 14.308 15.395 -0.985 1.00 4.94 N ATOM 173 CA GLY A 67 15.195 15.515 -2.182 1.00 5.45 C ATOM 174 C GLY A 67 16.588 14.964 -1.869 1.00 5.43 C ATOM 175 O GLY A 67 17.372 15.582 -1.177 1.00 5.79 O ATOM 0 H GLY A 67 13.739 14.549 -0.954 1.00 4.94 H new ATOM 0 HA2 GLY A 67 14.761 14.970 -3.021 1.00 5.45 H new ATOM 0 HA3 GLY A 67 15.269 16.560 -2.485 1.00 5.45 H new ATOM 179 N PHE A 68 16.905 13.804 -2.384 1.00 5.26 N ATOM 180 CA PHE A 68 18.251 13.210 -2.132 1.00 5.45 C ATOM 181 C PHE A 68 18.583 12.220 -3.262 1.00 4.79 C ATOM 182 O PHE A 68 17.697 11.599 -3.816 1.00 4.49 O ATOM 183 CB PHE A 68 18.237 12.459 -0.801 1.00 6.13 C ATOM 184 CG PHE A 68 17.155 11.408 -0.842 1.00 6.37 C ATOM 185 CD1 PHE A 68 15.822 11.777 -0.641 1.00 6.71 C ATOM 186 CD2 PHE A 68 17.483 10.070 -1.084 1.00 6.59 C ATOM 187 CE1 PHE A 68 14.813 10.809 -0.681 1.00 7.20 C ATOM 188 CE2 PHE A 68 16.475 9.100 -1.126 1.00 7.13 C ATOM 189 CZ PHE A 68 15.139 9.470 -0.924 1.00 7.40 C ATOM 0 H PHE A 68 16.288 13.242 -2.970 1.00 5.26 H new ATOM 0 HA PHE A 68 18.999 14.002 -2.097 1.00 5.45 H new ATOM 0 HB2 PHE A 68 19.206 11.995 -0.620 1.00 6.13 H new ATOM 0 HB3 PHE A 68 18.058 13.152 0.021 1.00 6.13 H new ATOM 0 HD1 PHE A 68 15.571 12.811 -0.455 1.00 6.71 H new ATOM 0 HD2 PHE A 68 18.513 9.786 -1.238 1.00 6.59 H new ATOM 0 HE1 PHE A 68 13.783 11.095 -0.524 1.00 7.20 H new ATOM 0 HE2 PHE A 68 16.727 8.067 -1.314 1.00 7.13 H new ATOM 0 HZ PHE A 68 14.361 8.722 -0.956 1.00 7.40 H new ATOM 199 N PRO A 69 19.841 12.056 -3.600 1.00 4.86 N ATOM 200 CA PRO A 69 20.257 11.109 -4.670 1.00 4.45 C ATOM 201 C PRO A 69 19.437 9.810 -4.654 1.00 4.09 C ATOM 202 O PRO A 69 19.695 8.916 -3.872 1.00 4.61 O ATOM 203 CB PRO A 69 21.722 10.822 -4.329 1.00 5.21 C ATOM 204 CG PRO A 69 22.224 12.075 -3.678 1.00 5.88 C ATOM 205 CD PRO A 69 21.008 12.748 -3.012 1.00 5.67 C ATOM 0 HA PRO A 69 20.107 11.524 -5.667 1.00 4.45 H new ATOM 0 HB2 PRO A 69 21.811 9.967 -3.659 1.00 5.21 H new ATOM 0 HB3 PRO A 69 22.296 10.586 -5.225 1.00 5.21 H new ATOM 0 HG2 PRO A 69 22.992 11.846 -2.939 1.00 5.88 H new ATOM 0 HG3 PRO A 69 22.678 12.738 -4.414 1.00 5.88 H new ATOM 0 HD2 PRO A 69 21.034 12.634 -1.928 1.00 5.67 H new ATOM 0 HD3 PRO A 69 20.982 13.818 -3.219 1.00 5.67 H new ATOM 213 N VAL A 70 18.464 9.689 -5.518 1.00 3.53 N ATOM 214 CA VAL A 70 17.652 8.435 -5.547 1.00 3.48 C ATOM 215 C VAL A 70 18.412 7.378 -6.349 1.00 3.20 C ATOM 216 O VAL A 70 18.979 7.661 -7.385 1.00 3.15 O ATOM 217 CB VAL A 70 16.290 8.706 -6.195 1.00 3.52 C ATOM 218 CG1 VAL A 70 15.462 9.611 -5.282 1.00 4.19 C ATOM 219 CG2 VAL A 70 16.486 9.392 -7.550 1.00 3.47 C ATOM 0 H VAL A 70 18.197 10.398 -6.201 1.00 3.53 H new ATOM 0 HA VAL A 70 17.486 8.079 -4.530 1.00 3.48 H new ATOM 0 HB VAL A 70 15.769 7.760 -6.343 1.00 3.52 H new ATOM 0 HG11 VAL A 70 14.493 9.804 -5.743 1.00 4.19 H new ATOM 0 HG12 VAL A 70 15.315 9.121 -4.320 1.00 4.19 H new ATOM 0 HG13 VAL A 70 15.987 10.555 -5.132 1.00 4.19 H new ATOM 0 HG21 VAL A 70 15.514 9.582 -8.006 1.00 3.47 H new ATOM 0 HG22 VAL A 70 17.011 10.337 -7.407 1.00 3.47 H new ATOM 0 HG23 VAL A 70 17.073 8.746 -8.203 1.00 3.47 H new ATOM 229 N THR A 71 18.445 6.163 -5.871 1.00 3.33 N ATOM 230 CA THR A 71 19.188 5.092 -6.600 1.00 3.19 C ATOM 231 C THR A 71 18.270 4.441 -7.655 1.00 2.33 C ATOM 232 O THR A 71 17.193 3.988 -7.328 1.00 2.20 O ATOM 233 CB THR A 71 19.623 4.022 -5.596 1.00 3.92 C ATOM 234 OG1 THR A 71 18.512 3.193 -5.284 1.00 4.10 O ATOM 235 CG2 THR A 71 20.137 4.687 -4.319 1.00 4.65 C ATOM 0 H THR A 71 17.990 5.865 -5.008 1.00 3.33 H new ATOM 0 HA THR A 71 20.057 5.526 -7.095 1.00 3.19 H new ATOM 0 HB THR A 71 20.421 3.420 -6.032 1.00 3.92 H new ATOM 0 HG1 THR A 71 17.707 3.548 -5.716 1.00 4.10 H new ATOM 0 HG21 THR A 71 20.445 3.920 -3.608 1.00 4.65 H new ATOM 0 HG22 THR A 71 20.989 5.324 -4.558 1.00 4.65 H new ATOM 0 HG23 THR A 71 19.344 5.292 -3.879 1.00 4.65 H new ATOM 243 N PRO A 72 18.679 4.372 -8.910 1.00 2.04 N ATOM 244 CA PRO A 72 17.851 3.747 -9.984 1.00 1.36 C ATOM 245 C PRO A 72 17.941 2.216 -9.954 1.00 1.25 C ATOM 246 O PRO A 72 18.259 1.625 -8.944 1.00 1.81 O ATOM 247 CB PRO A 72 18.462 4.309 -11.270 1.00 1.84 C ATOM 248 CG PRO A 72 19.908 4.489 -10.943 1.00 2.59 C ATOM 249 CD PRO A 72 19.961 4.874 -9.457 1.00 2.69 C ATOM 0 HA PRO A 72 16.789 3.970 -9.878 1.00 1.36 H new ATOM 0 HB2 PRO A 72 18.326 3.625 -12.107 1.00 1.84 H new ATOM 0 HB3 PRO A 72 17.997 5.254 -11.552 1.00 1.84 H new ATOM 0 HG2 PRO A 72 20.467 3.572 -11.129 1.00 2.59 H new ATOM 0 HG3 PRO A 72 20.355 5.266 -11.564 1.00 2.59 H new ATOM 0 HD2 PRO A 72 20.815 4.417 -8.957 1.00 2.69 H new ATOM 0 HD3 PRO A 72 20.055 5.952 -9.327 1.00 2.69 H new ATOM 257 N GLN A 73 17.639 1.574 -11.050 1.00 1.10 N ATOM 258 CA GLN A 73 17.683 0.088 -11.096 1.00 1.44 C ATOM 259 C GLN A 73 18.940 -0.434 -10.389 1.00 1.16 C ATOM 260 O GLN A 73 19.999 -0.554 -10.969 1.00 1.32 O ATOM 261 CB GLN A 73 17.690 -0.374 -12.560 1.00 2.13 C ATOM 262 CG GLN A 73 16.765 0.522 -13.387 1.00 2.59 C ATOM 263 CD GLN A 73 16.525 -0.117 -14.757 1.00 3.31 C ATOM 264 OE1 GLN A 73 16.791 0.491 -15.776 1.00 3.76 O ATOM 265 NE2 GLN A 73 16.035 -1.323 -14.826 1.00 3.98 N ATOM 0 H GLN A 73 17.361 2.022 -11.923 1.00 1.10 H new ATOM 0 HA GLN A 73 16.805 -0.307 -10.586 1.00 1.44 H new ATOM 0 HB2 GLN A 73 18.703 -0.334 -12.959 1.00 2.13 H new ATOM 0 HB3 GLN A 73 17.362 -1.411 -12.626 1.00 2.13 H new ATOM 0 HG2 GLN A 73 15.817 0.661 -12.868 1.00 2.59 H new ATOM 0 HG3 GLN A 73 17.210 1.510 -13.508 1.00 2.59 H new ATOM 0 HE21 GLN A 73 15.812 -1.833 -13.971 1.00 3.98 H new ATOM 0 HE22 GLN A 73 15.875 -1.757 -15.735 1.00 3.98 H new ATOM 274 N VAL A 74 18.796 -0.773 -9.143 1.00 1.04 N ATOM 275 CA VAL A 74 19.935 -1.336 -8.349 1.00 0.93 C ATOM 276 C VAL A 74 19.792 -2.862 -8.344 1.00 0.86 C ATOM 277 O VAL A 74 18.704 -3.369 -8.531 1.00 0.89 O ATOM 278 CB VAL A 74 19.849 -0.798 -6.911 1.00 1.09 C ATOM 279 CG1 VAL A 74 20.469 0.603 -6.834 1.00 1.17 C ATOM 280 CG2 VAL A 74 18.375 -0.720 -6.498 1.00 1.38 C ATOM 0 H VAL A 74 17.922 -0.685 -8.625 1.00 1.04 H new ATOM 0 HA VAL A 74 20.895 -1.051 -8.780 1.00 0.93 H new ATOM 0 HB VAL A 74 20.394 -1.465 -6.243 1.00 1.09 H new ATOM 0 HG11 VAL A 74 20.403 0.974 -5.811 1.00 1.17 H new ATOM 0 HG12 VAL A 74 21.515 0.555 -7.136 1.00 1.17 H new ATOM 0 HG13 VAL A 74 19.930 1.277 -7.500 1.00 1.17 H new ATOM 0 HG21 VAL A 74 18.302 -0.339 -5.479 1.00 1.38 H new ATOM 0 HG22 VAL A 74 17.843 -0.051 -7.174 1.00 1.38 H new ATOM 0 HG23 VAL A 74 17.930 -1.714 -6.547 1.00 1.38 H new ATOM 290 N PRO A 75 20.861 -3.599 -8.128 1.00 0.93 N ATOM 291 CA PRO A 75 20.806 -5.089 -8.094 1.00 1.00 C ATOM 292 C PRO A 75 19.484 -5.596 -7.503 1.00 0.88 C ATOM 293 O PRO A 75 19.080 -5.203 -6.428 1.00 0.84 O ATOM 294 CB PRO A 75 21.993 -5.443 -7.205 1.00 1.18 C ATOM 295 CG PRO A 75 23.018 -4.394 -7.523 1.00 1.37 C ATOM 296 CD PRO A 75 22.237 -3.115 -7.897 1.00 1.13 C ATOM 0 HA PRO A 75 20.854 -5.545 -9.083 1.00 1.00 H new ATOM 0 HB2 PRO A 75 21.719 -5.425 -6.150 1.00 1.18 H new ATOM 0 HB3 PRO A 75 22.367 -6.444 -7.421 1.00 1.18 H new ATOM 0 HG2 PRO A 75 23.668 -4.215 -6.667 1.00 1.37 H new ATOM 0 HG3 PRO A 75 23.657 -4.713 -8.347 1.00 1.37 H new ATOM 0 HD2 PRO A 75 22.272 -2.376 -7.097 1.00 1.13 H new ATOM 0 HD3 PRO A 75 22.649 -2.640 -8.787 1.00 1.13 H new ATOM 304 N LEU A 76 18.795 -6.439 -8.221 1.00 0.86 N ATOM 305 CA LEU A 76 17.480 -6.946 -7.726 1.00 0.77 C ATOM 306 C LEU A 76 17.662 -7.761 -6.442 1.00 0.77 C ATOM 307 O LEU A 76 17.988 -8.931 -6.475 1.00 0.85 O ATOM 308 CB LEU A 76 16.831 -7.819 -8.802 1.00 0.84 C ATOM 309 CG LEU A 76 16.567 -6.989 -10.070 1.00 0.87 C ATOM 310 CD1 LEU A 76 16.103 -7.926 -11.192 1.00 1.01 C ATOM 311 CD2 LEU A 76 15.479 -5.925 -9.801 1.00 0.76 C ATOM 0 H LEU A 76 19.084 -6.800 -9.130 1.00 0.86 H new ATOM 0 HA LEU A 76 16.838 -6.093 -7.507 1.00 0.77 H new ATOM 0 HB2 LEU A 76 17.481 -8.661 -9.038 1.00 0.84 H new ATOM 0 HB3 LEU A 76 15.895 -8.234 -8.428 1.00 0.84 H new ATOM 0 HG LEU A 76 17.486 -6.481 -10.363 1.00 0.87 H new ATOM 0 HD11 LEU A 76 15.913 -7.346 -12.095 1.00 1.01 H new ATOM 0 HD12 LEU A 76 16.878 -8.666 -11.392 1.00 1.01 H new ATOM 0 HD13 LEU A 76 15.187 -8.433 -10.887 1.00 1.01 H new ATOM 0 HD21 LEU A 76 15.304 -5.346 -10.708 1.00 0.76 H new ATOM 0 HD22 LEU A 76 14.554 -6.418 -9.501 1.00 0.76 H new ATOM 0 HD23 LEU A 76 15.810 -5.259 -9.004 1.00 0.76 H new ATOM 323 N ARG A 77 17.427 -7.151 -5.309 1.00 0.74 N ATOM 324 CA ARG A 77 17.556 -7.880 -4.013 1.00 0.79 C ATOM 325 C ARG A 77 16.266 -8.689 -3.781 1.00 0.71 C ATOM 326 O ARG A 77 15.185 -8.178 -3.994 1.00 0.73 O ATOM 327 CB ARG A 77 17.720 -6.854 -2.885 1.00 0.85 C ATOM 328 CG ARG A 77 18.012 -7.559 -1.552 1.00 1.19 C ATOM 329 CD ARG A 77 18.040 -6.525 -0.406 1.00 1.52 C ATOM 330 NE ARG A 77 19.100 -6.891 0.589 1.00 2.13 N ATOM 331 CZ ARG A 77 19.201 -8.106 1.057 1.00 2.66 C ATOM 332 NH1 ARG A 77 18.299 -9.003 0.777 1.00 2.73 N ATOM 333 NH2 ARG A 77 20.190 -8.413 1.851 1.00 3.61 N ATOM 0 H ARG A 77 17.150 -6.173 -5.226 1.00 0.74 H new ATOM 0 HA ARG A 77 18.418 -8.547 -4.032 1.00 0.79 H new ATOM 0 HB2 ARG A 77 18.532 -6.168 -3.125 1.00 0.85 H new ATOM 0 HB3 ARG A 77 16.813 -6.256 -2.795 1.00 0.85 H new ATOM 0 HG2 ARG A 77 17.250 -8.313 -1.355 1.00 1.19 H new ATOM 0 HG3 ARG A 77 18.968 -8.079 -1.608 1.00 1.19 H new ATOM 0 HD2 ARG A 77 18.234 -5.530 -0.807 1.00 1.52 H new ATOM 0 HD3 ARG A 77 17.067 -6.487 0.084 1.00 1.52 H new ATOM 0 HE ARG A 77 19.755 -6.177 0.907 1.00 2.13 H new ATOM 0 HH11 ARG A 77 17.504 -8.759 0.187 1.00 2.73 H new ATOM 0 HH12 ARG A 77 18.388 -9.949 1.148 1.00 2.73 H new ATOM 0 HH21 ARG A 77 20.880 -7.705 2.104 1.00 3.61 H new ATOM 0 HH22 ARG A 77 20.273 -9.361 2.219 1.00 3.61 H new ATOM 347 N PRO A 78 16.347 -9.932 -3.350 1.00 0.79 N ATOM 348 CA PRO A 78 15.120 -10.754 -3.111 1.00 0.76 C ATOM 349 C PRO A 78 14.277 -10.208 -1.946 1.00 0.67 C ATOM 350 O PRO A 78 14.750 -10.062 -0.836 1.00 0.69 O ATOM 351 CB PRO A 78 15.667 -12.161 -2.802 1.00 0.86 C ATOM 352 CG PRO A 78 17.068 -11.941 -2.324 1.00 1.18 C ATOM 353 CD PRO A 78 17.577 -10.691 -3.046 1.00 1.06 C ATOM 0 HA PRO A 78 14.447 -10.745 -3.968 1.00 0.76 H new ATOM 0 HB2 PRO A 78 15.065 -12.659 -2.042 1.00 0.86 H new ATOM 0 HB3 PRO A 78 15.648 -12.794 -3.689 1.00 0.86 H new ATOM 0 HG2 PRO A 78 17.093 -11.803 -1.243 1.00 1.18 H new ATOM 0 HG3 PRO A 78 17.696 -12.803 -2.550 1.00 1.18 H new ATOM 0 HD2 PRO A 78 18.257 -10.115 -2.418 1.00 1.06 H new ATOM 0 HD3 PRO A 78 18.123 -10.948 -3.954 1.00 1.06 H new ATOM 361 N MET A 79 13.032 -9.898 -2.203 1.00 0.65 N ATOM 362 CA MET A 79 12.147 -9.352 -1.131 1.00 0.61 C ATOM 363 C MET A 79 11.875 -10.431 -0.075 1.00 0.51 C ATOM 364 O MET A 79 11.226 -11.424 -0.338 1.00 0.56 O ATOM 365 CB MET A 79 10.826 -8.895 -1.755 1.00 0.66 C ATOM 366 CG MET A 79 9.953 -8.227 -0.690 1.00 0.74 C ATOM 367 SD MET A 79 8.424 -7.625 -1.460 1.00 1.25 S ATOM 368 CE MET A 79 8.463 -5.931 -0.818 1.00 0.83 C ATOM 0 H MET A 79 12.588 -10.001 -3.116 1.00 0.65 H new ATOM 0 HA MET A 79 12.639 -8.506 -0.651 1.00 0.61 H new ATOM 0 HB2 MET A 79 11.020 -8.197 -2.569 1.00 0.66 H new ATOM 0 HB3 MET A 79 10.302 -9.749 -2.185 1.00 0.66 H new ATOM 0 HG2 MET A 79 9.719 -8.937 0.103 1.00 0.74 H new ATOM 0 HG3 MET A 79 10.492 -7.399 -0.228 1.00 0.74 H new ATOM 0 HE1 MET A 79 7.444 -5.556 -0.720 1.00 0.83 H new ATOM 0 HE2 MET A 79 8.948 -5.923 0.158 1.00 0.83 H new ATOM 0 HE3 MET A 79 9.020 -5.294 -1.505 1.00 0.83 H new ATOM 378 N THR A 80 12.378 -10.240 1.117 1.00 0.56 N ATOM 379 CA THR A 80 12.169 -11.246 2.204 1.00 0.60 C ATOM 380 C THR A 80 10.912 -10.933 2.999 1.00 0.56 C ATOM 381 O THR A 80 10.500 -9.798 3.113 1.00 0.50 O ATOM 382 CB THR A 80 13.372 -11.229 3.149 1.00 0.77 C ATOM 383 OG1 THR A 80 13.253 -10.134 4.045 1.00 0.94 O ATOM 384 CG2 THR A 80 14.664 -11.091 2.341 1.00 0.73 C ATOM 0 H THR A 80 12.929 -9.425 1.387 1.00 0.56 H new ATOM 0 HA THR A 80 12.060 -12.229 1.746 1.00 0.60 H new ATOM 0 HB THR A 80 13.400 -12.161 3.713 1.00 0.77 H new ATOM 0 HG1 THR A 80 14.090 -10.026 4.543 1.00 0.94 H new ATOM 0 HG21 THR A 80 15.518 -11.079 3.019 1.00 0.73 H new ATOM 0 HG22 THR A 80 14.756 -11.934 1.656 1.00 0.73 H new ATOM 0 HG23 THR A 80 14.640 -10.162 1.772 1.00 0.73 H new ATOM 392 N TYR A 81 10.310 -11.938 3.596 1.00 0.61 N ATOM 393 CA TYR A 81 9.103 -11.684 4.431 1.00 0.60 C ATOM 394 C TYR A 81 9.506 -10.580 5.404 1.00 0.51 C ATOM 395 O TYR A 81 8.823 -9.591 5.575 1.00 0.45 O ATOM 396 CB TYR A 81 8.713 -12.989 5.174 1.00 0.69 C ATOM 397 CG TYR A 81 8.257 -12.708 6.597 1.00 0.60 C ATOM 398 CD1 TYR A 81 7.025 -12.084 6.828 1.00 0.59 C ATOM 399 CD2 TYR A 81 9.071 -13.071 7.679 1.00 0.71 C ATOM 400 CE1 TYR A 81 6.607 -11.824 8.140 1.00 0.66 C ATOM 401 CE2 TYR A 81 8.651 -12.811 8.989 1.00 0.77 C ATOM 402 CZ TYR A 81 7.420 -12.187 9.220 1.00 0.73 C ATOM 403 OH TYR A 81 7.007 -11.930 10.511 1.00 0.90 O ATOM 0 H TYR A 81 10.604 -12.913 3.538 1.00 0.61 H new ATOM 0 HA TYR A 81 8.236 -11.380 3.845 1.00 0.60 H new ATOM 0 HB2 TYR A 81 7.916 -13.494 4.629 1.00 0.69 H new ATOM 0 HB3 TYR A 81 9.566 -13.667 5.192 1.00 0.69 H new ATOM 0 HD1 TYR A 81 6.397 -11.803 5.995 1.00 0.59 H new ATOM 0 HD2 TYR A 81 10.022 -13.551 7.502 1.00 0.71 H new ATOM 0 HE1 TYR A 81 5.657 -11.343 8.318 1.00 0.66 H new ATOM 0 HE2 TYR A 81 9.278 -13.092 9.822 1.00 0.77 H new ATOM 0 HH TYR A 81 7.688 -12.246 11.141 1.00 0.90 H new ATOM 413 N LYS A 82 10.654 -10.739 5.995 1.00 0.52 N ATOM 414 CA LYS A 82 11.166 -9.704 6.911 1.00 0.48 C ATOM 415 C LYS A 82 11.278 -8.398 6.126 1.00 0.40 C ATOM 416 O LYS A 82 11.138 -7.324 6.676 1.00 0.38 O ATOM 417 CB LYS A 82 12.545 -10.119 7.428 1.00 0.55 C ATOM 418 CG LYS A 82 12.960 -9.203 8.580 1.00 0.60 C ATOM 419 CD LYS A 82 14.245 -9.733 9.217 1.00 0.92 C ATOM 420 CE LYS A 82 14.544 -8.953 10.501 1.00 1.49 C ATOM 421 NZ LYS A 82 14.197 -7.517 10.301 1.00 2.32 N ATOM 0 H LYS A 82 11.260 -11.551 5.877 1.00 0.52 H new ATOM 0 HA LYS A 82 10.497 -9.577 7.762 1.00 0.48 H new ATOM 0 HB2 LYS A 82 12.521 -11.155 7.765 1.00 0.55 H new ATOM 0 HB3 LYS A 82 13.278 -10.062 6.623 1.00 0.55 H new ATOM 0 HG2 LYS A 82 13.115 -8.188 8.214 1.00 0.60 H new ATOM 0 HG3 LYS A 82 12.165 -9.155 9.325 1.00 0.60 H new ATOM 0 HD2 LYS A 82 14.140 -10.795 9.441 1.00 0.92 H new ATOM 0 HD3 LYS A 82 15.076 -9.635 8.518 1.00 0.92 H new ATOM 0 HE2 LYS A 82 13.970 -9.365 11.331 1.00 1.49 H new ATOM 0 HE3 LYS A 82 15.598 -9.051 10.762 1.00 1.49 H new ATOM 0 HZ1 LYS A 82 14.681 -6.940 11.018 1.00 2.32 H new ATOM 0 HZ2 LYS A 82 14.499 -7.216 9.353 1.00 2.32 H new ATOM 0 HZ3 LYS A 82 13.169 -7.392 10.392 1.00 2.32 H new ATOM 435 N ALA A 83 11.526 -8.474 4.835 1.00 0.42 N ATOM 436 CA ALA A 83 11.633 -7.209 4.047 1.00 0.41 C ATOM 437 C ALA A 83 10.268 -6.508 4.002 1.00 0.35 C ATOM 438 O ALA A 83 10.175 -5.303 4.132 1.00 0.34 O ATOM 439 CB ALA A 83 12.106 -7.517 2.624 1.00 0.52 C ATOM 0 H ALA A 83 11.655 -9.337 4.308 1.00 0.42 H new ATOM 0 HA ALA A 83 12.358 -6.552 4.527 1.00 0.41 H new ATOM 0 HB1 ALA A 83 12.181 -6.589 2.057 1.00 0.52 H new ATOM 0 HB2 ALA A 83 13.083 -7.999 2.662 1.00 0.52 H new ATOM 0 HB3 ALA A 83 11.391 -8.182 2.139 1.00 0.52 H new ATOM 445 N ALA A 84 9.207 -7.253 3.824 1.00 0.34 N ATOM 446 CA ALA A 84 7.851 -6.630 3.776 1.00 0.31 C ATOM 447 C ALA A 84 7.561 -5.940 5.108 1.00 0.28 C ATOM 448 O ALA A 84 7.179 -4.787 5.150 1.00 0.28 O ATOM 449 CB ALA A 84 6.802 -7.716 3.524 1.00 0.34 C ATOM 0 H ALA A 84 9.222 -8.266 3.710 1.00 0.34 H new ATOM 0 HA ALA A 84 7.815 -5.895 2.972 1.00 0.31 H new ATOM 0 HB1 ALA A 84 5.811 -7.263 3.489 1.00 0.34 H new ATOM 0 HB2 ALA A 84 7.010 -8.209 2.574 1.00 0.34 H new ATOM 0 HB3 ALA A 84 6.837 -8.450 4.329 1.00 0.34 H new ATOM 455 N VAL A 85 7.740 -6.632 6.197 1.00 0.29 N ATOM 456 CA VAL A 85 7.474 -6.006 7.521 1.00 0.29 C ATOM 457 C VAL A 85 8.456 -4.861 7.747 1.00 0.29 C ATOM 458 O VAL A 85 8.080 -3.783 8.161 1.00 0.30 O ATOM 459 CB VAL A 85 7.636 -7.054 8.625 1.00 0.33 C ATOM 460 CG1 VAL A 85 6.967 -6.561 9.910 1.00 0.37 C ATOM 461 CG2 VAL A 85 6.978 -8.359 8.178 1.00 0.38 C ATOM 0 H VAL A 85 8.058 -7.601 6.228 1.00 0.29 H new ATOM 0 HA VAL A 85 6.456 -5.617 7.543 1.00 0.29 H new ATOM 0 HB VAL A 85 8.696 -7.221 8.814 1.00 0.33 H new ATOM 0 HG11 VAL A 85 7.085 -7.311 10.692 1.00 0.37 H new ATOM 0 HG12 VAL A 85 7.433 -5.628 10.228 1.00 0.37 H new ATOM 0 HG13 VAL A 85 5.906 -6.393 9.726 1.00 0.37 H new ATOM 0 HG21 VAL A 85 7.090 -9.110 8.960 1.00 0.38 H new ATOM 0 HG22 VAL A 85 5.918 -8.186 7.990 1.00 0.38 H new ATOM 0 HG23 VAL A 85 7.456 -8.713 7.264 1.00 0.38 H new ATOM 471 N ASP A 86 9.711 -5.076 7.468 1.00 0.30 N ATOM 472 CA ASP A 86 10.697 -3.983 7.662 1.00 0.32 C ATOM 473 C ASP A 86 10.300 -2.821 6.756 1.00 0.30 C ATOM 474 O ASP A 86 10.231 -1.684 7.178 1.00 0.31 O ATOM 475 CB ASP A 86 12.098 -4.476 7.292 1.00 0.36 C ATOM 476 CG ASP A 86 12.632 -5.378 8.405 1.00 0.42 C ATOM 477 OD1 ASP A 86 11.846 -5.769 9.252 1.00 1.05 O ATOM 478 OD2 ASP A 86 13.818 -5.663 8.392 1.00 1.23 O ATOM 0 H ASP A 86 10.092 -5.955 7.117 1.00 0.30 H new ATOM 0 HA ASP A 86 10.707 -3.663 8.704 1.00 0.32 H new ATOM 0 HB2 ASP A 86 12.065 -5.023 6.350 1.00 0.36 H new ATOM 0 HB3 ASP A 86 12.766 -3.628 7.145 1.00 0.36 H new ATOM 483 N LEU A 87 10.019 -3.105 5.516 1.00 0.29 N ATOM 484 CA LEU A 87 9.605 -2.023 4.585 1.00 0.30 C ATOM 485 C LEU A 87 8.310 -1.389 5.101 1.00 0.29 C ATOM 486 O LEU A 87 8.150 -0.185 5.079 1.00 0.30 O ATOM 487 CB LEU A 87 9.377 -2.601 3.181 1.00 0.33 C ATOM 488 CG LEU A 87 9.255 -1.457 2.152 1.00 0.42 C ATOM 489 CD1 LEU A 87 10.648 -0.979 1.713 1.00 0.52 C ATOM 490 CD2 LEU A 87 8.492 -1.951 0.916 1.00 0.44 C ATOM 0 H LEU A 87 10.058 -4.039 5.108 1.00 0.29 H new ATOM 0 HA LEU A 87 10.388 -1.267 4.531 1.00 0.30 H new ATOM 0 HB2 LEU A 87 10.204 -3.258 2.911 1.00 0.33 H new ATOM 0 HB3 LEU A 87 8.472 -3.208 3.171 1.00 0.33 H new ATOM 0 HG LEU A 87 8.719 -0.631 2.619 1.00 0.42 H new ATOM 0 HD11 LEU A 87 10.544 -0.172 0.987 1.00 0.52 H new ATOM 0 HD12 LEU A 87 11.199 -0.617 2.581 1.00 0.52 H new ATOM 0 HD13 LEU A 87 11.191 -1.808 1.259 1.00 0.52 H new ATOM 0 HD21 LEU A 87 8.408 -1.140 0.192 1.00 0.44 H new ATOM 0 HD22 LEU A 87 9.030 -2.785 0.466 1.00 0.44 H new ATOM 0 HD23 LEU A 87 7.495 -2.279 1.211 1.00 0.44 H new ATOM 502 N SER A 88 7.381 -2.185 5.573 1.00 0.30 N ATOM 503 CA SER A 88 6.112 -1.604 6.088 1.00 0.34 C ATOM 504 C SER A 88 6.434 -0.536 7.135 1.00 0.33 C ATOM 505 O SER A 88 5.892 0.551 7.114 1.00 0.36 O ATOM 506 CB SER A 88 5.267 -2.707 6.727 1.00 0.40 C ATOM 507 OG SER A 88 5.793 -3.017 8.009 1.00 0.44 O ATOM 0 H SER A 88 7.449 -3.202 5.622 1.00 0.30 H new ATOM 0 HA SER A 88 5.556 -1.154 5.265 1.00 0.34 H new ATOM 0 HB2 SER A 88 4.230 -2.382 6.815 1.00 0.40 H new ATOM 0 HB3 SER A 88 5.270 -3.595 6.095 1.00 0.40 H new ATOM 0 HG SER A 88 5.104 -3.460 8.547 1.00 0.44 H new ATOM 513 N HIS A 89 7.312 -0.840 8.051 1.00 0.34 N ATOM 514 CA HIS A 89 7.670 0.155 9.102 1.00 0.36 C ATOM 515 C HIS A 89 8.547 1.250 8.497 1.00 0.36 C ATOM 516 O HIS A 89 8.475 2.398 8.888 1.00 0.41 O ATOM 517 CB HIS A 89 8.427 -0.544 10.235 1.00 0.41 C ATOM 518 CG HIS A 89 7.523 -1.550 10.894 1.00 0.52 C ATOM 519 ND1 HIS A 89 6.642 -2.337 10.169 1.00 1.43 N ATOM 520 CD2 HIS A 89 7.350 -1.908 12.208 1.00 1.01 C ATOM 521 CE1 HIS A 89 5.986 -3.122 11.043 1.00 1.27 C ATOM 522 NE2 HIS A 89 6.379 -2.900 12.300 1.00 0.82 N ATOM 0 H HIS A 89 7.797 -1.735 8.117 1.00 0.34 H new ATOM 0 HA HIS A 89 6.759 0.603 9.499 1.00 0.36 H new ATOM 0 HB2 HIS A 89 9.315 -1.039 9.842 1.00 0.41 H new ATOM 0 HB3 HIS A 89 8.768 0.189 10.966 1.00 0.41 H new ATOM 0 HD1 HIS A 89 6.514 -2.324 9.157 1.00 1.43 H new ATOM 0 HD2 HIS A 89 7.887 -1.484 13.044 1.00 1.01 H new ATOM 0 HE1 HIS A 89 5.233 -3.844 10.762 1.00 1.27 H new ATOM 530 N PHE A 90 9.369 0.916 7.541 1.00 0.34 N ATOM 531 CA PHE A 90 10.231 1.957 6.922 1.00 0.37 C ATOM 532 C PHE A 90 9.333 3.053 6.349 1.00 0.40 C ATOM 533 O PHE A 90 9.479 4.219 6.658 1.00 0.47 O ATOM 534 CB PHE A 90 11.065 1.339 5.797 1.00 0.38 C ATOM 535 CG PHE A 90 12.107 2.333 5.341 1.00 0.47 C ATOM 536 CD1 PHE A 90 11.765 3.339 4.429 1.00 0.59 C ATOM 537 CD2 PHE A 90 13.416 2.250 5.831 1.00 0.57 C ATOM 538 CE1 PHE A 90 12.732 4.262 4.010 1.00 0.70 C ATOM 539 CE2 PHE A 90 14.382 3.172 5.413 1.00 0.69 C ATOM 540 CZ PHE A 90 14.040 4.178 4.500 1.00 0.72 C ATOM 0 H PHE A 90 9.480 -0.026 7.165 1.00 0.34 H new ATOM 0 HA PHE A 90 10.904 2.375 7.671 1.00 0.37 H new ATOM 0 HB2 PHE A 90 11.546 0.425 6.146 1.00 0.38 H new ATOM 0 HB3 PHE A 90 10.421 1.062 4.962 1.00 0.38 H new ATOM 0 HD1 PHE A 90 10.756 3.403 4.049 1.00 0.59 H new ATOM 0 HD2 PHE A 90 13.681 1.473 6.533 1.00 0.57 H new ATOM 0 HE1 PHE A 90 12.468 5.039 3.308 1.00 0.70 H new ATOM 0 HE2 PHE A 90 15.391 3.108 5.794 1.00 0.69 H new ATOM 0 HZ PHE A 90 14.786 4.888 4.174 1.00 0.72 H new ATOM 550 N LEU A 91 8.399 2.680 5.518 1.00 0.37 N ATOM 551 CA LEU A 91 7.483 3.691 4.925 1.00 0.42 C ATOM 552 C LEU A 91 6.684 4.385 6.032 1.00 0.47 C ATOM 553 O LEU A 91 6.366 5.550 5.928 1.00 0.57 O ATOM 554 CB LEU A 91 6.518 3.004 3.954 1.00 0.41 C ATOM 555 CG LEU A 91 7.267 2.588 2.674 1.00 0.41 C ATOM 556 CD1 LEU A 91 6.432 1.552 1.916 1.00 0.42 C ATOM 557 CD2 LEU A 91 7.507 3.810 1.765 1.00 0.54 C ATOM 0 H LEU A 91 8.232 1.718 5.225 1.00 0.37 H new ATOM 0 HA LEU A 91 8.073 4.434 4.388 1.00 0.42 H new ATOM 0 HB2 LEU A 91 6.075 2.128 4.427 1.00 0.41 H new ATOM 0 HB3 LEU A 91 5.699 3.679 3.703 1.00 0.41 H new ATOM 0 HG LEU A 91 8.231 2.163 2.953 1.00 0.41 H new ATOM 0 HD11 LEU A 91 6.958 1.254 1.009 1.00 0.42 H new ATOM 0 HD12 LEU A 91 6.275 0.678 2.548 1.00 0.42 H new ATOM 0 HD13 LEU A 91 5.468 1.985 1.651 1.00 0.42 H new ATOM 0 HD21 LEU A 91 8.037 3.496 0.866 1.00 0.54 H new ATOM 0 HD22 LEU A 91 6.549 4.250 1.487 1.00 0.54 H new ATOM 0 HD23 LEU A 91 8.104 4.549 2.299 1.00 0.54 H new ATOM 569 N LYS A 92 6.347 3.689 7.087 1.00 0.45 N ATOM 570 CA LYS A 92 5.561 4.341 8.174 1.00 0.53 C ATOM 571 C LYS A 92 6.373 5.485 8.786 1.00 0.63 C ATOM 572 O LYS A 92 5.847 6.535 9.098 1.00 0.85 O ATOM 573 CB LYS A 92 5.238 3.318 9.268 1.00 0.54 C ATOM 574 CG LYS A 92 4.180 3.899 10.220 1.00 0.73 C ATOM 575 CD LYS A 92 4.216 3.147 11.553 1.00 1.20 C ATOM 576 CE LYS A 92 3.127 3.687 12.485 1.00 1.61 C ATOM 577 NZ LYS A 92 1.837 3.789 11.743 1.00 2.27 N ATOM 0 H LYS A 92 6.579 2.708 7.241 1.00 0.45 H new ATOM 0 HA LYS A 92 4.635 4.732 7.753 1.00 0.53 H new ATOM 0 HB2 LYS A 92 4.871 2.395 8.820 1.00 0.54 H new ATOM 0 HB3 LYS A 92 6.142 3.066 9.823 1.00 0.54 H new ATOM 0 HG2 LYS A 92 4.369 4.960 10.385 1.00 0.73 H new ATOM 0 HG3 LYS A 92 3.190 3.817 9.772 1.00 0.73 H new ATOM 0 HD2 LYS A 92 4.066 2.081 11.383 1.00 1.20 H new ATOM 0 HD3 LYS A 92 5.195 3.261 12.019 1.00 1.20 H new ATOM 0 HE2 LYS A 92 3.012 3.028 13.346 1.00 1.61 H new ATOM 0 HE3 LYS A 92 3.415 4.666 12.869 1.00 1.61 H new ATOM 0 HZ1 LYS A 92 1.054 3.890 12.420 1.00 2.27 H new ATOM 0 HZ2 LYS A 92 1.862 4.618 11.116 1.00 2.27 H new ATOM 0 HZ3 LYS A 92 1.694 2.930 11.175 1.00 2.27 H new ATOM 591 N GLU A 93 7.647 5.288 8.968 1.00 0.62 N ATOM 592 CA GLU A 93 8.493 6.357 9.570 1.00 0.76 C ATOM 593 C GLU A 93 8.657 7.519 8.585 1.00 0.77 C ATOM 594 O GLU A 93 8.170 8.608 8.811 1.00 1.05 O ATOM 595 CB GLU A 93 9.868 5.781 9.910 1.00 0.94 C ATOM 596 CG GLU A 93 9.747 4.861 11.127 1.00 1.22 C ATOM 597 CD GLU A 93 9.574 5.703 12.391 1.00 2.00 C ATOM 598 OE1 GLU A 93 10.580 6.102 12.954 1.00 2.54 O ATOM 599 OE2 GLU A 93 8.440 5.936 12.774 1.00 2.73 O ATOM 0 H GLU A 93 8.142 4.430 8.725 1.00 0.62 H new ATOM 0 HA GLU A 93 8.011 6.726 10.476 1.00 0.76 H new ATOM 0 HB2 GLU A 93 10.263 5.226 9.059 1.00 0.94 H new ATOM 0 HB3 GLU A 93 10.571 6.588 10.118 1.00 0.94 H new ATOM 0 HG2 GLU A 93 8.896 4.190 11.005 1.00 1.22 H new ATOM 0 HG3 GLU A 93 10.636 4.236 11.213 1.00 1.22 H new ATOM 606 N LYS A 94 9.355 7.300 7.506 1.00 0.80 N ATOM 607 CA LYS A 94 9.567 8.399 6.520 1.00 1.02 C ATOM 608 C LYS A 94 8.304 8.615 5.677 1.00 0.96 C ATOM 609 O LYS A 94 7.789 9.712 5.590 1.00 1.41 O ATOM 610 CB LYS A 94 10.741 8.045 5.599 1.00 1.39 C ATOM 611 CG LYS A 94 12.061 8.239 6.348 1.00 1.63 C ATOM 612 CD LYS A 94 13.199 7.585 5.556 1.00 2.18 C ATOM 613 CE LYS A 94 13.378 8.307 4.216 1.00 2.61 C ATOM 614 NZ LYS A 94 14.711 7.967 3.642 1.00 2.96 N ATOM 0 H LYS A 94 9.788 6.409 7.263 1.00 0.80 H new ATOM 0 HA LYS A 94 9.789 9.317 7.063 1.00 1.02 H new ATOM 0 HB2 LYS A 94 10.652 7.013 5.261 1.00 1.39 H new ATOM 0 HB3 LYS A 94 10.721 8.675 4.709 1.00 1.39 H new ATOM 0 HG2 LYS A 94 12.262 9.302 6.483 1.00 1.63 H new ATOM 0 HG3 LYS A 94 11.995 7.798 7.343 1.00 1.63 H new ATOM 0 HD2 LYS A 94 14.125 7.627 6.129 1.00 2.18 H new ATOM 0 HD3 LYS A 94 12.978 6.531 5.386 1.00 2.18 H new ATOM 0 HE2 LYS A 94 12.587 8.015 3.525 1.00 2.61 H new ATOM 0 HE3 LYS A 94 13.295 9.385 4.358 1.00 2.61 H new ATOM 0 HZ1 LYS A 94 14.833 8.457 2.733 1.00 2.96 H new ATOM 0 HZ2 LYS A 94 15.459 8.267 4.300 1.00 2.96 H new ATOM 0 HZ3 LYS A 94 14.773 6.940 3.493 1.00 2.96 H new ATOM 628 N GLY A 95 7.815 7.587 5.038 1.00 1.12 N ATOM 629 CA GLY A 95 6.603 7.749 4.184 1.00 1.51 C ATOM 630 C GLY A 95 5.352 7.913 5.053 1.00 1.10 C ATOM 631 O GLY A 95 5.361 7.637 6.236 1.00 1.71 O ATOM 0 H GLY A 95 8.201 6.644 5.070 1.00 1.12 H new ATOM 0 HA2 GLY A 95 6.720 8.619 3.537 1.00 1.51 H new ATOM 0 HA3 GLY A 95 6.490 6.881 3.534 1.00 1.51 H new ATOM 635 N GLY A 96 4.269 8.359 4.462 1.00 1.17 N ATOM 636 CA GLY A 96 2.990 8.542 5.221 1.00 0.99 C ATOM 637 C GLY A 96 1.866 7.818 4.478 1.00 0.81 C ATOM 638 O GLY A 96 0.921 8.425 4.023 1.00 0.83 O ATOM 0 H GLY A 96 4.216 8.607 3.474 1.00 1.17 H new ATOM 0 HA2 GLY A 96 3.091 8.145 6.231 1.00 0.99 H new ATOM 0 HA3 GLY A 96 2.757 9.602 5.317 1.00 0.99 H new ATOM 642 N LEU A 97 1.968 6.525 4.338 1.00 0.67 N ATOM 643 CA LEU A 97 0.908 5.766 3.608 1.00 0.55 C ATOM 644 C LEU A 97 -0.275 5.500 4.542 1.00 0.46 C ATOM 645 O LEU A 97 -1.402 5.369 4.108 1.00 0.49 O ATOM 646 CB LEU A 97 1.487 4.433 3.121 1.00 0.54 C ATOM 647 CG LEU A 97 0.545 3.791 2.087 1.00 0.54 C ATOM 648 CD1 LEU A 97 0.688 4.482 0.719 1.00 0.65 C ATOM 649 CD2 LEU A 97 0.894 2.304 1.942 1.00 0.66 C ATOM 0 H LEU A 97 2.738 5.960 4.696 1.00 0.67 H new ATOM 0 HA LEU A 97 0.565 6.351 2.755 1.00 0.55 H new ATOM 0 HB2 LEU A 97 2.469 4.595 2.678 1.00 0.54 H new ATOM 0 HB3 LEU A 97 1.626 3.758 3.966 1.00 0.54 H new ATOM 0 HG LEU A 97 -0.483 3.905 2.430 1.00 0.54 H new ATOM 0 HD11 LEU A 97 0.014 4.013 0.002 1.00 0.65 H new ATOM 0 HD12 LEU A 97 0.437 5.538 0.817 1.00 0.65 H new ATOM 0 HD13 LEU A 97 1.715 4.385 0.368 1.00 0.65 H new ATOM 0 HD21 LEU A 97 0.230 1.844 1.211 1.00 0.66 H new ATOM 0 HD22 LEU A 97 1.927 2.204 1.608 1.00 0.66 H new ATOM 0 HD23 LEU A 97 0.774 1.807 2.904 1.00 0.66 H new ATOM 661 N GLU A 98 -0.030 5.410 5.818 1.00 0.44 N ATOM 662 CA GLU A 98 -1.143 5.146 6.773 1.00 0.40 C ATOM 663 C GLU A 98 -2.266 6.165 6.561 1.00 0.40 C ATOM 664 O GLU A 98 -2.035 7.334 6.330 1.00 0.58 O ATOM 665 CB GLU A 98 -0.610 5.237 8.211 1.00 0.49 C ATOM 666 CG GLU A 98 -1.770 5.361 9.219 1.00 0.48 C ATOM 667 CD GLU A 98 -2.203 6.828 9.347 1.00 1.26 C ATOM 668 OE1 GLU A 98 -1.336 7.685 9.337 1.00 2.03 O ATOM 669 OE2 GLU A 98 -3.395 7.065 9.452 1.00 1.94 O ATOM 0 H GLU A 98 0.892 5.508 6.242 1.00 0.44 H new ATOM 0 HA GLU A 98 -1.542 4.147 6.599 1.00 0.40 H new ATOM 0 HB2 GLU A 98 -0.016 4.352 8.440 1.00 0.49 H new ATOM 0 HB3 GLU A 98 0.052 6.098 8.304 1.00 0.49 H new ATOM 0 HG2 GLU A 98 -2.613 4.752 8.892 1.00 0.48 H new ATOM 0 HG3 GLU A 98 -1.459 4.979 10.192 1.00 0.48 H new ATOM 676 N GLY A 99 -3.482 5.713 6.663 1.00 0.39 N ATOM 677 CA GLY A 99 -4.657 6.619 6.501 1.00 0.42 C ATOM 678 C GLY A 99 -4.540 7.458 5.220 1.00 0.42 C ATOM 679 O GLY A 99 -5.355 8.324 4.967 1.00 0.46 O ATOM 0 H GLY A 99 -3.718 4.739 6.855 1.00 0.39 H new ATOM 0 HA2 GLY A 99 -5.573 6.029 6.470 1.00 0.42 H new ATOM 0 HA3 GLY A 99 -4.732 7.279 7.365 1.00 0.42 H new ATOM 683 N LEU A 100 -3.550 7.213 4.407 1.00 0.41 N ATOM 684 CA LEU A 100 -3.413 8.007 3.146 1.00 0.43 C ATOM 685 C LEU A 100 -4.464 7.495 2.144 1.00 0.42 C ATOM 686 O LEU A 100 -4.285 6.470 1.518 1.00 0.44 O ATOM 687 CB LEU A 100 -1.986 7.817 2.585 1.00 0.45 C ATOM 688 CG LEU A 100 -1.498 9.076 1.834 1.00 0.55 C ATOM 689 CD1 LEU A 100 -2.531 9.510 0.785 1.00 1.15 C ATOM 690 CD2 LEU A 100 -1.238 10.235 2.823 1.00 1.17 C ATOM 0 H LEU A 100 -2.833 6.503 4.556 1.00 0.41 H new ATOM 0 HA LEU A 100 -3.574 9.069 3.330 1.00 0.43 H new ATOM 0 HB2 LEU A 100 -1.300 7.591 3.402 1.00 0.45 H new ATOM 0 HB3 LEU A 100 -1.971 6.961 1.910 1.00 0.45 H new ATOM 0 HG LEU A 100 -0.564 8.828 1.330 1.00 0.55 H new ATOM 0 HD11 LEU A 100 -2.171 10.398 0.266 1.00 1.15 H new ATOM 0 HD12 LEU A 100 -2.680 8.704 0.066 1.00 1.15 H new ATOM 0 HD13 LEU A 100 -3.477 9.736 1.277 1.00 1.15 H new ATOM 0 HD21 LEU A 100 -0.895 11.112 2.274 1.00 1.17 H new ATOM 0 HD22 LEU A 100 -2.160 10.476 3.352 1.00 1.17 H new ATOM 0 HD23 LEU A 100 -0.475 9.936 3.542 1.00 1.17 H new ATOM 702 N ILE A 101 -5.574 8.181 2.018 1.00 0.44 N ATOM 703 CA ILE A 101 -6.645 7.708 1.090 1.00 0.45 C ATOM 704 C ILE A 101 -6.095 7.481 -0.322 1.00 0.46 C ATOM 705 O ILE A 101 -5.729 8.400 -1.028 1.00 0.49 O ATOM 706 CB ILE A 101 -7.805 8.722 1.085 1.00 0.50 C ATOM 707 CG1 ILE A 101 -8.627 8.570 2.391 1.00 0.51 C ATOM 708 CG2 ILE A 101 -8.711 8.503 -0.138 1.00 0.54 C ATOM 709 CD1 ILE A 101 -9.654 7.420 2.288 1.00 0.52 C ATOM 0 H ILE A 101 -5.783 9.046 2.517 1.00 0.44 H new ATOM 0 HA ILE A 101 -7.020 6.747 1.443 1.00 0.45 H new ATOM 0 HB ILE A 101 -7.394 9.730 1.029 1.00 0.50 H new ATOM 0 HG12 ILE A 101 -7.952 8.382 3.226 1.00 0.51 H new ATOM 0 HG13 ILE A 101 -9.146 9.504 2.605 1.00 0.51 H new ATOM 0 HG21 ILE A 101 -9.524 9.229 -0.123 1.00 0.54 H new ATOM 0 HG22 ILE A 101 -8.128 8.630 -1.050 1.00 0.54 H new ATOM 0 HG23 ILE A 101 -9.124 7.495 -0.109 1.00 0.54 H new ATOM 0 HD11 ILE A 101 -10.211 7.345 3.222 1.00 0.52 H new ATOM 0 HD12 ILE A 101 -10.345 7.621 1.469 1.00 0.52 H new ATOM 0 HD13 ILE A 101 -9.132 6.482 2.100 1.00 0.52 H new ATOM 721 N HIS A 102 -6.057 6.235 -0.726 1.00 0.47 N ATOM 722 CA HIS A 102 -5.562 5.875 -2.085 1.00 0.51 C ATOM 723 C HIS A 102 -6.531 6.430 -3.135 1.00 0.58 C ATOM 724 O HIS A 102 -7.609 5.906 -3.338 1.00 0.64 O ATOM 725 CB HIS A 102 -5.475 4.336 -2.182 1.00 0.57 C ATOM 726 CG HIS A 102 -5.536 3.871 -3.617 1.00 0.64 C ATOM 727 ND1 HIS A 102 -6.727 3.810 -4.327 1.00 1.41 N ATOM 728 CD2 HIS A 102 -4.566 3.424 -4.477 1.00 0.64 C ATOM 729 CE1 HIS A 102 -6.441 3.342 -5.556 1.00 1.36 C ATOM 730 NE2 HIS A 102 -5.138 3.090 -5.701 1.00 0.70 N ATOM 0 H HIS A 102 -6.354 5.441 -0.159 1.00 0.47 H new ATOM 0 HA HIS A 102 -4.575 6.302 -2.263 1.00 0.51 H new ATOM 0 HB2 HIS A 102 -4.546 3.993 -1.726 1.00 0.57 H new ATOM 0 HB3 HIS A 102 -6.292 3.887 -1.617 1.00 0.57 H new ATOM 0 HD1 HIS A 102 -7.650 4.072 -3.981 1.00 1.41 H new ATOM 0 HD2 HIS A 102 -3.515 3.343 -4.240 1.00 0.64 H new ATOM 0 HE1 HIS A 102 -7.177 3.189 -6.331 1.00 1.36 H new ATOM 738 N SER A 103 -6.147 7.481 -3.806 1.00 0.60 N ATOM 739 CA SER A 103 -7.035 8.064 -4.848 1.00 0.69 C ATOM 740 C SER A 103 -7.150 7.079 -6.013 1.00 0.76 C ATOM 741 O SER A 103 -8.178 6.467 -6.226 1.00 0.85 O ATOM 742 CB SER A 103 -6.434 9.379 -5.347 1.00 0.74 C ATOM 743 OG SER A 103 -6.959 9.675 -6.634 1.00 1.49 O ATOM 0 H SER A 103 -5.256 7.961 -3.677 1.00 0.60 H new ATOM 0 HA SER A 103 -8.023 8.254 -4.429 1.00 0.69 H new ATOM 0 HB2 SER A 103 -6.667 10.186 -4.652 1.00 0.74 H new ATOM 0 HB3 SER A 103 -5.348 9.302 -5.393 1.00 0.74 H new ATOM 0 HG SER A 103 -6.578 10.518 -6.957 1.00 1.49 H new ATOM 749 N GLN A 104 -6.096 6.921 -6.765 1.00 0.81 N ATOM 750 CA GLN A 104 -6.129 5.977 -7.917 1.00 0.92 C ATOM 751 C GLN A 104 -4.705 5.762 -8.434 1.00 0.93 C ATOM 752 O GLN A 104 -4.209 4.654 -8.481 1.00 1.37 O ATOM 753 CB GLN A 104 -6.994 6.559 -9.036 1.00 1.06 C ATOM 754 CG GLN A 104 -7.036 5.579 -10.210 1.00 1.76 C ATOM 755 CD GLN A 104 -8.065 6.052 -11.240 1.00 2.14 C ATOM 756 OE1 GLN A 104 -9.067 6.645 -10.890 1.00 2.64 O ATOM 757 NE2 GLN A 104 -7.857 5.813 -12.506 1.00 2.70 N ATOM 0 H GLN A 104 -5.210 7.407 -6.630 1.00 0.81 H new ATOM 0 HA GLN A 104 -6.551 5.025 -7.594 1.00 0.92 H new ATOM 0 HB2 GLN A 104 -8.003 6.748 -8.670 1.00 1.06 H new ATOM 0 HB3 GLN A 104 -6.589 7.517 -9.362 1.00 1.06 H new ATOM 0 HG2 GLN A 104 -6.051 5.507 -10.672 1.00 1.76 H new ATOM 0 HG3 GLN A 104 -7.295 4.582 -9.855 1.00 1.76 H new ATOM 0 HE21 GLN A 104 -7.016 5.316 -12.800 1.00 2.70 H new ATOM 0 HE22 GLN A 104 -8.535 6.124 -13.202 1.00 2.70 H new ATOM 766 N ARG A 105 -4.044 6.818 -8.820 1.00 0.83 N ATOM 767 CA ARG A 105 -2.651 6.683 -9.333 1.00 0.87 C ATOM 768 C ARG A 105 -1.683 6.566 -8.152 1.00 0.74 C ATOM 769 O ARG A 105 -0.558 6.133 -8.300 1.00 0.70 O ATOM 770 CB ARG A 105 -2.299 7.916 -10.173 1.00 1.06 C ATOM 771 CG ARG A 105 -2.868 9.168 -9.504 1.00 1.71 C ATOM 772 CD ARG A 105 -2.266 10.417 -10.151 1.00 1.99 C ATOM 773 NE ARG A 105 -2.989 11.622 -9.657 1.00 2.86 N ATOM 774 CZ ARG A 105 -2.488 12.810 -9.849 1.00 3.60 C ATOM 775 NH1 ARG A 105 -1.366 12.947 -10.500 1.00 3.73 N ATOM 776 NH2 ARG A 105 -3.113 13.863 -9.397 1.00 4.61 N ATOM 0 H ARG A 105 -4.409 7.770 -8.802 1.00 0.83 H new ATOM 0 HA ARG A 105 -2.571 5.790 -9.952 1.00 0.87 H new ATOM 0 HB2 ARG A 105 -1.217 8.004 -10.273 1.00 1.06 H new ATOM 0 HB3 ARG A 105 -2.705 7.812 -11.179 1.00 1.06 H new ATOM 0 HG2 ARG A 105 -3.953 9.183 -9.602 1.00 1.71 H new ATOM 0 HG3 ARG A 105 -2.644 9.156 -8.437 1.00 1.71 H new ATOM 0 HD2 ARG A 105 -1.205 10.490 -9.910 1.00 1.99 H new ATOM 0 HD3 ARG A 105 -2.343 10.352 -11.236 1.00 1.99 H new ATOM 0 HE ARG A 105 -3.878 11.517 -9.168 1.00 2.86 H new ATOM 0 HH11 ARG A 105 -0.881 12.125 -10.859 1.00 3.73 H new ATOM 0 HH12 ARG A 105 -0.974 13.877 -10.650 1.00 3.73 H new ATOM 0 HH21 ARG A 105 -3.994 13.756 -8.893 1.00 4.61 H new ATOM 0 HH22 ARG A 105 -2.721 14.792 -9.547 1.00 4.61 H new ATOM 790 N ARG A 106 -2.110 6.952 -6.979 1.00 0.71 N ATOM 791 CA ARG A 106 -1.209 6.866 -5.794 1.00 0.65 C ATOM 792 C ARG A 106 -0.666 5.441 -5.665 1.00 0.54 C ATOM 793 O ARG A 106 0.399 5.221 -5.122 1.00 0.50 O ATOM 794 CB ARG A 106 -1.992 7.234 -4.527 1.00 0.70 C ATOM 795 CG ARG A 106 -2.154 8.758 -4.445 1.00 1.01 C ATOM 796 CD ARG A 106 -2.946 9.141 -3.181 1.00 1.24 C ATOM 797 NE ARG A 106 -3.830 10.313 -3.479 1.00 1.86 N ATOM 798 CZ ARG A 106 -3.363 11.378 -4.074 1.00 2.48 C ATOM 799 NH1 ARG A 106 -2.079 11.521 -4.263 1.00 2.86 N ATOM 800 NH2 ARG A 106 -4.180 12.330 -4.434 1.00 3.29 N ATOM 0 H ARG A 106 -3.042 7.322 -6.791 1.00 0.71 H new ATOM 0 HA ARG A 106 -0.378 7.559 -5.920 1.00 0.65 H new ATOM 0 HB2 ARG A 106 -2.971 6.755 -4.540 1.00 0.70 H new ATOM 0 HB3 ARG A 106 -1.469 6.866 -3.644 1.00 0.70 H new ATOM 0 HG2 ARG A 106 -1.174 9.235 -4.427 1.00 1.01 H new ATOM 0 HG3 ARG A 106 -2.671 9.124 -5.332 1.00 1.01 H new ATOM 0 HD2 ARG A 106 -3.547 8.295 -2.846 1.00 1.24 H new ATOM 0 HD3 ARG A 106 -2.260 9.387 -2.370 1.00 1.24 H new ATOM 0 HE ARG A 106 -4.814 10.279 -3.213 1.00 1.86 H new ATOM 0 HH11 ARG A 106 -1.433 10.798 -3.945 1.00 2.86 H new ATOM 0 HH12 ARG A 106 -1.722 12.355 -4.728 1.00 2.86 H new ATOM 0 HH21 ARG A 106 -5.179 12.241 -4.250 1.00 3.29 H new ATOM 0 HH22 ARG A 106 -3.819 13.163 -4.899 1.00 3.29 H new ATOM 814 N GLN A 107 -1.382 4.472 -6.164 1.00 0.55 N ATOM 815 CA GLN A 107 -0.897 3.065 -6.070 1.00 0.52 C ATOM 816 C GLN A 107 0.418 2.935 -6.841 1.00 0.49 C ATOM 817 O GLN A 107 1.400 2.431 -6.335 1.00 0.44 O ATOM 818 CB GLN A 107 -1.932 2.124 -6.689 1.00 0.63 C ATOM 819 CG GLN A 107 -1.498 0.674 -6.463 1.00 1.11 C ATOM 820 CD GLN A 107 -2.551 -0.269 -7.048 1.00 1.53 C ATOM 821 OE1 GLN A 107 -2.693 -0.370 -8.250 1.00 2.13 O ATOM 822 NE2 GLN A 107 -3.300 -0.968 -6.240 1.00 2.12 N ATOM 0 H GLN A 107 -2.280 4.592 -6.632 1.00 0.55 H new ATOM 0 HA GLN A 107 -0.744 2.803 -5.023 1.00 0.52 H new ATOM 0 HB2 GLN A 107 -2.911 2.297 -6.241 1.00 0.63 H new ATOM 0 HB3 GLN A 107 -2.030 2.324 -7.756 1.00 0.63 H new ATOM 0 HG2 GLN A 107 -0.532 0.495 -6.934 1.00 1.11 H new ATOM 0 HG3 GLN A 107 -1.374 0.482 -5.397 1.00 1.11 H new ATOM 0 HE21 GLN A 107 -3.180 -0.882 -5.231 1.00 2.12 H new ATOM 0 HE22 GLN A 107 -4.006 -1.600 -6.618 1.00 2.12 H new ATOM 831 N ASP A 108 0.444 3.385 -8.066 1.00 0.56 N ATOM 832 CA ASP A 108 1.692 3.286 -8.874 1.00 0.59 C ATOM 833 C ASP A 108 2.830 4.021 -8.163 1.00 0.54 C ATOM 834 O ASP A 108 3.895 3.473 -7.956 1.00 0.54 O ATOM 835 CB ASP A 108 1.463 3.912 -10.249 1.00 0.72 C ATOM 836 CG ASP A 108 0.298 3.203 -10.943 1.00 0.81 C ATOM 837 OD1 ASP A 108 -0.090 2.146 -10.475 1.00 1.33 O ATOM 838 OD2 ASP A 108 -0.187 3.730 -11.931 1.00 1.42 O ATOM 0 H ASP A 108 -0.347 3.818 -8.543 1.00 0.56 H new ATOM 0 HA ASP A 108 1.959 2.236 -8.992 1.00 0.59 H new ATOM 0 HB2 ASP A 108 1.246 4.975 -10.145 1.00 0.72 H new ATOM 0 HB3 ASP A 108 2.366 3.829 -10.854 1.00 0.72 H new ATOM 843 N ILE A 109 2.619 5.259 -7.791 1.00 0.55 N ATOM 844 CA ILE A 109 3.695 6.031 -7.095 1.00 0.54 C ATOM 845 C ILE A 109 4.353 5.151 -6.025 1.00 0.47 C ATOM 846 O ILE A 109 5.560 5.033 -5.959 1.00 0.53 O ATOM 847 CB ILE A 109 3.091 7.268 -6.422 1.00 0.59 C ATOM 848 CG1 ILE A 109 2.164 8.002 -7.401 1.00 0.70 C ATOM 849 CG2 ILE A 109 4.213 8.209 -5.979 1.00 0.63 C ATOM 850 CD1 ILE A 109 2.888 8.253 -8.727 1.00 1.47 C ATOM 0 H ILE A 109 1.748 5.769 -7.939 1.00 0.55 H new ATOM 0 HA ILE A 109 4.441 6.339 -7.827 1.00 0.54 H new ATOM 0 HB ILE A 109 2.513 6.953 -5.553 1.00 0.59 H new ATOM 0 HG12 ILE A 109 1.265 7.410 -7.575 1.00 0.70 H new ATOM 0 HG13 ILE A 109 1.843 8.950 -6.968 1.00 0.70 H new ATOM 0 HG21 ILE A 109 3.782 9.089 -5.500 1.00 0.63 H new ATOM 0 HG22 ILE A 109 4.863 7.693 -5.272 1.00 0.63 H new ATOM 0 HG23 ILE A 109 4.794 8.517 -6.848 1.00 0.63 H new ATOM 0 HD11 ILE A 109 2.220 8.774 -9.413 1.00 1.47 H new ATOM 0 HD12 ILE A 109 3.773 8.863 -8.548 1.00 1.47 H new ATOM 0 HD13 ILE A 109 3.186 7.300 -9.165 1.00 1.47 H new ATOM 862 N LEU A 110 3.564 4.531 -5.189 1.00 0.43 N ATOM 863 CA LEU A 110 4.139 3.659 -4.127 1.00 0.39 C ATOM 864 C LEU A 110 5.126 2.673 -4.760 1.00 0.38 C ATOM 865 O LEU A 110 6.324 2.779 -4.584 1.00 0.38 O ATOM 866 CB LEU A 110 3.004 2.889 -3.437 1.00 0.42 C ATOM 867 CG LEU A 110 3.555 1.992 -2.315 1.00 0.44 C ATOM 868 CD1 LEU A 110 4.170 2.852 -1.198 1.00 0.56 C ATOM 869 CD2 LEU A 110 2.405 1.154 -1.743 1.00 0.66 C ATOM 0 H LEU A 110 2.546 4.591 -5.196 1.00 0.43 H new ATOM 0 HA LEU A 110 4.663 4.268 -3.390 1.00 0.39 H new ATOM 0 HB2 LEU A 110 2.280 3.592 -3.024 1.00 0.42 H new ATOM 0 HB3 LEU A 110 2.475 2.279 -4.169 1.00 0.42 H new ATOM 0 HG LEU A 110 4.329 1.340 -2.720 1.00 0.44 H new ATOM 0 HD11 LEU A 110 4.556 2.204 -0.411 1.00 0.56 H new ATOM 0 HD12 LEU A 110 4.984 3.451 -1.606 1.00 0.56 H new ATOM 0 HD13 LEU A 110 3.407 3.511 -0.784 1.00 0.56 H new ATOM 0 HD21 LEU A 110 2.783 0.513 -0.946 1.00 0.66 H new ATOM 0 HD22 LEU A 110 1.637 1.816 -1.343 1.00 0.66 H new ATOM 0 HD23 LEU A 110 1.977 0.537 -2.533 1.00 0.66 H new ATOM 881 N ASP A 111 4.632 1.715 -5.494 1.00 0.40 N ATOM 882 CA ASP A 111 5.543 0.724 -6.135 1.00 0.42 C ATOM 883 C ASP A 111 6.648 1.462 -6.887 1.00 0.43 C ATOM 884 O ASP A 111 7.764 0.994 -6.988 1.00 0.42 O ATOM 885 CB ASP A 111 4.748 -0.146 -7.111 1.00 0.50 C ATOM 886 CG ASP A 111 3.699 -0.950 -6.340 1.00 0.59 C ATOM 887 OD1 ASP A 111 4.041 -1.483 -5.298 1.00 1.30 O ATOM 888 OD2 ASP A 111 2.573 -1.017 -6.804 1.00 1.19 O ATOM 0 H ASP A 111 3.639 1.575 -5.678 1.00 0.40 H new ATOM 0 HA ASP A 111 5.988 0.090 -5.368 1.00 0.42 H new ATOM 0 HB2 ASP A 111 4.263 0.480 -7.861 1.00 0.50 H new ATOM 0 HB3 ASP A 111 5.419 -0.820 -7.644 1.00 0.50 H new ATOM 893 N LEU A 112 6.348 2.616 -7.413 1.00 0.48 N ATOM 894 CA LEU A 112 7.381 3.388 -8.157 1.00 0.52 C ATOM 895 C LEU A 112 8.486 3.823 -7.189 1.00 0.48 C ATOM 896 O LEU A 112 9.644 3.502 -7.371 1.00 0.47 O ATOM 897 CB LEU A 112 6.722 4.620 -8.799 1.00 0.60 C ATOM 898 CG LEU A 112 7.540 5.097 -10.003 1.00 0.70 C ATOM 899 CD1 LEU A 112 6.848 6.306 -10.639 1.00 1.45 C ATOM 900 CD2 LEU A 112 8.951 5.493 -9.547 1.00 1.26 C ATOM 0 H LEU A 112 5.431 3.059 -7.360 1.00 0.48 H new ATOM 0 HA LEU A 112 7.820 2.768 -8.938 1.00 0.52 H new ATOM 0 HB2 LEU A 112 5.708 4.375 -9.115 1.00 0.60 H new ATOM 0 HB3 LEU A 112 6.642 5.422 -8.065 1.00 0.60 H new ATOM 0 HG LEU A 112 7.613 4.292 -10.734 1.00 0.70 H new ATOM 0 HD11 LEU A 112 7.428 6.648 -11.496 1.00 1.45 H new ATOM 0 HD12 LEU A 112 5.848 6.022 -10.967 1.00 1.45 H new ATOM 0 HD13 LEU A 112 6.775 7.110 -9.907 1.00 1.45 H new ATOM 0 HD21 LEU A 112 9.529 5.832 -10.407 1.00 1.26 H new ATOM 0 HD22 LEU A 112 8.884 6.298 -8.815 1.00 1.26 H new ATOM 0 HD23 LEU A 112 9.443 4.631 -9.095 1.00 1.26 H new ATOM 912 N TRP A 113 8.144 4.549 -6.158 1.00 0.48 N ATOM 913 CA TRP A 113 9.187 4.992 -5.193 1.00 0.48 C ATOM 914 C TRP A 113 10.007 3.775 -4.753 1.00 0.43 C ATOM 915 O TRP A 113 11.220 3.817 -4.717 1.00 0.45 O ATOM 916 CB TRP A 113 8.524 5.645 -3.975 1.00 0.52 C ATOM 917 CG TRP A 113 9.568 5.974 -2.952 1.00 0.56 C ATOM 918 CD1 TRP A 113 10.293 7.119 -2.911 1.00 0.66 C ATOM 919 CD2 TRP A 113 10.011 5.171 -1.821 1.00 0.55 C ATOM 920 NE1 TRP A 113 11.157 7.061 -1.833 1.00 0.70 N ATOM 921 CE2 TRP A 113 11.021 5.880 -1.130 1.00 0.65 C ATOM 922 CE3 TRP A 113 9.640 3.906 -1.337 1.00 0.51 C ATOM 923 CZ2 TRP A 113 11.640 5.351 0.004 1.00 0.70 C ATOM 924 CZ3 TRP A 113 10.259 3.369 -0.196 1.00 0.58 C ATOM 925 CH2 TRP A 113 11.258 4.090 0.472 1.00 0.67 C ATOM 0 H TRP A 113 7.194 4.852 -5.945 1.00 0.48 H new ATOM 0 HA TRP A 113 9.842 5.722 -5.668 1.00 0.48 H new ATOM 0 HB2 TRP A 113 7.997 6.551 -4.277 1.00 0.52 H new ATOM 0 HB3 TRP A 113 7.781 4.972 -3.548 1.00 0.52 H new ATOM 0 HD1 TRP A 113 10.209 7.941 -3.606 1.00 0.66 H new ATOM 0 HE1 TRP A 113 11.815 7.801 -1.587 1.00 0.70 H new ATOM 0 HE3 TRP A 113 8.873 3.342 -1.846 1.00 0.51 H new ATOM 0 HZ2 TRP A 113 12.408 5.912 0.516 1.00 0.70 H new ATOM 0 HZ3 TRP A 113 9.964 2.396 0.168 1.00 0.58 H new ATOM 0 HH2 TRP A 113 11.732 3.672 1.348 1.00 0.67 H new ATOM 936 N ILE A 114 9.358 2.687 -4.428 1.00 0.39 N ATOM 937 CA ILE A 114 10.116 1.472 -4.005 1.00 0.37 C ATOM 938 C ILE A 114 11.039 1.030 -5.145 1.00 0.39 C ATOM 939 O ILE A 114 12.157 0.614 -4.921 1.00 0.44 O ATOM 940 CB ILE A 114 9.145 0.332 -3.656 1.00 0.37 C ATOM 941 CG1 ILE A 114 8.150 0.812 -2.590 1.00 0.37 C ATOM 942 CG2 ILE A 114 9.933 -0.864 -3.103 1.00 0.42 C ATOM 943 CD1 ILE A 114 7.112 -0.281 -2.308 1.00 1.00 C ATOM 0 H ILE A 114 8.343 2.587 -4.437 1.00 0.39 H new ATOM 0 HA ILE A 114 10.708 1.711 -3.122 1.00 0.37 H new ATOM 0 HB ILE A 114 8.606 0.033 -4.555 1.00 0.37 H new ATOM 0 HG12 ILE A 114 8.682 1.065 -1.673 1.00 0.37 H new ATOM 0 HG13 ILE A 114 7.651 1.720 -2.930 1.00 0.37 H new ATOM 0 HG21 ILE A 114 9.243 -1.671 -2.856 1.00 0.42 H new ATOM 0 HG22 ILE A 114 10.643 -1.210 -3.854 1.00 0.42 H new ATOM 0 HG23 ILE A 114 10.473 -0.561 -2.206 1.00 0.42 H new ATOM 0 HD11 ILE A 114 6.411 0.070 -1.550 1.00 1.00 H new ATOM 0 HD12 ILE A 114 6.570 -0.513 -3.225 1.00 1.00 H new ATOM 0 HD13 ILE A 114 7.616 -1.178 -1.948 1.00 1.00 H new ATOM 955 N TYR A 115 10.584 1.102 -6.366 1.00 0.40 N ATOM 956 CA TYR A 115 11.453 0.671 -7.498 1.00 0.46 C ATOM 957 C TYR A 115 12.661 1.613 -7.615 1.00 0.51 C ATOM 958 O TYR A 115 13.799 1.184 -7.597 1.00 0.54 O ATOM 959 CB TYR A 115 10.639 0.683 -8.801 1.00 0.53 C ATOM 960 CG TYR A 115 11.292 -0.219 -9.825 1.00 0.59 C ATOM 961 CD1 TYR A 115 11.119 -1.610 -9.753 1.00 0.56 C ATOM 962 CD2 TYR A 115 12.073 0.334 -10.848 1.00 0.74 C ATOM 963 CE1 TYR A 115 11.726 -2.441 -10.703 1.00 0.65 C ATOM 964 CE2 TYR A 115 12.680 -0.499 -11.796 1.00 0.82 C ATOM 965 CZ TYR A 115 12.506 -1.887 -11.724 1.00 0.77 C ATOM 966 OH TYR A 115 13.104 -2.707 -12.657 1.00 0.87 O ATOM 0 H TYR A 115 9.657 1.437 -6.628 1.00 0.40 H new ATOM 0 HA TYR A 115 11.816 -0.340 -7.315 1.00 0.46 H new ATOM 0 HB2 TYR A 115 9.620 0.349 -8.606 1.00 0.53 H new ATOM 0 HB3 TYR A 115 10.572 1.699 -9.189 1.00 0.53 H new ATOM 0 HD1 TYR A 115 10.518 -2.039 -8.965 1.00 0.56 H new ATOM 0 HD2 TYR A 115 12.207 1.404 -10.906 1.00 0.74 H new ATOM 0 HE1 TYR A 115 11.592 -3.511 -10.647 1.00 0.65 H new ATOM 0 HE2 TYR A 115 13.283 -0.071 -12.583 1.00 0.82 H new ATOM 0 HH TYR A 115 13.608 -2.162 -13.296 1.00 0.87 H new ATOM 976 N HIS A 116 12.421 2.890 -7.738 1.00 0.58 N ATOM 977 CA HIS A 116 13.548 3.868 -7.862 1.00 0.67 C ATOM 978 C HIS A 116 14.404 3.876 -6.582 1.00 0.67 C ATOM 979 O HIS A 116 15.196 4.774 -6.381 1.00 0.81 O ATOM 980 CB HIS A 116 12.971 5.276 -8.095 1.00 0.79 C ATOM 981 CG HIS A 116 12.667 5.480 -9.557 1.00 1.20 C ATOM 982 ND1 HIS A 116 12.688 4.440 -10.475 1.00 1.99 N ATOM 983 CD2 HIS A 116 12.340 6.605 -10.272 1.00 2.05 C ATOM 984 CE1 HIS A 116 12.382 4.958 -11.679 1.00 2.71 C ATOM 985 NE2 HIS A 116 12.161 6.274 -11.611 1.00 2.74 N ATOM 0 H HIS A 116 11.489 3.303 -7.758 1.00 0.58 H new ATOM 0 HA HIS A 116 14.178 3.574 -8.702 1.00 0.67 H new ATOM 0 HB2 HIS A 116 12.063 5.407 -7.506 1.00 0.79 H new ATOM 0 HB3 HIS A 116 13.682 6.029 -7.756 1.00 0.79 H new ATOM 0 HD2 HIS A 116 12.237 7.597 -9.858 1.00 2.05 H new ATOM 0 HE1 HIS A 116 12.322 4.380 -12.589 1.00 2.71 H new ATOM 0 HE2 HIS A 116 11.914 6.901 -12.377 1.00 2.74 H new ATOM 993 N THR A 117 14.255 2.897 -5.717 1.00 0.63 N ATOM 994 CA THR A 117 15.072 2.864 -4.454 1.00 0.68 C ATOM 995 C THR A 117 15.809 1.530 -4.354 1.00 0.66 C ATOM 996 O THR A 117 16.914 1.380 -4.837 1.00 0.73 O ATOM 997 CB THR A 117 14.157 3.018 -3.240 1.00 0.80 C ATOM 998 OG1 THR A 117 13.037 2.158 -3.380 1.00 0.85 O ATOM 999 CG2 THR A 117 13.683 4.468 -3.134 1.00 0.91 C ATOM 0 H THR A 117 13.604 2.120 -5.829 1.00 0.63 H new ATOM 0 HA THR A 117 15.791 3.683 -4.476 1.00 0.68 H new ATOM 0 HB THR A 117 14.706 2.753 -2.336 1.00 0.80 H new ATOM 0 HG1 THR A 117 13.127 1.635 -4.204 1.00 0.85 H new ATOM 0 HG21 THR A 117 13.031 4.575 -2.267 1.00 0.91 H new ATOM 0 HG22 THR A 117 14.545 5.125 -3.023 1.00 0.91 H new ATOM 0 HG23 THR A 117 13.135 4.738 -4.036 1.00 0.91 H new ATOM 1007 N GLN A 118 15.208 0.560 -3.722 1.00 0.73 N ATOM 1008 CA GLN A 118 15.879 -0.760 -3.582 1.00 0.83 C ATOM 1009 C GLN A 118 15.735 -1.528 -4.900 1.00 0.72 C ATOM 1010 O GLN A 118 16.444 -2.475 -5.167 1.00 0.91 O ATOM 1011 CB GLN A 118 15.212 -1.535 -2.433 1.00 1.06 C ATOM 1012 CG GLN A 118 16.156 -2.619 -1.899 1.00 1.48 C ATOM 1013 CD GLN A 118 16.316 -3.715 -2.951 1.00 2.12 C ATOM 1014 OE1 GLN A 118 17.422 -4.101 -3.272 1.00 2.89 O ATOM 1015 NE2 GLN A 118 15.253 -4.219 -3.525 1.00 2.13 N ATOM 0 H GLN A 118 14.283 0.625 -3.298 1.00 0.73 H new ATOM 0 HA GLN A 118 16.938 -0.633 -3.358 1.00 0.83 H new ATOM 0 HB2 GLN A 118 14.945 -0.848 -1.630 1.00 1.06 H new ATOM 0 HB3 GLN A 118 14.286 -1.991 -2.783 1.00 1.06 H new ATOM 0 HG2 GLN A 118 17.127 -2.185 -1.659 1.00 1.48 H new ATOM 0 HG3 GLN A 118 15.758 -3.041 -0.976 1.00 1.48 H new ATOM 0 HE21 GLN A 118 14.325 -3.894 -3.254 1.00 2.13 H new ATOM 0 HE22 GLN A 118 15.353 -4.937 -4.243 1.00 2.13 H new ATOM 1024 N GLY A 119 14.838 -1.104 -5.743 1.00 0.86 N ATOM 1025 CA GLY A 119 14.667 -1.792 -7.051 1.00 0.85 C ATOM 1026 C GLY A 119 13.973 -3.139 -6.851 1.00 0.65 C ATOM 1027 O GLY A 119 14.254 -4.097 -7.543 1.00 0.67 O ATOM 0 H GLY A 119 14.216 -0.311 -5.583 1.00 0.86 H new ATOM 0 HA2 GLY A 119 14.079 -1.168 -7.724 1.00 0.85 H new ATOM 0 HA3 GLY A 119 15.639 -1.941 -7.522 1.00 0.85 H new ATOM 1031 N TYR A 120 13.058 -3.224 -5.923 1.00 0.54 N ATOM 1032 CA TYR A 120 12.348 -4.515 -5.711 1.00 0.44 C ATOM 1033 C TYR A 120 11.383 -4.726 -6.882 1.00 0.49 C ATOM 1034 O TYR A 120 10.732 -3.807 -7.334 1.00 0.70 O ATOM 1035 CB TYR A 120 11.549 -4.460 -4.398 1.00 0.48 C ATOM 1036 CG TYR A 120 12.423 -4.820 -3.213 1.00 0.52 C ATOM 1037 CD1 TYR A 120 13.005 -6.094 -3.130 1.00 0.58 C ATOM 1038 CD2 TYR A 120 12.633 -3.889 -2.187 1.00 0.60 C ATOM 1039 CE1 TYR A 120 13.798 -6.430 -2.027 1.00 0.71 C ATOM 1040 CE2 TYR A 120 13.423 -4.227 -1.084 1.00 0.71 C ATOM 1041 CZ TYR A 120 14.007 -5.497 -1.004 1.00 0.75 C ATOM 1042 OH TYR A 120 14.784 -5.831 0.085 1.00 0.91 O ATOM 0 H TYR A 120 12.774 -2.461 -5.308 1.00 0.54 H new ATOM 0 HA TYR A 120 13.066 -5.333 -5.654 1.00 0.44 H new ATOM 0 HB2 TYR A 120 11.138 -3.460 -4.260 1.00 0.48 H new ATOM 0 HB3 TYR A 120 10.705 -5.147 -4.453 1.00 0.48 H new ATOM 0 HD1 TYR A 120 12.841 -6.815 -3.917 1.00 0.58 H new ATOM 0 HD2 TYR A 120 12.184 -2.909 -2.248 1.00 0.60 H new ATOM 0 HE1 TYR A 120 14.249 -7.409 -1.965 1.00 0.71 H new ATOM 0 HE2 TYR A 120 13.583 -3.508 -0.294 1.00 0.71 H new ATOM 0 HH TYR A 120 14.828 -5.070 0.701 1.00 0.91 H new ATOM 1052 N PHE A 121 11.281 -5.929 -7.374 1.00 0.48 N ATOM 1053 CA PHE A 121 10.350 -6.187 -8.511 1.00 0.57 C ATOM 1054 C PHE A 121 8.928 -6.372 -7.948 1.00 0.55 C ATOM 1055 O PHE A 121 8.759 -6.977 -6.908 1.00 0.59 O ATOM 1056 CB PHE A 121 10.789 -7.463 -9.238 1.00 0.68 C ATOM 1057 CG PHE A 121 11.224 -8.491 -8.221 1.00 1.42 C ATOM 1058 CD1 PHE A 121 10.271 -9.306 -7.608 1.00 2.32 C ATOM 1059 CD2 PHE A 121 12.577 -8.624 -7.889 1.00 2.33 C ATOM 1060 CE1 PHE A 121 10.665 -10.256 -6.660 1.00 3.44 C ATOM 1061 CE2 PHE A 121 12.975 -9.576 -6.942 1.00 3.43 C ATOM 1062 CZ PHE A 121 12.019 -10.392 -6.327 1.00 3.85 C ATOM 0 H PHE A 121 11.799 -6.742 -7.041 1.00 0.48 H new ATOM 0 HA PHE A 121 10.364 -5.352 -9.211 1.00 0.57 H new ATOM 0 HB2 PHE A 121 9.968 -7.854 -9.839 1.00 0.68 H new ATOM 0 HB3 PHE A 121 11.608 -7.242 -9.922 1.00 0.68 H new ATOM 0 HD1 PHE A 121 9.227 -9.203 -7.866 1.00 2.32 H new ATOM 0 HD2 PHE A 121 13.314 -7.993 -8.363 1.00 2.33 H new ATOM 0 HE1 PHE A 121 9.926 -10.884 -6.185 1.00 3.44 H new ATOM 0 HE2 PHE A 121 14.019 -9.680 -6.687 1.00 3.43 H new ATOM 0 HZ PHE A 121 12.325 -11.126 -5.596 1.00 3.85 H new ATOM 1072 N PRO A 122 7.910 -5.857 -8.604 1.00 0.64 N ATOM 1073 CA PRO A 122 6.505 -5.985 -8.111 1.00 0.67 C ATOM 1074 C PRO A 122 5.911 -7.379 -8.353 1.00 0.73 C ATOM 1075 O PRO A 122 5.457 -7.698 -9.434 1.00 1.19 O ATOM 1076 CB PRO A 122 5.750 -4.924 -8.921 1.00 0.80 C ATOM 1077 CG PRO A 122 6.489 -4.856 -10.217 1.00 1.05 C ATOM 1078 CD PRO A 122 7.963 -5.099 -9.874 1.00 0.87 C ATOM 0 HA PRO A 122 6.440 -5.846 -7.032 1.00 0.67 H new ATOM 0 HB2 PRO A 122 4.708 -5.205 -9.071 1.00 0.80 H new ATOM 0 HB3 PRO A 122 5.750 -3.960 -8.412 1.00 0.80 H new ATOM 0 HG2 PRO A 122 6.122 -5.608 -10.916 1.00 1.05 H new ATOM 0 HG3 PRO A 122 6.354 -3.885 -10.693 1.00 1.05 H new ATOM 0 HD2 PRO A 122 8.468 -5.665 -10.657 1.00 0.87 H new ATOM 0 HD3 PRO A 122 8.506 -4.161 -9.758 1.00 0.87 H new ATOM 1086 N ASP A 123 5.896 -8.199 -7.341 1.00 0.56 N ATOM 1087 CA ASP A 123 5.318 -9.565 -7.478 1.00 0.64 C ATOM 1088 C ASP A 123 4.876 -10.046 -6.095 1.00 0.58 C ATOM 1089 O ASP A 123 4.638 -11.219 -5.879 1.00 0.65 O ATOM 1090 CB ASP A 123 6.372 -10.519 -8.058 1.00 0.74 C ATOM 1091 CG ASP A 123 7.431 -10.841 -6.998 1.00 0.77 C ATOM 1092 OD1 ASP A 123 7.684 -9.986 -6.165 1.00 1.27 O ATOM 1093 OD2 ASP A 123 7.969 -11.935 -7.039 1.00 1.38 O ATOM 0 H ASP A 123 6.263 -7.979 -6.415 1.00 0.56 H new ATOM 0 HA ASP A 123 4.462 -9.545 -8.152 1.00 0.64 H new ATOM 0 HB2 ASP A 123 5.894 -11.438 -8.397 1.00 0.74 H new ATOM 0 HB3 ASP A 123 6.844 -10.065 -8.929 1.00 0.74 H new ATOM 1098 N TRP A 124 4.780 -9.137 -5.154 1.00 0.53 N ATOM 1099 CA TRP A 124 4.371 -9.504 -3.763 1.00 0.52 C ATOM 1100 C TRP A 124 3.039 -8.846 -3.426 1.00 0.51 C ATOM 1101 O TRP A 124 2.263 -9.344 -2.634 1.00 0.55 O ATOM 1102 CB TRP A 124 5.437 -9.001 -2.791 1.00 0.49 C ATOM 1103 CG TRP A 124 5.673 -7.545 -3.040 1.00 0.43 C ATOM 1104 CD1 TRP A 124 6.474 -7.036 -4.007 1.00 0.44 C ATOM 1105 CD2 TRP A 124 5.110 -6.402 -2.332 1.00 0.42 C ATOM 1106 NE1 TRP A 124 6.443 -5.656 -3.932 1.00 0.42 N ATOM 1107 CE2 TRP A 124 5.616 -5.217 -2.918 1.00 0.41 C ATOM 1108 CE3 TRP A 124 4.219 -6.279 -1.250 1.00 0.51 C ATOM 1109 CZ2 TRP A 124 5.254 -3.957 -2.446 1.00 0.46 C ATOM 1110 CZ3 TRP A 124 3.852 -5.010 -0.773 1.00 0.58 C ATOM 1111 CH2 TRP A 124 4.368 -3.852 -1.371 1.00 0.55 C ATOM 0 H TRP A 124 4.970 -8.145 -5.294 1.00 0.53 H new ATOM 0 HA TRP A 124 4.267 -10.586 -3.685 1.00 0.52 H new ATOM 0 HB2 TRP A 124 5.114 -9.160 -1.762 1.00 0.49 H new ATOM 0 HB3 TRP A 124 6.363 -9.561 -2.924 1.00 0.49 H new ATOM 0 HD1 TRP A 124 7.044 -7.614 -4.720 1.00 0.44 H new ATOM 0 HE1 TRP A 124 6.967 -5.038 -4.551 1.00 0.42 H new ATOM 0 HE3 TRP A 124 3.815 -7.165 -0.784 1.00 0.51 H new ATOM 0 HZ2 TRP A 124 5.656 -3.067 -2.908 1.00 0.46 H new ATOM 0 HZ3 TRP A 124 3.169 -4.926 0.059 1.00 0.58 H new ATOM 0 HH2 TRP A 124 4.081 -2.879 -1.001 1.00 0.55 H new ATOM 1122 N GLN A 125 2.780 -7.731 -4.021 1.00 0.53 N ATOM 1123 CA GLN A 125 1.501 -7.012 -3.746 1.00 0.60 C ATOM 1124 C GLN A 125 0.347 -7.720 -4.464 1.00 0.66 C ATOM 1125 O GLN A 125 0.224 -7.671 -5.671 1.00 0.84 O ATOM 1126 CB GLN A 125 1.600 -5.550 -4.213 1.00 0.69 C ATOM 1127 CG GLN A 125 2.325 -5.465 -5.559 1.00 1.56 C ATOM 1128 CD GLN A 125 2.364 -4.007 -6.020 1.00 2.18 C ATOM 1129 OE1 GLN A 125 2.205 -3.103 -5.224 1.00 2.78 O ATOM 1130 NE2 GLN A 125 2.573 -3.737 -7.278 1.00 2.82 N ATOM 0 H GLN A 125 3.397 -7.275 -4.693 1.00 0.53 H new ATOM 0 HA GLN A 125 1.312 -7.020 -2.672 1.00 0.60 H new ATOM 0 HB2 GLN A 125 0.601 -5.123 -4.303 1.00 0.69 H new ATOM 0 HB3 GLN A 125 2.133 -4.959 -3.468 1.00 0.69 H new ATOM 0 HG2 GLN A 125 3.338 -5.856 -5.465 1.00 1.56 H new ATOM 0 HG3 GLN A 125 1.814 -6.079 -6.300 1.00 1.56 H new ATOM 0 HE21 GLN A 125 2.707 -4.495 -7.947 1.00 2.82 H new ATOM 0 HE22 GLN A 125 2.603 -2.767 -7.593 1.00 2.82 H new ATOM 1139 N ASN A 126 -0.502 -8.379 -3.722 1.00 0.64 N ATOM 1140 CA ASN A 126 -1.652 -9.093 -4.349 1.00 0.72 C ATOM 1141 C ASN A 126 -2.764 -9.263 -3.312 1.00 0.69 C ATOM 1142 O ASN A 126 -2.864 -10.278 -2.659 1.00 1.22 O ATOM 1143 CB ASN A 126 -1.192 -10.470 -4.839 1.00 0.84 C ATOM 1144 CG ASN A 126 -0.185 -10.295 -5.978 1.00 0.89 C ATOM 1145 OD1 ASN A 126 -0.509 -9.743 -7.010 1.00 1.53 O ATOM 1146 ND2 ASN A 126 1.031 -10.747 -5.835 1.00 0.88 N ATOM 0 H ASN A 126 -0.449 -8.454 -2.706 1.00 0.64 H new ATOM 0 HA ASN A 126 -2.026 -8.516 -5.195 1.00 0.72 H new ATOM 0 HB2 ASN A 126 -0.737 -11.026 -4.019 1.00 0.84 H new ATOM 0 HB3 ASN A 126 -2.048 -11.051 -5.182 1.00 0.84 H new ATOM 0 HD21 ASN A 126 1.708 -10.636 -6.590 1.00 0.88 H new ATOM 0 HD22 ASN A 126 1.304 -11.211 -4.969 1.00 0.88 H new ATOM 1153 N TYR A 127 -3.593 -8.273 -3.150 1.00 0.69 N ATOM 1154 CA TYR A 127 -4.697 -8.378 -2.151 1.00 0.61 C ATOM 1155 C TYR A 127 -5.735 -9.398 -2.623 1.00 0.63 C ATOM 1156 O TYR A 127 -5.540 -10.101 -3.595 1.00 0.75 O ATOM 1157 CB TYR A 127 -5.378 -7.017 -1.994 1.00 0.65 C ATOM 1158 CG TYR A 127 -4.395 -6.012 -1.449 1.00 0.79 C ATOM 1159 CD1 TYR A 127 -3.547 -5.320 -2.320 1.00 0.93 C ATOM 1160 CD2 TYR A 127 -4.339 -5.765 -0.072 1.00 0.98 C ATOM 1161 CE1 TYR A 127 -2.641 -4.381 -1.816 1.00 1.14 C ATOM 1162 CE2 TYR A 127 -3.433 -4.826 0.433 1.00 1.19 C ATOM 1163 CZ TYR A 127 -2.584 -4.133 -0.439 1.00 1.23 C ATOM 1164 OH TYR A 127 -1.693 -3.205 0.060 1.00 1.48 O ATOM 0 H TYR A 127 -3.556 -7.393 -3.665 1.00 0.69 H new ATOM 0 HA TYR A 127 -4.278 -8.698 -1.197 1.00 0.61 H new ATOM 0 HB2 TYR A 127 -5.761 -6.679 -2.957 1.00 0.65 H new ATOM 0 HB3 TYR A 127 -6.233 -7.103 -1.323 1.00 0.65 H new ATOM 0 HD1 TYR A 127 -3.592 -5.511 -3.382 1.00 0.93 H new ATOM 0 HD2 TYR A 127 -4.995 -6.299 0.600 1.00 0.98 H new ATOM 0 HE1 TYR A 127 -1.986 -3.847 -2.489 1.00 1.14 H new ATOM 0 HE2 TYR A 127 -3.388 -4.636 1.495 1.00 1.19 H new ATOM 0 HH TYR A 127 -1.784 -3.155 1.034 1.00 1.48 H new ATOM 1174 N THR A 128 -6.846 -9.466 -1.943 1.00 0.62 N ATOM 1175 CA THR A 128 -7.919 -10.418 -2.343 1.00 0.68 C ATOM 1176 C THR A 128 -8.454 -9.996 -3.723 1.00 0.75 C ATOM 1177 O THR A 128 -8.308 -8.858 -4.106 1.00 0.97 O ATOM 1178 CB THR A 128 -9.045 -10.358 -1.290 1.00 0.86 C ATOM 1179 OG1 THR A 128 -9.094 -9.051 -0.732 1.00 1.22 O ATOM 1180 CG2 THR A 128 -8.776 -11.371 -0.172 1.00 0.90 C ATOM 0 H THR A 128 -7.058 -8.899 -1.122 1.00 0.62 H new ATOM 0 HA THR A 128 -7.537 -11.437 -2.401 1.00 0.68 H new ATOM 0 HB THR A 128 -9.994 -10.597 -1.769 1.00 0.86 H new ATOM 0 HG1 THR A 128 -9.809 -9.007 -0.063 1.00 1.22 H new ATOM 0 HG21 THR A 128 -9.577 -11.320 0.566 1.00 0.90 H new ATOM 0 HG22 THR A 128 -8.734 -12.375 -0.593 1.00 0.90 H new ATOM 0 HG23 THR A 128 -7.825 -11.139 0.308 1.00 0.90 H new ATOM 1188 N PRO A 129 -9.062 -10.909 -4.456 1.00 0.88 N ATOM 1189 CA PRO A 129 -9.635 -10.636 -5.818 1.00 1.15 C ATOM 1190 C PRO A 129 -10.252 -9.234 -5.974 1.00 1.51 C ATOM 1191 O PRO A 129 -9.582 -8.230 -5.839 1.00 2.29 O ATOM 1192 CB PRO A 129 -10.696 -11.732 -5.957 1.00 1.51 C ATOM 1193 CG PRO A 129 -10.127 -12.902 -5.215 1.00 1.27 C ATOM 1194 CD PRO A 129 -9.266 -12.323 -4.077 1.00 1.09 C ATOM 0 HA PRO A 129 -8.866 -10.650 -6.590 1.00 1.15 H new ATOM 0 HB2 PRO A 129 -11.649 -11.418 -5.532 1.00 1.51 H new ATOM 0 HB3 PRO A 129 -10.879 -11.977 -7.003 1.00 1.51 H new ATOM 0 HG2 PRO A 129 -10.922 -13.533 -4.817 1.00 1.27 H new ATOM 0 HG3 PRO A 129 -9.526 -13.526 -5.877 1.00 1.27 H new ATOM 0 HD2 PRO A 129 -9.770 -12.408 -3.114 1.00 1.09 H new ATOM 0 HD3 PRO A 129 -8.317 -12.852 -3.988 1.00 1.09 H new ATOM 1202 N GLY A 130 -11.516 -9.160 -6.300 1.00 1.64 N ATOM 1203 CA GLY A 130 -12.180 -7.826 -6.502 1.00 2.18 C ATOM 1204 C GLY A 130 -13.389 -7.640 -5.565 1.00 1.76 C ATOM 1205 O GLY A 130 -14.406 -7.119 -5.980 1.00 1.92 O ATOM 0 H GLY A 130 -12.125 -9.967 -6.437 1.00 1.64 H new ATOM 0 HA2 GLY A 130 -11.457 -7.030 -6.325 1.00 2.18 H new ATOM 0 HA3 GLY A 130 -12.506 -7.736 -7.538 1.00 2.18 H new ATOM 1209 N PRO A 131 -13.290 -8.024 -4.313 1.00 1.94 N ATOM 1210 CA PRO A 131 -14.408 -7.847 -3.336 1.00 2.04 C ATOM 1211 C PRO A 131 -14.479 -6.401 -2.823 1.00 1.43 C ATOM 1212 O PRO A 131 -13.969 -5.489 -3.442 1.00 1.44 O ATOM 1213 CB PRO A 131 -14.023 -8.795 -2.200 1.00 2.91 C ATOM 1214 CG PRO A 131 -12.532 -8.761 -2.200 1.00 3.25 C ATOM 1215 CD PRO A 131 -12.125 -8.671 -3.674 1.00 2.75 C ATOM 0 HA PRO A 131 -15.386 -8.055 -3.770 1.00 2.04 H new ATOM 0 HB2 PRO A 131 -14.431 -8.462 -1.246 1.00 2.91 H new ATOM 0 HB3 PRO A 131 -14.400 -9.803 -2.374 1.00 2.91 H new ATOM 0 HG2 PRO A 131 -12.159 -7.906 -1.637 1.00 3.25 H new ATOM 0 HG3 PRO A 131 -12.119 -9.655 -1.733 1.00 3.25 H new ATOM 0 HD2 PRO A 131 -11.217 -8.082 -3.805 1.00 2.75 H new ATOM 0 HD3 PRO A 131 -11.930 -9.656 -4.098 1.00 2.75 H new ATOM 1223 N GLY A 132 -15.089 -6.190 -1.689 1.00 1.58 N ATOM 1224 CA GLY A 132 -15.169 -4.809 -1.129 1.00 1.44 C ATOM 1225 C GLY A 132 -13.859 -4.502 -0.398 1.00 1.21 C ATOM 1226 O GLY A 132 -12.967 -3.880 -0.938 1.00 1.21 O ATOM 0 H GLY A 132 -15.536 -6.913 -1.125 1.00 1.58 H new ATOM 0 HA2 GLY A 132 -15.335 -4.086 -1.928 1.00 1.44 H new ATOM 0 HA3 GLY A 132 -16.013 -4.727 -0.444 1.00 1.44 H new ATOM 1230 N ILE A 133 -13.728 -4.949 0.823 1.00 1.11 N ATOM 1231 CA ILE A 133 -12.469 -4.702 1.581 1.00 0.94 C ATOM 1232 C ILE A 133 -11.309 -5.315 0.791 1.00 0.92 C ATOM 1233 O ILE A 133 -11.499 -5.816 -0.299 1.00 1.52 O ATOM 1234 CB ILE A 133 -12.593 -5.366 2.960 1.00 0.99 C ATOM 1235 CG1 ILE A 133 -13.822 -4.791 3.682 1.00 1.14 C ATOM 1236 CG2 ILE A 133 -11.333 -5.105 3.805 1.00 0.98 C ATOM 1237 CD1 ILE A 133 -14.210 -5.718 4.830 1.00 1.56 C ATOM 0 H ILE A 133 -14.441 -5.475 1.328 1.00 1.11 H new ATOM 0 HA ILE A 133 -12.289 -3.635 1.716 1.00 0.94 H new ATOM 0 HB ILE A 133 -12.703 -6.442 2.827 1.00 0.99 H new ATOM 0 HG12 ILE A 133 -13.601 -3.794 4.063 1.00 1.14 H new ATOM 0 HG13 ILE A 133 -14.653 -4.689 2.985 1.00 1.14 H new ATOM 0 HG21 ILE A 133 -11.442 -5.584 4.778 1.00 0.98 H new ATOM 0 HG22 ILE A 133 -10.461 -5.514 3.294 1.00 0.98 H new ATOM 0 HG23 ILE A 133 -11.203 -4.032 3.942 1.00 0.98 H new ATOM 0 HD11 ILE A 133 -15.082 -5.314 5.345 1.00 1.56 H new ATOM 0 HD12 ILE A 133 -14.447 -6.706 4.436 1.00 1.56 H new ATOM 0 HD13 ILE A 133 -13.379 -5.797 5.531 1.00 1.56 H new ATOM 1249 N ARG A 134 -10.112 -5.290 1.315 1.00 0.51 N ATOM 1250 CA ARG A 134 -8.966 -5.876 0.558 1.00 0.49 C ATOM 1251 C ARG A 134 -7.853 -6.280 1.530 1.00 0.40 C ATOM 1252 O ARG A 134 -6.999 -5.485 1.887 1.00 0.38 O ATOM 1253 CB ARG A 134 -8.414 -4.831 -0.418 1.00 0.58 C ATOM 1254 CG ARG A 134 -9.363 -4.651 -1.606 1.00 1.06 C ATOM 1255 CD ARG A 134 -8.661 -3.831 -2.689 1.00 1.37 C ATOM 1256 NE ARG A 134 -9.664 -3.368 -3.686 1.00 1.86 N ATOM 1257 CZ ARG A 134 -9.363 -2.402 -4.508 1.00 2.52 C ATOM 1258 NH1 ARG A 134 -8.190 -1.833 -4.444 1.00 2.83 N ATOM 1259 NH2 ARG A 134 -10.235 -2.001 -5.392 1.00 3.36 N ATOM 0 H ARG A 134 -9.879 -4.893 2.225 1.00 0.51 H new ATOM 0 HA ARG A 134 -9.312 -6.754 0.012 1.00 0.49 H new ATOM 0 HB2 ARG A 134 -8.281 -3.879 0.096 1.00 0.58 H new ATOM 0 HB3 ARG A 134 -7.431 -5.141 -0.774 1.00 0.58 H new ATOM 0 HG2 ARG A 134 -9.658 -5.623 -2.002 1.00 1.06 H new ATOM 0 HG3 ARG A 134 -10.275 -4.148 -1.285 1.00 1.06 H new ATOM 0 HD2 ARG A 134 -8.155 -2.976 -2.242 1.00 1.37 H new ATOM 0 HD3 ARG A 134 -7.896 -4.434 -3.179 1.00 1.37 H new ATOM 0 HE ARG A 134 -10.585 -3.805 -3.726 1.00 1.86 H new ATOM 0 HH11 ARG A 134 -7.509 -2.144 -3.751 1.00 2.83 H new ATOM 0 HH12 ARG A 134 -7.954 -1.077 -5.087 1.00 2.83 H new ATOM 0 HH21 ARG A 134 -11.153 -2.443 -5.440 1.00 3.36 H new ATOM 0 HH22 ARG A 134 -9.999 -1.245 -6.035 1.00 3.36 H new ATOM 1273 N TYR A 135 -7.851 -7.523 1.945 1.00 0.41 N ATOM 1274 CA TYR A 135 -6.792 -8.010 2.875 1.00 0.39 C ATOM 1275 C TYR A 135 -5.575 -8.439 2.041 1.00 0.36 C ATOM 1276 O TYR A 135 -5.720 -8.834 0.901 1.00 0.39 O ATOM 1277 CB TYR A 135 -7.323 -9.216 3.658 1.00 0.46 C ATOM 1278 CG TYR A 135 -8.345 -8.754 4.672 1.00 0.50 C ATOM 1279 CD1 TYR A 135 -9.620 -8.363 4.247 1.00 0.72 C ATOM 1280 CD2 TYR A 135 -8.020 -8.718 6.035 1.00 0.66 C ATOM 1281 CE1 TYR A 135 -10.571 -7.937 5.182 1.00 0.91 C ATOM 1282 CE2 TYR A 135 -8.971 -8.293 6.971 1.00 0.85 C ATOM 1283 CZ TYR A 135 -10.247 -7.903 6.545 1.00 0.92 C ATOM 1284 OH TYR A 135 -11.187 -7.487 7.468 1.00 1.17 O ATOM 0 H TYR A 135 -8.543 -8.223 1.676 1.00 0.41 H new ATOM 0 HA TYR A 135 -6.510 -7.222 3.574 1.00 0.39 H new ATOM 0 HB2 TYR A 135 -7.774 -9.936 2.975 1.00 0.46 H new ATOM 0 HB3 TYR A 135 -6.501 -9.726 4.161 1.00 0.46 H new ATOM 0 HD1 TYR A 135 -9.870 -8.390 3.197 1.00 0.72 H new ATOM 0 HD2 TYR A 135 -7.036 -9.018 6.363 1.00 0.66 H new ATOM 0 HE1 TYR A 135 -11.554 -7.635 4.853 1.00 0.91 H new ATOM 0 HE2 TYR A 135 -8.721 -8.266 8.021 1.00 0.85 H new ATOM 0 HH TYR A 135 -10.801 -7.524 8.368 1.00 1.17 H new ATOM 1294 N PRO A 136 -4.382 -8.366 2.584 1.00 0.37 N ATOM 1295 CA PRO A 136 -3.144 -8.759 1.844 1.00 0.38 C ATOM 1296 C PRO A 136 -2.943 -10.280 1.809 1.00 0.37 C ATOM 1297 O PRO A 136 -2.797 -10.917 2.833 1.00 0.38 O ATOM 1298 CB PRO A 136 -2.037 -8.086 2.657 1.00 0.42 C ATOM 1299 CG PRO A 136 -2.547 -8.109 4.060 1.00 0.51 C ATOM 1300 CD PRO A 136 -4.063 -7.905 3.952 1.00 0.44 C ATOM 0 HA PRO A 136 -3.172 -8.458 0.797 1.00 0.38 H new ATOM 0 HB2 PRO A 136 -1.094 -8.625 2.567 1.00 0.42 H new ATOM 0 HB3 PRO A 136 -1.856 -7.067 2.316 1.00 0.42 H new ATOM 0 HG2 PRO A 136 -2.313 -9.056 4.547 1.00 0.51 H new ATOM 0 HG3 PRO A 136 -2.087 -7.321 4.657 1.00 0.51 H new ATOM 0 HD2 PRO A 136 -4.599 -8.483 4.705 1.00 0.44 H new ATOM 0 HD3 PRO A 136 -4.338 -6.860 4.097 1.00 0.44 H new ATOM 1308 N LEU A 137 -2.923 -10.867 0.640 1.00 0.40 N ATOM 1309 CA LEU A 137 -2.721 -12.342 0.559 1.00 0.43 C ATOM 1310 C LEU A 137 -1.350 -12.683 1.146 1.00 0.41 C ATOM 1311 O LEU A 137 -1.206 -13.609 1.919 1.00 0.38 O ATOM 1312 CB LEU A 137 -2.781 -12.804 -0.905 1.00 0.51 C ATOM 1313 CG LEU A 137 -4.202 -12.638 -1.471 1.00 0.59 C ATOM 1314 CD1 LEU A 137 -4.179 -12.908 -2.982 1.00 0.64 C ATOM 1315 CD2 LEU A 137 -5.176 -13.632 -0.812 1.00 0.92 C ATOM 0 H LEU A 137 -3.037 -10.392 -0.255 1.00 0.40 H new ATOM 0 HA LEU A 137 -3.507 -12.849 1.119 1.00 0.43 H new ATOM 0 HB2 LEU A 137 -2.076 -12.226 -1.503 1.00 0.51 H new ATOM 0 HB3 LEU A 137 -2.476 -13.848 -0.975 1.00 0.51 H new ATOM 0 HG LEU A 137 -4.537 -11.621 -1.265 1.00 0.59 H new ATOM 0 HD11 LEU A 137 -5.184 -12.792 -3.388 1.00 0.64 H new ATOM 0 HD12 LEU A 137 -3.507 -12.200 -3.468 1.00 0.64 H new ATOM 0 HD13 LEU A 137 -3.829 -13.924 -3.165 1.00 0.64 H new ATOM 0 HD21 LEU A 137 -6.174 -13.495 -1.229 1.00 0.92 H new ATOM 0 HD22 LEU A 137 -4.840 -14.651 -1.003 1.00 0.92 H new ATOM 0 HD23 LEU A 137 -5.205 -13.455 0.263 1.00 0.92 H new ATOM 1327 N THR A 138 -0.341 -11.936 0.785 1.00 0.50 N ATOM 1328 CA THR A 138 1.020 -12.209 1.323 1.00 0.55 C ATOM 1329 C THR A 138 1.045 -11.899 2.823 1.00 0.47 C ATOM 1330 O THR A 138 0.261 -11.115 3.320 1.00 0.50 O ATOM 1331 CB THR A 138 2.046 -11.333 0.583 1.00 0.73 C ATOM 1332 OG1 THR A 138 1.446 -10.087 0.259 1.00 0.98 O ATOM 1333 CG2 THR A 138 2.492 -12.033 -0.703 1.00 1.04 C ATOM 0 H THR A 138 -0.402 -11.148 0.140 1.00 0.50 H new ATOM 0 HA THR A 138 1.274 -13.258 1.173 1.00 0.55 H new ATOM 0 HB THR A 138 2.914 -11.170 1.222 1.00 0.73 H new ATOM 0 HG1 THR A 138 1.707 -9.825 -0.649 1.00 0.98 H new ATOM 0 HG21 THR A 138 3.218 -11.409 -1.224 1.00 1.04 H new ATOM 0 HG22 THR A 138 2.948 -12.992 -0.456 1.00 1.04 H new ATOM 0 HG23 THR A 138 1.628 -12.197 -1.346 1.00 1.04 H new ATOM 1341 N PHE A 139 1.939 -12.520 3.544 1.00 0.51 N ATOM 1342 CA PHE A 139 2.027 -12.283 5.019 1.00 0.49 C ATOM 1343 C PHE A 139 3.119 -11.255 5.323 1.00 0.65 C ATOM 1344 O PHE A 139 4.053 -11.081 4.567 1.00 1.43 O ATOM 1345 CB PHE A 139 2.377 -13.602 5.716 1.00 0.52 C ATOM 1346 CG PHE A 139 2.525 -13.371 7.204 1.00 0.50 C ATOM 1347 CD1 PHE A 139 1.395 -13.096 7.981 1.00 0.67 C ATOM 1348 CD2 PHE A 139 3.789 -13.441 7.807 1.00 0.59 C ATOM 1349 CE1 PHE A 139 1.525 -12.888 9.360 1.00 0.77 C ATOM 1350 CE2 PHE A 139 3.920 -13.233 9.187 1.00 0.62 C ATOM 1351 CZ PHE A 139 2.786 -12.957 9.964 1.00 0.66 C ATOM 0 H PHE A 139 2.618 -13.186 3.175 1.00 0.51 H new ATOM 0 HA PHE A 139 1.070 -11.906 5.379 1.00 0.49 H new ATOM 0 HB2 PHE A 139 1.598 -14.341 5.529 1.00 0.52 H new ATOM 0 HB3 PHE A 139 3.303 -14.005 5.307 1.00 0.52 H new ATOM 0 HD1 PHE A 139 0.421 -13.044 7.517 1.00 0.67 H new ATOM 0 HD2 PHE A 139 4.662 -13.655 7.208 1.00 0.59 H new ATOM 0 HE1 PHE A 139 0.651 -12.674 9.958 1.00 0.77 H new ATOM 0 HE2 PHE A 139 4.894 -13.285 9.651 1.00 0.62 H new ATOM 0 HZ PHE A 139 2.885 -12.798 11.028 1.00 0.66 H new ATOM 1361 N GLY A 140 3.015 -10.582 6.438 1.00 0.46 N ATOM 1362 CA GLY A 140 4.052 -9.578 6.820 1.00 0.43 C ATOM 1363 C GLY A 140 3.624 -8.179 6.377 1.00 0.35 C ATOM 1364 O GLY A 140 3.880 -7.199 7.048 1.00 0.32 O ATOM 0 H GLY A 140 2.251 -10.685 7.106 1.00 0.46 H new ATOM 0 HA2 GLY A 140 4.204 -9.595 7.899 1.00 0.43 H new ATOM 0 HA3 GLY A 140 5.006 -9.837 6.360 1.00 0.43 H new ATOM 1368 N TRP A 141 2.971 -8.076 5.257 1.00 0.34 N ATOM 1369 CA TRP A 141 2.526 -6.735 4.785 1.00 0.29 C ATOM 1370 C TRP A 141 1.351 -6.302 5.654 1.00 0.32 C ATOM 1371 O TRP A 141 0.220 -6.692 5.444 1.00 0.40 O ATOM 1372 CB TRP A 141 2.126 -6.831 3.308 1.00 0.33 C ATOM 1373 CG TRP A 141 1.915 -5.474 2.696 1.00 0.31 C ATOM 1374 CD1 TRP A 141 0.804 -5.124 2.008 1.00 0.35 C ATOM 1375 CD2 TRP A 141 2.798 -4.298 2.665 1.00 0.28 C ATOM 1376 NE1 TRP A 141 0.936 -3.825 1.561 1.00 0.33 N ATOM 1377 CE2 TRP A 141 2.139 -3.271 1.937 1.00 0.30 C ATOM 1378 CE3 TRP A 141 4.083 -4.011 3.186 1.00 0.28 C ATOM 1379 CZ2 TRP A 141 2.724 -2.021 1.730 1.00 0.32 C ATOM 1380 CZ3 TRP A 141 4.669 -2.749 2.976 1.00 0.31 C ATOM 1381 CH2 TRP A 141 3.992 -1.758 2.250 1.00 0.33 C ATOM 0 H TRP A 141 2.726 -8.857 4.649 1.00 0.34 H new ATOM 0 HA TRP A 141 3.323 -5.997 4.868 1.00 0.29 H new ATOM 0 HB2 TRP A 141 2.901 -7.362 2.756 1.00 0.33 H new ATOM 0 HB3 TRP A 141 1.211 -7.417 3.217 1.00 0.33 H new ATOM 0 HD1 TRP A 141 -0.051 -5.761 1.836 1.00 0.35 H new ATOM 0 HE1 TRP A 141 0.227 -3.334 1.017 1.00 0.33 H new ATOM 0 HE3 TRP A 141 4.616 -4.764 3.747 1.00 0.28 H new ATOM 0 HZ2 TRP A 141 2.198 -1.261 1.170 1.00 0.32 H new ATOM 0 HZ3 TRP A 141 5.650 -2.541 3.378 1.00 0.31 H new ATOM 0 HH2 TRP A 141 4.451 -0.793 2.094 1.00 0.33 H new ATOM 1392 N CYS A 142 1.637 -5.533 6.667 1.00 0.31 N ATOM 1393 CA CYS A 142 0.579 -5.098 7.616 1.00 0.40 C ATOM 1394 C CYS A 142 -0.220 -3.905 7.071 1.00 0.39 C ATOM 1395 O CYS A 142 -0.602 -3.019 7.811 1.00 0.48 O ATOM 1396 CB CYS A 142 1.263 -4.723 8.931 1.00 0.47 C ATOM 1397 SG CYS A 142 2.883 -3.996 8.578 1.00 1.45 S ATOM 0 H CYS A 142 2.572 -5.184 6.879 1.00 0.31 H new ATOM 0 HA CYS A 142 -0.133 -5.910 7.764 1.00 0.40 H new ATOM 0 HB2 CYS A 142 0.647 -4.015 9.485 1.00 0.47 H new ATOM 0 HB3 CYS A 142 1.377 -5.606 9.559 1.00 0.47 H new ATOM 0 HG CYS A 142 3.280 -3.303 9.603 1.00 1.45 H new ATOM 1403 N TYR A 143 -0.494 -3.880 5.795 1.00 0.38 N ATOM 1404 CA TYR A 143 -1.288 -2.750 5.209 1.00 0.40 C ATOM 1405 C TYR A 143 -2.635 -3.296 4.713 1.00 0.43 C ATOM 1406 O TYR A 143 -2.729 -3.880 3.650 1.00 0.65 O ATOM 1407 CB TYR A 143 -0.488 -2.134 4.044 1.00 0.55 C ATOM 1408 CG TYR A 143 0.329 -0.958 4.544 1.00 1.43 C ATOM 1409 CD1 TYR A 143 -0.324 0.203 4.969 1.00 2.16 C ATOM 1410 CD2 TYR A 143 1.727 -1.025 4.577 1.00 2.17 C ATOM 1411 CE1 TYR A 143 0.416 1.299 5.426 1.00 3.14 C ATOM 1412 CE2 TYR A 143 2.470 0.072 5.033 1.00 3.14 C ATOM 1413 CZ TYR A 143 1.814 1.233 5.457 1.00 3.52 C ATOM 1414 OH TYR A 143 2.544 2.315 5.906 1.00 4.57 O ATOM 0 H TYR A 143 -0.203 -4.594 5.127 1.00 0.38 H new ATOM 0 HA TYR A 143 -1.474 -1.979 5.957 1.00 0.40 H new ATOM 0 HB2 TYR A 143 0.170 -2.885 3.606 1.00 0.55 H new ATOM 0 HB3 TYR A 143 -1.168 -1.807 3.257 1.00 0.55 H new ATOM 0 HD1 TYR A 143 -1.403 0.254 4.944 1.00 2.16 H new ATOM 0 HD2 TYR A 143 2.233 -1.922 4.251 1.00 2.17 H new ATOM 0 HE1 TYR A 143 -0.091 2.195 5.754 1.00 3.14 H new ATOM 0 HE2 TYR A 143 3.549 0.021 5.057 1.00 3.14 H new ATOM 0 HH TYR A 143 3.500 2.104 5.864 1.00 4.57 H new ATOM 1424 N LYS A 144 -3.680 -3.107 5.484 1.00 0.39 N ATOM 1425 CA LYS A 144 -5.033 -3.606 5.077 1.00 0.51 C ATOM 1426 C LYS A 144 -5.858 -2.437 4.537 1.00 0.43 C ATOM 1427 O LYS A 144 -6.195 -1.520 5.260 1.00 0.45 O ATOM 1428 CB LYS A 144 -5.748 -4.202 6.293 1.00 0.70 C ATOM 1429 CG LYS A 144 -4.893 -5.309 6.915 1.00 1.21 C ATOM 1430 CD LYS A 144 -5.478 -5.687 8.279 1.00 1.24 C ATOM 1431 CE LYS A 144 -4.651 -6.809 8.910 1.00 1.57 C ATOM 1432 NZ LYS A 144 -4.699 -8.017 8.038 1.00 2.32 N ATOM 0 H LYS A 144 -3.654 -2.626 6.383 1.00 0.39 H new ATOM 0 HA LYS A 144 -4.921 -4.370 4.308 1.00 0.51 H new ATOM 0 HB2 LYS A 144 -5.940 -3.422 7.030 1.00 0.70 H new ATOM 0 HB3 LYS A 144 -6.716 -4.604 5.995 1.00 0.70 H new ATOM 0 HG2 LYS A 144 -4.872 -6.180 6.260 1.00 1.21 H new ATOM 0 HG3 LYS A 144 -3.863 -4.970 7.028 1.00 1.21 H new ATOM 0 HD2 LYS A 144 -5.485 -4.816 8.935 1.00 1.24 H new ATOM 0 HD3 LYS A 144 -6.513 -6.008 8.164 1.00 1.24 H new ATOM 0 HE2 LYS A 144 -3.619 -6.484 9.042 1.00 1.57 H new ATOM 0 HE3 LYS A 144 -5.039 -7.047 9.900 1.00 1.57 H new ATOM 0 HZ1 LYS A 144 -4.268 -8.822 8.536 1.00 2.32 H new ATOM 0 HZ2 LYS A 144 -5.689 -8.241 7.809 1.00 2.32 H new ATOM 0 HZ3 LYS A 144 -4.174 -7.832 7.159 1.00 2.32 H new ATOM 1446 N LEU A 145 -6.189 -2.456 3.276 1.00 0.40 N ATOM 1447 CA LEU A 145 -6.997 -1.339 2.702 1.00 0.37 C ATOM 1448 C LEU A 145 -8.476 -1.542 3.067 1.00 0.38 C ATOM 1449 O LEU A 145 -8.942 -2.658 3.199 1.00 0.41 O ATOM 1450 CB LEU A 145 -6.813 -1.330 1.176 1.00 0.42 C ATOM 1451 CG LEU A 145 -5.492 -0.613 0.803 1.00 0.50 C ATOM 1452 CD1 LEU A 145 -4.927 -1.199 -0.496 1.00 0.63 C ATOM 1453 CD2 LEU A 145 -5.745 0.887 0.606 1.00 0.52 C ATOM 0 H LEU A 145 -5.937 -3.193 2.618 1.00 0.40 H new ATOM 0 HA LEU A 145 -6.667 -0.383 3.108 1.00 0.37 H new ATOM 0 HB2 LEU A 145 -6.800 -2.352 0.797 1.00 0.42 H new ATOM 0 HB3 LEU A 145 -7.656 -0.825 0.703 1.00 0.42 H new ATOM 0 HG LEU A 145 -4.777 -0.759 1.612 1.00 0.50 H new ATOM 0 HD11 LEU A 145 -3.998 -0.689 -0.751 1.00 0.63 H new ATOM 0 HD12 LEU A 145 -4.732 -2.263 -0.361 1.00 0.63 H new ATOM 0 HD13 LEU A 145 -5.649 -1.062 -1.301 1.00 0.63 H new ATOM 0 HD21 LEU A 145 -4.810 1.382 0.344 1.00 0.52 H new ATOM 0 HD22 LEU A 145 -6.469 1.032 -0.196 1.00 0.52 H new ATOM 0 HD23 LEU A 145 -6.136 1.314 1.529 1.00 0.52 H new ATOM 1465 N VAL A 146 -9.217 -0.467 3.230 1.00 0.43 N ATOM 1466 CA VAL A 146 -10.666 -0.587 3.600 1.00 0.50 C ATOM 1467 C VAL A 146 -11.417 0.670 3.097 1.00 0.59 C ATOM 1468 O VAL A 146 -11.006 1.776 3.382 1.00 0.63 O ATOM 1469 CB VAL A 146 -10.803 -0.631 5.132 1.00 0.56 C ATOM 1470 CG1 VAL A 146 -12.263 -0.899 5.514 1.00 0.68 C ATOM 1471 CG2 VAL A 146 -9.925 -1.738 5.723 1.00 0.56 C ATOM 0 H VAL A 146 -8.879 0.489 3.122 1.00 0.43 H new ATOM 0 HA VAL A 146 -11.077 -1.493 3.155 1.00 0.50 H new ATOM 0 HB VAL A 146 -10.482 0.331 5.531 1.00 0.56 H new ATOM 0 HG11 VAL A 146 -12.355 -0.929 6.600 1.00 0.68 H new ATOM 0 HG12 VAL A 146 -12.895 -0.104 5.118 1.00 0.68 H new ATOM 0 HG13 VAL A 146 -12.579 -1.855 5.096 1.00 0.68 H new ATOM 0 HG21 VAL A 146 -10.037 -1.751 6.807 1.00 0.56 H new ATOM 0 HG22 VAL A 146 -10.230 -2.701 5.315 1.00 0.56 H new ATOM 0 HG23 VAL A 146 -8.882 -1.550 5.468 1.00 0.56 H new ATOM 1481 N PRO A 147 -12.513 0.519 2.370 1.00 0.68 N ATOM 1482 CA PRO A 147 -13.301 1.687 1.860 1.00 0.81 C ATOM 1483 C PRO A 147 -13.534 2.765 2.929 1.00 0.91 C ATOM 1484 O PRO A 147 -13.163 2.609 4.076 1.00 1.12 O ATOM 1485 CB PRO A 147 -14.641 1.069 1.433 1.00 0.87 C ATOM 1486 CG PRO A 147 -14.332 -0.356 1.097 1.00 0.97 C ATOM 1487 CD PRO A 147 -13.118 -0.761 1.948 1.00 0.75 C ATOM 0 HA PRO A 147 -12.772 2.197 1.055 1.00 0.81 H new ATOM 0 HB2 PRO A 147 -15.376 1.133 2.235 1.00 0.87 H new ATOM 0 HB3 PRO A 147 -15.060 1.593 0.574 1.00 0.87 H new ATOM 0 HG2 PRO A 147 -15.186 -0.998 1.313 1.00 0.97 H new ATOM 0 HG3 PRO A 147 -14.112 -0.464 0.035 1.00 0.97 H new ATOM 0 HD2 PRO A 147 -13.419 -1.359 2.808 1.00 0.75 H new ATOM 0 HD3 PRO A 147 -12.413 -1.362 1.373 1.00 0.75 H new ATOM 1495 N VAL A 148 -14.161 3.850 2.554 1.00 1.17 N ATOM 1496 CA VAL A 148 -14.444 4.939 3.528 1.00 1.29 C ATOM 1497 C VAL A 148 -15.756 4.633 4.246 1.00 1.32 C ATOM 1498 O VAL A 148 -15.998 3.527 4.684 1.00 1.88 O ATOM 1499 CB VAL A 148 -14.554 6.278 2.777 1.00 1.89 C ATOM 1500 CG1 VAL A 148 -14.328 7.444 3.750 1.00 2.07 C ATOM 1501 CG2 VAL A 148 -13.497 6.328 1.668 1.00 2.31 C ATOM 0 H VAL A 148 -14.491 4.027 1.605 1.00 1.17 H new ATOM 0 HA VAL A 148 -13.638 5.007 4.259 1.00 1.29 H new ATOM 0 HB VAL A 148 -15.549 6.363 2.341 1.00 1.89 H new ATOM 0 HG11 VAL A 148 -14.407 8.388 3.211 1.00 2.07 H new ATOM 0 HG12 VAL A 148 -15.081 7.411 4.538 1.00 2.07 H new ATOM 0 HG13 VAL A 148 -13.335 7.361 4.193 1.00 2.07 H new ATOM 0 HG21 VAL A 148 -13.573 7.276 1.135 1.00 2.31 H new ATOM 0 HG22 VAL A 148 -12.504 6.238 2.108 1.00 2.31 H new ATOM 0 HG23 VAL A 148 -13.661 5.506 0.972 1.00 2.31 H new ATOM 1511 N GLU A 149 -16.592 5.617 4.362 1.00 1.71 N ATOM 1512 CA GLU A 149 -17.906 5.451 5.053 1.00 2.15 C ATOM 1513 C GLU A 149 -18.877 6.526 4.549 1.00 2.52 C ATOM 1514 O GLU A 149 -19.062 7.545 5.185 1.00 2.96 O ATOM 1515 CB GLU A 149 -17.729 5.662 6.563 1.00 3.00 C ATOM 1516 CG GLU A 149 -16.664 4.719 7.123 1.00 3.61 C ATOM 1517 CD GLU A 149 -16.681 4.789 8.650 1.00 4.55 C ATOM 1518 OE1 GLU A 149 -16.090 5.710 9.187 1.00 5.02 O ATOM 1519 OE2 GLU A 149 -17.285 3.919 9.257 1.00 5.12 O ATOM 0 H GLU A 149 -16.421 6.555 4.000 1.00 1.71 H new ATOM 0 HA GLU A 149 -18.287 4.450 4.850 1.00 2.15 H new ATOM 0 HB2 GLU A 149 -17.445 6.696 6.759 1.00 3.00 H new ATOM 0 HB3 GLU A 149 -18.677 5.490 7.072 1.00 3.00 H new ATOM 0 HG2 GLU A 149 -16.855 3.698 6.792 1.00 3.61 H new ATOM 0 HG3 GLU A 149 -15.680 4.998 6.745 1.00 3.61 H new ATOM 1526 N PRO A 150 -19.492 6.305 3.414 1.00 3.13 N ATOM 1527 CA PRO A 150 -20.458 7.278 2.818 1.00 4.08 C ATOM 1528 C PRO A 150 -21.454 7.828 3.851 1.00 4.33 C ATOM 1529 O PRO A 150 -21.467 7.421 4.997 1.00 4.84 O ATOM 1530 CB PRO A 150 -21.173 6.450 1.744 1.00 4.93 C ATOM 1531 CG PRO A 150 -20.156 5.442 1.314 1.00 4.81 C ATOM 1532 CD PRO A 150 -19.337 5.107 2.568 1.00 3.63 C ATOM 0 HA PRO A 150 -19.960 8.164 2.424 1.00 4.08 H new ATOM 0 HB2 PRO A 150 -22.066 5.969 2.142 1.00 4.93 H new ATOM 0 HB3 PRO A 150 -21.493 7.073 0.909 1.00 4.93 H new ATOM 0 HG2 PRO A 150 -20.636 4.550 0.912 1.00 4.81 H new ATOM 0 HG3 PRO A 150 -19.518 5.843 0.527 1.00 4.81 H new ATOM 0 HD2 PRO A 150 -19.713 4.213 3.066 1.00 3.63 H new ATOM 0 HD3 PRO A 150 -18.291 4.920 2.325 1.00 3.63 H new ATOM 1540 N GLU A 151 -22.283 8.758 3.452 1.00 4.44 N ATOM 1541 CA GLU A 151 -23.273 9.349 4.402 1.00 5.08 C ATOM 1542 C GLU A 151 -24.220 8.266 4.921 1.00 5.48 C ATOM 1543 O GLU A 151 -24.143 7.118 4.532 1.00 5.61 O ATOM 1544 CB GLU A 151 -24.091 10.423 3.681 1.00 5.57 C ATOM 1545 CG GLU A 151 -23.207 11.642 3.410 1.00 5.87 C ATOM 1546 CD GLU A 151 -24.064 12.774 2.845 1.00 6.47 C ATOM 1547 OE1 GLU A 151 -24.532 12.634 1.728 1.00 6.96 O ATOM 1548 OE2 GLU A 151 -24.241 13.760 3.541 1.00 6.74 O ATOM 0 H GLU A 151 -22.317 9.135 2.505 1.00 4.44 H new ATOM 0 HA GLU A 151 -22.736 9.789 5.242 1.00 5.08 H new ATOM 0 HB2 GLU A 151 -24.482 10.029 2.743 1.00 5.57 H new ATOM 0 HB3 GLU A 151 -24.949 10.711 4.289 1.00 5.57 H new ATOM 0 HG2 GLU A 151 -22.720 11.964 4.331 1.00 5.87 H new ATOM 0 HG3 GLU A 151 -22.417 11.383 2.705 1.00 5.87 H new ATOM 1555 N LYS A 152 -25.115 8.631 5.804 1.00 6.06 N ATOM 1556 CA LYS A 152 -26.080 7.646 6.365 1.00 6.80 C ATOM 1557 C LYS A 152 -27.324 7.587 5.471 1.00 7.18 C ATOM 1558 O LYS A 152 -27.233 7.381 4.277 1.00 7.59 O ATOM 1559 CB LYS A 152 -26.470 8.093 7.783 1.00 7.59 C ATOM 1560 CG LYS A 152 -27.082 6.917 8.567 1.00 7.87 C ATOM 1561 CD LYS A 152 -25.975 6.103 9.248 1.00 8.73 C ATOM 1562 CE LYS A 152 -26.601 4.959 10.046 1.00 9.22 C ATOM 1563 NZ LYS A 152 -25.556 4.309 10.885 1.00 9.63 N ATOM 0 H LYS A 152 -25.217 9.581 6.162 1.00 6.06 H new ATOM 0 HA LYS A 152 -25.628 6.655 6.406 1.00 6.80 H new ATOM 0 HB2 LYS A 152 -25.592 8.470 8.307 1.00 7.59 H new ATOM 0 HB3 LYS A 152 -27.185 8.914 7.729 1.00 7.59 H new ATOM 0 HG2 LYS A 152 -27.780 7.293 9.315 1.00 7.87 H new ATOM 0 HG3 LYS A 152 -27.651 6.278 7.893 1.00 7.87 H new ATOM 0 HD2 LYS A 152 -25.288 5.706 8.500 1.00 8.73 H new ATOM 0 HD3 LYS A 152 -25.391 6.744 9.908 1.00 8.73 H new ATOM 0 HE2 LYS A 152 -27.405 5.339 10.677 1.00 9.22 H new ATOM 0 HE3 LYS A 152 -27.045 4.229 9.369 1.00 9.22 H new ATOM 0 HZ1 LYS A 152 -25.981 3.531 11.428 1.00 9.63 H new ATOM 0 HZ2 LYS A 152 -24.804 3.934 10.273 1.00 9.63 H new ATOM 0 HZ3 LYS A 152 -25.152 5.008 11.540 1.00 9.63 H new ATOM 1577 N LEU A 153 -28.483 7.771 6.042 1.00 7.34 N ATOM 1578 CA LEU A 153 -29.738 7.733 5.231 1.00 7.98 C ATOM 1579 C LEU A 153 -29.995 9.109 4.614 1.00 8.11 C ATOM 1580 O LEU A 153 -31.123 9.478 4.353 1.00 8.31 O ATOM 1581 CB LEU A 153 -30.925 7.363 6.126 1.00 8.45 C ATOM 1582 CG LEU A 153 -30.763 5.936 6.666 1.00 8.93 C ATOM 1583 CD1 LEU A 153 -31.850 5.671 7.712 1.00 9.23 C ATOM 1584 CD2 LEU A 153 -30.885 4.908 5.523 1.00 9.46 C ATOM 0 H LEU A 153 -28.617 7.947 7.038 1.00 7.34 H new ATOM 0 HA LEU A 153 -29.626 6.988 4.443 1.00 7.98 H new ATOM 0 HB2 LEU A 153 -30.997 8.067 6.955 1.00 8.45 H new ATOM 0 HB3 LEU A 153 -31.853 7.441 5.560 1.00 8.45 H new ATOM 0 HG LEU A 153 -29.776 5.836 7.118 1.00 8.93 H new ATOM 0 HD11 LEU A 153 -31.742 4.658 8.101 1.00 9.23 H new ATOM 0 HD12 LEU A 153 -31.751 6.386 8.529 1.00 9.23 H new ATOM 0 HD13 LEU A 153 -32.832 5.780 7.252 1.00 9.23 H new ATOM 0 HD21 LEU A 153 -30.767 3.902 5.925 1.00 9.46 H new ATOM 0 HD22 LEU A 153 -31.865 5.000 5.054 1.00 9.46 H new ATOM 0 HD23 LEU A 153 -30.109 5.095 4.781 1.00 9.46 H new ATOM 1596 N GLU A 154 -28.967 9.874 4.380 1.00 8.27 N ATOM 1597 CA GLU A 154 -29.175 11.223 3.781 1.00 8.64 C ATOM 1598 C GLU A 154 -29.533 11.070 2.303 1.00 8.97 C ATOM 1599 O GLU A 154 -29.318 10.035 1.706 1.00 9.31 O ATOM 1600 CB GLU A 154 -27.893 12.045 3.914 1.00 9.08 C ATOM 1601 CG GLU A 154 -27.704 12.459 5.374 1.00 9.38 C ATOM 1602 CD GLU A 154 -26.458 13.337 5.495 1.00 9.91 C ATOM 1603 OE1 GLU A 154 -25.375 12.785 5.586 1.00 10.18 O ATOM 1604 OE2 GLU A 154 -26.609 14.548 5.492 1.00 10.25 O ATOM 0 H GLU A 154 -27.997 9.627 4.576 1.00 8.27 H new ATOM 0 HA GLU A 154 -29.986 11.732 4.302 1.00 8.64 H new ATOM 0 HB2 GLU A 154 -27.037 11.461 3.576 1.00 9.08 H new ATOM 0 HB3 GLU A 154 -27.947 12.929 3.278 1.00 9.08 H new ATOM 0 HG2 GLU A 154 -28.581 13.002 5.726 1.00 9.38 H new ATOM 0 HG3 GLU A 154 -27.602 11.575 6.004 1.00 9.38 H new ATOM 1611 N GLU A 155 -30.084 12.092 1.706 1.00 9.09 N ATOM 1612 CA GLU A 155 -30.460 12.000 0.269 1.00 9.60 C ATOM 1613 C GLU A 155 -29.199 12.048 -0.595 1.00 9.70 C ATOM 1614 O GLU A 155 -28.352 12.902 -0.427 1.00 10.09 O ATOM 1615 CB GLU A 155 -31.380 13.172 -0.094 1.00 10.07 C ATOM 1616 CG GLU A 155 -31.690 13.154 -1.602 1.00 10.61 C ATOM 1617 CD GLU A 155 -30.582 13.878 -2.375 1.00 11.03 C ATOM 1618 OE1 GLU A 155 -30.629 15.095 -2.436 1.00 11.33 O ATOM 1619 OE2 GLU A 155 -29.708 13.202 -2.892 1.00 11.24 O ATOM 0 H GLU A 155 -30.289 12.986 2.152 1.00 9.09 H new ATOM 0 HA GLU A 155 -30.983 11.061 0.089 1.00 9.60 H new ATOM 0 HB2 GLU A 155 -32.307 13.107 0.476 1.00 10.07 H new ATOM 0 HB3 GLU A 155 -30.905 14.115 0.176 1.00 10.07 H new ATOM 0 HG2 GLU A 155 -31.776 12.125 -1.952 1.00 10.61 H new ATOM 0 HG3 GLU A 155 -32.650 13.635 -1.790 1.00 10.61 H new ATOM 1626 N ALA A 156 -29.068 11.134 -1.524 1.00 9.56 N ATOM 1627 CA ALA A 156 -27.860 11.117 -2.406 1.00 9.82 C ATOM 1628 C ALA A 156 -28.267 10.700 -3.819 1.00 9.59 C ATOM 1629 O ALA A 156 -28.104 9.562 -4.213 1.00 9.64 O ATOM 1630 CB ALA A 156 -26.843 10.115 -1.857 1.00 9.95 C ATOM 0 H ALA A 156 -29.748 10.397 -1.710 1.00 9.56 H new ATOM 0 HA ALA A 156 -27.416 12.112 -2.432 1.00 9.82 H new ATOM 0 HB1 ALA A 156 -25.962 10.102 -2.499 1.00 9.95 H new ATOM 0 HB2 ALA A 156 -26.552 10.408 -0.848 1.00 9.95 H new ATOM 0 HB3 ALA A 156 -27.289 9.121 -1.832 1.00 9.95 H new ATOM 1636 N ASN A 157 -28.794 11.613 -4.587 1.00 9.56 N ATOM 1637 CA ASN A 157 -29.208 11.273 -5.978 1.00 9.52 C ATOM 1638 C ASN A 157 -27.962 11.006 -6.823 1.00 9.04 C ATOM 1639 O ASN A 157 -28.037 10.464 -7.908 1.00 9.05 O ATOM 1640 CB ASN A 157 -29.993 12.446 -6.573 1.00 10.08 C ATOM 1641 CG ASN A 157 -30.691 11.999 -7.859 1.00 10.54 C ATOM 1642 OD1 ASN A 157 -31.591 11.183 -7.825 1.00 10.93 O ATOM 1643 ND2 ASN A 157 -30.311 12.503 -9.001 1.00 10.75 N ATOM 0 H ASN A 157 -28.956 12.582 -4.311 1.00 9.56 H new ATOM 0 HA ASN A 157 -29.838 10.383 -5.969 1.00 9.52 H new ATOM 0 HB2 ASN A 157 -30.729 12.806 -5.854 1.00 10.08 H new ATOM 0 HB3 ASN A 157 -29.320 13.277 -6.783 1.00 10.08 H new ATOM 0 HD21 ASN A 157 -30.769 12.212 -9.865 1.00 10.75 H new ATOM 0 HD22 ASN A 157 -29.556 13.188 -9.030 1.00 10.75 H new ATOM 1650 N LYS A 158 -26.815 11.379 -6.329 1.00 8.83 N ATOM 1651 CA LYS A 158 -25.556 11.148 -7.092 1.00 8.52 C ATOM 1652 C LYS A 158 -25.305 9.645 -7.222 1.00 8.03 C ATOM 1653 O LYS A 158 -26.207 8.840 -7.103 1.00 8.18 O ATOM 1654 CB LYS A 158 -24.390 11.794 -6.340 1.00 8.88 C ATOM 1655 CG LYS A 158 -24.338 11.234 -4.917 1.00 9.31 C ATOM 1656 CD LYS A 158 -23.291 11.995 -4.098 1.00 9.87 C ATOM 1657 CE LYS A 158 -23.510 11.715 -2.608 1.00 10.59 C ATOM 1658 NZ LYS A 158 -24.749 12.405 -2.156 1.00 10.96 N ATOM 0 H LYS A 158 -26.694 11.836 -5.425 1.00 8.83 H new ATOM 0 HA LYS A 158 -25.644 11.587 -8.086 1.00 8.52 H new ATOM 0 HB2 LYS A 158 -23.452 11.593 -6.857 1.00 8.88 H new ATOM 0 HB3 LYS A 158 -24.514 12.877 -6.313 1.00 8.88 H new ATOM 0 HG2 LYS A 158 -25.317 11.323 -4.445 1.00 9.31 H new ATOM 0 HG3 LYS A 158 -24.092 10.173 -4.943 1.00 9.31 H new ATOM 0 HD2 LYS A 158 -22.288 11.688 -4.394 1.00 9.87 H new ATOM 0 HD3 LYS A 158 -23.367 13.065 -4.294 1.00 9.87 H new ATOM 0 HE2 LYS A 158 -23.594 10.642 -2.436 1.00 10.59 H new ATOM 0 HE3 LYS A 158 -22.654 12.064 -2.031 1.00 10.59 H new ATOM 0 HZ1 LYS A 158 -25.155 11.894 -1.346 1.00 10.96 H new ATOM 0 HZ2 LYS A 158 -24.520 13.379 -1.872 1.00 10.96 H new ATOM 0 HZ3 LYS A 158 -25.439 12.425 -2.934 1.00 10.96 H new ATOM 1672 N ASP A 174 -24.078 9.265 -7.463 1.00 7.70 N ATOM 1673 CA ASP A 174 -23.742 7.816 -7.601 1.00 7.46 C ATOM 1674 C ASP A 174 -22.351 7.572 -7.008 1.00 6.93 C ATOM 1675 O ASP A 174 -21.731 8.469 -6.472 1.00 7.21 O ATOM 1676 CB ASP A 174 -23.740 7.434 -9.084 1.00 7.83 C ATOM 1677 CG ASP A 174 -23.697 5.911 -9.222 1.00 8.11 C ATOM 1678 OD1 ASP A 174 -24.708 5.282 -8.952 1.00 8.38 O ATOM 1679 OD2 ASP A 174 -22.656 5.399 -9.596 1.00 8.32 O ATOM 0 H ASP A 174 -23.288 9.901 -7.571 1.00 7.70 H new ATOM 0 HA ASP A 174 -24.480 7.211 -7.074 1.00 7.46 H new ATOM 0 HB2 ASP A 174 -24.631 7.828 -9.573 1.00 7.83 H new ATOM 0 HB3 ASP A 174 -22.879 7.879 -9.583 1.00 7.83 H new ATOM 1684 N ASP A 175 -21.857 6.367 -7.096 1.00 6.43 N ATOM 1685 CA ASP A 175 -20.506 6.073 -6.532 1.00 6.11 C ATOM 1686 C ASP A 175 -19.886 4.896 -7.287 1.00 5.51 C ATOM 1687 O ASP A 175 -19.733 3.817 -6.750 1.00 5.46 O ATOM 1688 CB ASP A 175 -20.637 5.716 -5.049 1.00 6.61 C ATOM 1689 CG ASP A 175 -20.986 6.974 -4.252 1.00 7.27 C ATOM 1690 OD1 ASP A 175 -20.259 7.946 -4.372 1.00 7.70 O ATOM 1691 OD2 ASP A 175 -21.974 6.944 -3.536 1.00 7.57 O ATOM 0 H ASP A 175 -22.328 5.574 -7.533 1.00 6.43 H new ATOM 0 HA ASP A 175 -19.869 6.951 -6.638 1.00 6.11 H new ATOM 0 HB2 ASP A 175 -21.410 4.960 -4.913 1.00 6.61 H new ATOM 0 HB3 ASP A 175 -19.704 5.288 -4.683 1.00 6.61 H new ATOM 1696 N PRO A 176 -19.529 5.106 -8.528 1.00 5.43 N ATOM 1697 CA PRO A 176 -18.913 4.053 -9.381 1.00 5.29 C ATOM 1698 C PRO A 176 -17.410 3.922 -9.116 1.00 4.96 C ATOM 1699 O PRO A 176 -16.906 2.848 -8.847 1.00 4.91 O ATOM 1700 CB PRO A 176 -19.178 4.562 -10.801 1.00 5.76 C ATOM 1701 CG PRO A 176 -19.164 6.054 -10.676 1.00 6.11 C ATOM 1702 CD PRO A 176 -19.671 6.378 -9.259 1.00 5.94 C ATOM 0 HA PRO A 176 -19.323 3.061 -9.193 1.00 5.29 H new ATOM 0 HB2 PRO A 176 -18.413 4.215 -11.496 1.00 5.76 H new ATOM 0 HB3 PRO A 176 -20.136 4.205 -11.178 1.00 5.76 H new ATOM 0 HG2 PRO A 176 -18.159 6.447 -10.828 1.00 6.11 H new ATOM 0 HG3 PRO A 176 -19.803 6.513 -11.431 1.00 6.11 H new ATOM 0 HD2 PRO A 176 -19.083 7.171 -8.797 1.00 5.94 H new ATOM 0 HD3 PRO A 176 -20.707 6.716 -9.274 1.00 5.94 H new ATOM 1710 N GLU A 177 -16.694 5.012 -9.179 1.00 5.10 N ATOM 1711 CA GLU A 177 -15.228 4.958 -8.920 1.00 5.19 C ATOM 1712 C GLU A 177 -14.987 4.901 -7.412 1.00 4.50 C ATOM 1713 O GLU A 177 -14.442 5.815 -6.827 1.00 4.75 O ATOM 1714 CB GLU A 177 -14.561 6.209 -9.500 1.00 6.10 C ATOM 1715 CG GLU A 177 -14.753 6.236 -11.019 1.00 6.79 C ATOM 1716 CD GLU A 177 -14.428 7.632 -11.554 1.00 7.52 C ATOM 1717 OE1 GLU A 177 -13.255 7.965 -11.607 1.00 7.81 O ATOM 1718 OE2 GLU A 177 -15.356 8.342 -11.903 1.00 8.01 O ATOM 0 H GLU A 177 -17.062 5.938 -9.399 1.00 5.10 H new ATOM 0 HA GLU A 177 -14.803 4.072 -9.392 1.00 5.19 H new ATOM 0 HB2 GLU A 177 -14.993 7.104 -9.053 1.00 6.10 H new ATOM 0 HB3 GLU A 177 -13.498 6.212 -9.257 1.00 6.10 H new ATOM 0 HG2 GLU A 177 -14.107 5.496 -11.490 1.00 6.79 H new ATOM 0 HG3 GLU A 177 -15.780 5.969 -11.271 1.00 6.79 H new ATOM 1725 N ARG A 178 -15.396 3.838 -6.774 1.00 3.95 N ATOM 1726 CA ARG A 178 -15.194 3.733 -5.302 1.00 3.61 C ATOM 1727 C ARG A 178 -13.743 3.340 -5.012 1.00 3.28 C ATOM 1728 O ARG A 178 -13.456 2.636 -4.064 1.00 3.07 O ATOM 1729 CB ARG A 178 -16.151 2.676 -4.728 1.00 3.75 C ATOM 1730 CG ARG A 178 -16.367 2.922 -3.231 1.00 4.06 C ATOM 1731 CD ARG A 178 -17.304 1.850 -2.668 1.00 4.58 C ATOM 1732 NE ARG A 178 -18.635 1.954 -3.329 1.00 5.19 N ATOM 1733 CZ ARG A 178 -19.492 0.971 -3.241 1.00 5.87 C ATOM 1734 NH1 ARG A 178 -19.180 -0.112 -2.583 1.00 6.06 N ATOM 1735 NH2 ARG A 178 -20.657 1.070 -3.817 1.00 6.66 N ATOM 0 H ARG A 178 -15.860 3.040 -7.208 1.00 3.95 H new ATOM 0 HA ARG A 178 -15.403 4.695 -4.834 1.00 3.61 H new ATOM 0 HB2 ARG A 178 -17.106 2.715 -5.253 1.00 3.75 H new ATOM 0 HB3 ARG A 178 -15.741 1.678 -4.886 1.00 3.75 H new ATOM 0 HG2 ARG A 178 -15.412 2.898 -2.706 1.00 4.06 H new ATOM 0 HG3 ARG A 178 -16.793 3.913 -3.072 1.00 4.06 H new ATOM 0 HD2 ARG A 178 -16.881 0.859 -2.833 1.00 4.58 H new ATOM 0 HD3 ARG A 178 -17.411 1.975 -1.590 1.00 4.58 H new ATOM 0 HE ARG A 178 -18.878 2.795 -3.852 1.00 5.19 H new ATOM 0 HH11 ARG A 178 -18.266 -0.192 -2.137 1.00 6.06 H new ATOM 0 HH12 ARG A 178 -19.850 -0.878 -2.515 1.00 6.06 H new ATOM 0 HH21 ARG A 178 -20.899 1.914 -4.336 1.00 6.66 H new ATOM 0 HH22 ARG A 178 -21.326 0.303 -3.749 1.00 6.66 H new ATOM 1749 N GLU A 179 -12.824 3.800 -5.817 1.00 3.66 N ATOM 1750 CA GLU A 179 -11.390 3.465 -5.583 1.00 3.59 C ATOM 1751 C GLU A 179 -10.868 4.319 -4.434 1.00 2.48 C ATOM 1752 O GLU A 179 -9.681 4.514 -4.269 1.00 2.75 O ATOM 1753 CB GLU A 179 -10.577 3.756 -6.847 1.00 4.67 C ATOM 1754 CG GLU A 179 -10.768 2.628 -7.866 1.00 5.63 C ATOM 1755 CD GLU A 179 -12.195 2.665 -8.411 1.00 6.37 C ATOM 1756 OE1 GLU A 179 -13.090 2.235 -7.703 1.00 6.71 O ATOM 1757 OE2 GLU A 179 -12.368 3.123 -9.528 1.00 6.87 O ATOM 0 H GLU A 179 -13.004 4.393 -6.627 1.00 3.66 H new ATOM 0 HA GLU A 179 -11.295 2.408 -5.335 1.00 3.59 H new ATOM 0 HB2 GLU A 179 -10.891 4.705 -7.280 1.00 4.67 H new ATOM 0 HB3 GLU A 179 -9.521 3.854 -6.595 1.00 4.67 H new ATOM 0 HG2 GLU A 179 -10.054 2.737 -8.682 1.00 5.63 H new ATOM 0 HG3 GLU A 179 -10.572 1.664 -7.397 1.00 5.63 H new ATOM 1764 N VAL A 180 -11.759 4.824 -3.640 1.00 1.65 N ATOM 1765 CA VAL A 180 -11.356 5.673 -2.485 1.00 0.77 C ATOM 1766 C VAL A 180 -11.076 4.770 -1.292 1.00 0.63 C ATOM 1767 O VAL A 180 -11.923 4.540 -0.451 1.00 0.64 O ATOM 1768 CB VAL A 180 -12.488 6.643 -2.170 1.00 1.22 C ATOM 1769 CG1 VAL A 180 -12.026 7.651 -1.121 1.00 2.08 C ATOM 1770 CG2 VAL A 180 -12.862 7.378 -3.454 1.00 1.28 C ATOM 0 H VAL A 180 -12.765 4.685 -3.740 1.00 1.65 H new ATOM 0 HA VAL A 180 -10.457 6.244 -2.718 1.00 0.77 H new ATOM 0 HB VAL A 180 -13.349 6.099 -1.782 1.00 1.22 H new ATOM 0 HG11 VAL A 180 -12.838 8.343 -0.899 1.00 2.08 H new ATOM 0 HG12 VAL A 180 -11.739 7.124 -0.211 1.00 2.08 H new ATOM 0 HG13 VAL A 180 -11.170 8.207 -1.503 1.00 2.08 H new ATOM 0 HG21 VAL A 180 -13.672 8.078 -3.250 1.00 1.28 H new ATOM 0 HG22 VAL A 180 -11.995 7.924 -3.826 1.00 1.28 H new ATOM 0 HG23 VAL A 180 -13.186 6.657 -4.205 1.00 1.28 H new ATOM 1780 N LEU A 181 -9.887 4.235 -1.243 1.00 0.58 N ATOM 1781 CA LEU A 181 -9.503 3.299 -0.133 1.00 0.52 C ATOM 1782 C LEU A 181 -8.390 3.900 0.731 1.00 0.47 C ATOM 1783 O LEU A 181 -7.513 4.586 0.248 1.00 0.51 O ATOM 1784 CB LEU A 181 -8.986 1.996 -0.750 1.00 0.60 C ATOM 1785 CG LEU A 181 -10.084 1.341 -1.625 1.00 0.74 C ATOM 1786 CD1 LEU A 181 -9.438 0.595 -2.802 1.00 0.95 C ATOM 1787 CD2 LEU A 181 -10.904 0.349 -0.784 1.00 0.87 C ATOM 0 H LEU A 181 -9.153 4.405 -1.930 1.00 0.58 H new ATOM 0 HA LEU A 181 -10.378 3.121 0.492 1.00 0.52 H new ATOM 0 HB2 LEU A 181 -8.102 2.198 -1.355 1.00 0.60 H new ATOM 0 HB3 LEU A 181 -8.682 1.308 0.039 1.00 0.60 H new ATOM 0 HG LEU A 181 -10.742 2.122 -2.006 1.00 0.74 H new ATOM 0 HD11 LEU A 181 -10.216 0.137 -3.413 1.00 0.95 H new ATOM 0 HD12 LEU A 181 -8.867 1.298 -3.409 1.00 0.95 H new ATOM 0 HD13 LEU A 181 -8.773 -0.180 -2.421 1.00 0.95 H new ATOM 0 HD21 LEU A 181 -11.674 -0.107 -1.407 1.00 0.87 H new ATOM 0 HD22 LEU A 181 -10.246 -0.427 -0.393 1.00 0.87 H new ATOM 0 HD23 LEU A 181 -11.374 0.877 0.045 1.00 0.87 H new ATOM 1799 N GLU A 182 -8.418 3.625 2.012 1.00 0.45 N ATOM 1800 CA GLU A 182 -7.365 4.145 2.941 1.00 0.45 C ATOM 1801 C GLU A 182 -6.453 3.002 3.395 1.00 0.42 C ATOM 1802 O GLU A 182 -6.902 1.969 3.855 1.00 0.43 O ATOM 1803 CB GLU A 182 -8.035 4.790 4.168 1.00 0.49 C ATOM 1804 CG GLU A 182 -9.302 4.004 4.556 1.00 0.56 C ATOM 1805 CD GLU A 182 -10.502 4.504 3.742 1.00 0.90 C ATOM 1806 OE1 GLU A 182 -10.709 3.999 2.652 1.00 1.62 O ATOM 1807 OE2 GLU A 182 -11.193 5.386 4.226 1.00 1.49 O ATOM 0 H GLU A 182 -9.135 3.055 2.460 1.00 0.45 H new ATOM 0 HA GLU A 182 -6.766 4.890 2.418 1.00 0.45 H new ATOM 0 HB2 GLU A 182 -7.338 4.807 5.006 1.00 0.49 H new ATOM 0 HB3 GLU A 182 -8.294 5.826 3.948 1.00 0.49 H new ATOM 0 HG2 GLU A 182 -9.149 2.940 4.376 1.00 0.56 H new ATOM 0 HG3 GLU A 182 -9.501 4.122 5.621 1.00 0.56 H new ATOM 1814 N TRP A 183 -5.166 3.206 3.283 1.00 0.40 N ATOM 1815 CA TRP A 183 -4.188 2.172 3.721 1.00 0.38 C ATOM 1816 C TRP A 183 -4.193 2.150 5.257 1.00 0.37 C ATOM 1817 O TRP A 183 -3.720 3.072 5.892 1.00 0.43 O ATOM 1818 CB TRP A 183 -2.788 2.572 3.212 1.00 0.41 C ATOM 1819 CG TRP A 183 -2.536 2.028 1.837 1.00 0.42 C ATOM 1820 CD1 TRP A 183 -2.457 0.715 1.518 1.00 0.52 C ATOM 1821 CD2 TRP A 183 -2.307 2.764 0.600 1.00 0.38 C ATOM 1822 NE1 TRP A 183 -2.189 0.599 0.164 1.00 0.53 N ATOM 1823 CE2 TRP A 183 -2.091 1.837 -0.447 1.00 0.44 C ATOM 1824 CE3 TRP A 183 -2.269 4.134 0.291 1.00 0.38 C ATOM 1825 CZ2 TRP A 183 -1.840 2.259 -1.757 1.00 0.44 C ATOM 1826 CZ3 TRP A 183 -2.019 4.561 -1.022 1.00 0.41 C ATOM 1827 CH2 TRP A 183 -1.804 3.626 -2.044 1.00 0.41 C ATOM 0 H TRP A 183 -4.749 4.055 2.902 1.00 0.40 H new ATOM 0 HA TRP A 183 -4.447 1.189 3.328 1.00 0.38 H new ATOM 0 HB2 TRP A 183 -2.700 3.658 3.198 1.00 0.41 H new ATOM 0 HB3 TRP A 183 -2.028 2.199 3.899 1.00 0.41 H new ATOM 0 HD1 TRP A 183 -2.582 -0.108 2.206 1.00 0.52 H new ATOM 0 HE1 TRP A 183 -2.077 -0.290 -0.323 1.00 0.53 H new ATOM 0 HE3 TRP A 183 -2.433 4.864 1.070 1.00 0.38 H new ATOM 0 HZ2 TRP A 183 -1.675 1.534 -2.540 1.00 0.44 H new ATOM 0 HZ3 TRP A 183 -1.992 5.617 -1.247 1.00 0.41 H new ATOM 0 HH2 TRP A 183 -1.611 3.962 -3.052 1.00 0.41 H new ATOM 1838 N ARG A 184 -4.731 1.121 5.865 1.00 0.35 N ATOM 1839 CA ARG A 184 -4.766 1.079 7.361 1.00 0.35 C ATOM 1840 C ARG A 184 -3.543 0.332 7.888 1.00 0.31 C ATOM 1841 O ARG A 184 -3.475 -0.881 7.845 1.00 0.31 O ATOM 1842 CB ARG A 184 -6.038 0.365 7.829 1.00 0.40 C ATOM 1843 CG ARG A 184 -6.063 0.334 9.360 1.00 0.98 C ATOM 1844 CD ARG A 184 -7.464 -0.042 9.854 1.00 1.51 C ATOM 1845 NE ARG A 184 -8.335 1.167 9.822 1.00 1.57 N ATOM 1846 CZ ARG A 184 -9.625 1.048 9.976 1.00 2.13 C ATOM 1847 NH1 ARG A 184 -10.154 -0.125 10.192 1.00 2.82 N ATOM 1848 NH2 ARG A 184 -10.387 2.107 9.922 1.00 2.61 N ATOM 0 H ARG A 184 -5.144 0.315 5.396 1.00 0.35 H new ATOM 0 HA ARG A 184 -4.759 2.099 7.745 1.00 0.35 H new ATOM 0 HB2 ARG A 184 -6.920 0.881 7.449 1.00 0.40 H new ATOM 0 HB3 ARG A 184 -6.067 -0.650 7.432 1.00 0.40 H new ATOM 0 HG2 ARG A 184 -5.333 -0.386 9.729 1.00 0.98 H new ATOM 0 HG3 ARG A 184 -5.778 1.309 9.756 1.00 0.98 H new ATOM 0 HD2 ARG A 184 -7.886 -0.826 9.225 1.00 1.51 H new ATOM 0 HD3 ARG A 184 -7.411 -0.440 10.867 1.00 1.51 H new ATOM 0 HE ARG A 184 -7.922 2.089 9.680 1.00 1.57 H new ATOM 0 HH11 ARG A 184 -9.559 -0.952 10.241 1.00 2.82 H new ATOM 0 HH12 ARG A 184 -11.163 -0.215 10.312 1.00 2.82 H new ATOM 0 HH21 ARG A 184 -9.973 3.025 9.760 1.00 2.61 H new ATOM 0 HH22 ARG A 184 -11.396 2.016 10.042 1.00 2.61 H new ATOM 1862 N PHE A 185 -2.576 1.053 8.382 1.00 0.31 N ATOM 1863 CA PHE A 185 -1.347 0.397 8.914 1.00 0.31 C ATOM 1864 C PHE A 185 -1.667 -0.352 10.215 1.00 0.31 C ATOM 1865 O PHE A 185 -2.293 0.176 11.113 1.00 0.37 O ATOM 1866 CB PHE A 185 -0.288 1.467 9.189 1.00 0.40 C ATOM 1867 CG PHE A 185 0.925 0.835 9.833 1.00 0.44 C ATOM 1868 CD1 PHE A 185 0.930 0.568 11.207 1.00 0.65 C ATOM 1869 CD2 PHE A 185 2.048 0.526 9.056 1.00 0.62 C ATOM 1870 CE1 PHE A 185 2.058 -0.010 11.803 1.00 0.75 C ATOM 1871 CE2 PHE A 185 3.174 -0.050 9.652 1.00 0.74 C ATOM 1872 CZ PHE A 185 3.179 -0.319 11.024 1.00 0.71 C ATOM 0 H PHE A 185 -2.583 2.071 8.441 1.00 0.31 H new ATOM 0 HA PHE A 185 -0.974 -0.316 8.179 1.00 0.31 H new ATOM 0 HB2 PHE A 185 -0.003 1.957 8.258 1.00 0.40 H new ATOM 0 HB3 PHE A 185 -0.698 2.238 9.842 1.00 0.40 H new ATOM 0 HD1 PHE A 185 0.065 0.808 11.807 1.00 0.65 H new ATOM 0 HD2 PHE A 185 2.044 0.733 7.996 1.00 0.62 H new ATOM 0 HE1 PHE A 185 2.063 -0.217 12.863 1.00 0.75 H new ATOM 0 HE2 PHE A 185 4.040 -0.287 9.052 1.00 0.74 H new ATOM 0 HZ PHE A 185 4.049 -0.766 11.483 1.00 0.71 H new ATOM 1882 N ASP A 186 -1.237 -1.581 10.318 1.00 0.28 N ATOM 1883 CA ASP A 186 -1.500 -2.381 11.544 1.00 0.32 C ATOM 1884 C ASP A 186 -0.410 -3.451 11.675 1.00 0.30 C ATOM 1885 O ASP A 186 -0.619 -4.604 11.351 1.00 0.32 O ATOM 1886 CB ASP A 186 -2.866 -3.047 11.400 1.00 0.37 C ATOM 1887 CG ASP A 186 -3.376 -3.496 12.773 1.00 0.47 C ATOM 1888 OD1 ASP A 186 -2.553 -3.708 13.649 1.00 1.23 O ATOM 1889 OD2 ASP A 186 -4.580 -3.620 12.925 1.00 1.16 O ATOM 0 H ASP A 186 -0.708 -2.068 9.595 1.00 0.28 H new ATOM 0 HA ASP A 186 -1.493 -1.747 12.430 1.00 0.32 H new ATOM 0 HB2 ASP A 186 -3.574 -2.351 10.950 1.00 0.37 H new ATOM 0 HB3 ASP A 186 -2.793 -3.905 10.731 1.00 0.37 H new ATOM 1894 N SER A 187 0.759 -3.070 12.119 1.00 0.33 N ATOM 1895 CA SER A 187 1.885 -4.049 12.249 1.00 0.34 C ATOM 1896 C SER A 187 1.411 -5.316 12.974 1.00 0.35 C ATOM 1897 O SER A 187 2.141 -6.283 13.079 1.00 0.37 O ATOM 1898 CB SER A 187 3.019 -3.410 13.056 1.00 0.40 C ATOM 1899 OG SER A 187 3.757 -4.429 13.720 1.00 1.32 O ATOM 0 H SER A 187 0.986 -2.116 12.400 1.00 0.33 H new ATOM 0 HA SER A 187 2.235 -4.317 11.252 1.00 0.34 H new ATOM 0 HB2 SER A 187 3.675 -2.842 12.396 1.00 0.40 H new ATOM 0 HB3 SER A 187 2.612 -2.707 13.783 1.00 0.40 H new ATOM 0 HG SER A 187 3.563 -5.296 13.306 1.00 1.32 H new ATOM 1905 N ARG A 188 0.208 -5.327 13.480 1.00 0.40 N ATOM 1906 CA ARG A 188 -0.282 -6.535 14.199 1.00 0.46 C ATOM 1907 C ARG A 188 -0.275 -7.734 13.246 1.00 0.42 C ATOM 1908 O ARG A 188 -0.107 -8.864 13.658 1.00 0.43 O ATOM 1909 CB ARG A 188 -1.707 -6.286 14.693 1.00 0.58 C ATOM 1910 CG ARG A 188 -2.222 -7.534 15.409 1.00 1.40 C ATOM 1911 CD ARG A 188 -3.507 -7.195 16.168 1.00 1.75 C ATOM 1912 NE ARG A 188 -3.267 -6.044 17.105 1.00 2.37 N ATOM 1913 CZ ARG A 188 -2.370 -6.102 18.056 1.00 2.99 C ATOM 1914 NH1 ARG A 188 -1.754 -7.222 18.320 1.00 3.19 N ATOM 1915 NH2 ARG A 188 -2.121 -5.044 18.779 1.00 3.87 N ATOM 0 H ARG A 188 -0.455 -4.553 13.426 1.00 0.40 H new ATOM 0 HA ARG A 188 0.368 -6.743 15.049 1.00 0.46 H new ATOM 0 HB2 ARG A 188 -1.725 -5.432 15.370 1.00 0.58 H new ATOM 0 HB3 ARG A 188 -2.357 -6.041 13.853 1.00 0.58 H new ATOM 0 HG2 ARG A 188 -2.413 -8.328 14.687 1.00 1.40 H new ATOM 0 HG3 ARG A 188 -1.467 -7.907 16.101 1.00 1.40 H new ATOM 0 HD2 ARG A 188 -4.298 -6.941 15.463 1.00 1.75 H new ATOM 0 HD3 ARG A 188 -3.847 -8.065 16.729 1.00 1.75 H new ATOM 0 HE ARG A 188 -3.819 -5.193 16.996 1.00 2.37 H new ATOM 0 HH11 ARG A 188 -1.970 -8.062 17.783 1.00 3.19 H new ATOM 0 HH12 ARG A 188 -1.056 -7.257 19.063 1.00 3.19 H new ATOM 0 HH21 ARG A 188 -2.625 -4.175 18.602 1.00 3.87 H new ATOM 0 HH22 ARG A 188 -1.422 -5.086 19.521 1.00 3.87 H new ATOM 1929 N LEU A 189 -0.439 -7.495 11.974 1.00 0.43 N ATOM 1930 CA LEU A 189 -0.423 -8.619 10.996 1.00 0.46 C ATOM 1931 C LEU A 189 0.947 -9.304 11.077 1.00 0.41 C ATOM 1932 O LEU A 189 1.190 -10.320 10.456 1.00 0.46 O ATOM 1933 CB LEU A 189 -0.667 -8.058 9.576 1.00 0.57 C ATOM 1934 CG LEU A 189 -1.524 -9.026 8.745 1.00 1.05 C ATOM 1935 CD1 LEU A 189 -1.810 -8.404 7.376 1.00 1.46 C ATOM 1936 CD2 LEU A 189 -0.775 -10.349 8.552 1.00 1.78 C ATOM 0 H LEU A 189 -0.583 -6.570 11.570 1.00 0.43 H new ATOM 0 HA LEU A 189 -1.206 -9.343 11.222 1.00 0.46 H new ATOM 0 HB2 LEU A 189 -1.165 -7.091 9.643 1.00 0.57 H new ATOM 0 HB3 LEU A 189 0.288 -7.891 9.077 1.00 0.57 H new ATOM 0 HG LEU A 189 -2.461 -9.215 9.268 1.00 1.05 H new ATOM 0 HD11 LEU A 189 -2.418 -9.089 6.785 1.00 1.46 H new ATOM 0 HD12 LEU A 189 -2.347 -7.465 7.508 1.00 1.46 H new ATOM 0 HD13 LEU A 189 -0.869 -8.215 6.859 1.00 1.46 H new ATOM 0 HD21 LEU A 189 -1.387 -11.031 7.962 1.00 1.78 H new ATOM 0 HD22 LEU A 189 0.164 -10.163 8.032 1.00 1.78 H new ATOM 0 HD23 LEU A 189 -0.569 -10.796 9.525 1.00 1.78 H new ATOM 1948 N ALA A 190 1.845 -8.751 11.845 1.00 0.37 N ATOM 1949 CA ALA A 190 3.194 -9.363 11.971 1.00 0.42 C ATOM 1950 C ALA A 190 3.098 -10.601 12.862 1.00 0.44 C ATOM 1951 O ALA A 190 4.081 -11.266 13.121 1.00 0.53 O ATOM 1952 CB ALA A 190 4.153 -8.351 12.601 1.00 0.47 C ATOM 0 H ALA A 190 1.701 -7.901 12.390 1.00 0.37 H new ATOM 0 HA ALA A 190 3.565 -9.648 10.987 1.00 0.42 H new ATOM 0 HB1 ALA A 190 5.143 -8.797 12.695 1.00 0.47 H new ATOM 0 HB2 ALA A 190 4.213 -7.465 11.970 1.00 0.47 H new ATOM 0 HB3 ALA A 190 3.787 -8.069 13.588 1.00 0.47 H new ATOM 1958 N PHE A 191 1.914 -10.912 13.336 1.00 0.42 N ATOM 1959 CA PHE A 191 1.740 -12.110 14.219 1.00 0.51 C ATOM 1960 C PHE A 191 0.464 -12.869 13.832 1.00 0.56 C ATOM 1961 O PHE A 191 0.519 -13.945 13.271 1.00 0.96 O ATOM 1962 CB PHE A 191 1.631 -11.653 15.677 1.00 0.58 C ATOM 1963 CG PHE A 191 2.936 -11.030 16.112 1.00 1.14 C ATOM 1964 CD1 PHE A 191 3.968 -11.837 16.603 1.00 1.81 C ATOM 1965 CD2 PHE A 191 3.112 -9.644 16.024 1.00 1.98 C ATOM 1966 CE1 PHE A 191 5.177 -11.258 17.007 1.00 2.75 C ATOM 1967 CE2 PHE A 191 4.320 -9.064 16.428 1.00 2.87 C ATOM 1968 CZ PHE A 191 5.354 -9.871 16.919 1.00 3.15 C ATOM 0 H PHE A 191 1.060 -10.387 13.149 1.00 0.42 H new ATOM 0 HA PHE A 191 2.600 -12.769 14.098 1.00 0.51 H new ATOM 0 HB2 PHE A 191 0.820 -10.933 15.783 1.00 0.58 H new ATOM 0 HB3 PHE A 191 1.390 -12.501 16.317 1.00 0.58 H new ATOM 0 HD1 PHE A 191 3.832 -12.906 16.670 1.00 1.81 H new ATOM 0 HD2 PHE A 191 2.315 -9.022 15.644 1.00 1.98 H new ATOM 0 HE1 PHE A 191 5.973 -11.881 17.387 1.00 2.75 H new ATOM 0 HE2 PHE A 191 4.455 -7.995 16.361 1.00 2.87 H new ATOM 0 HZ PHE A 191 6.287 -9.424 17.230 1.00 3.15 H new ATOM 1978 N HIS A 192 -0.684 -12.325 14.139 1.00 0.64 N ATOM 1979 CA HIS A 192 -1.956 -13.028 13.799 1.00 0.72 C ATOM 1980 C HIS A 192 -2.212 -12.946 12.294 1.00 0.67 C ATOM 1981 O HIS A 192 -2.555 -11.905 11.770 1.00 1.26 O ATOM 1982 CB HIS A 192 -3.122 -12.366 14.540 1.00 1.01 C ATOM 1983 CG HIS A 192 -2.758 -12.158 15.985 1.00 1.62 C ATOM 1984 ND1 HIS A 192 -2.899 -10.929 16.610 1.00 2.46 N ATOM 1985 CD2 HIS A 192 -2.268 -13.012 16.942 1.00 2.48 C ATOM 1986 CE1 HIS A 192 -2.502 -11.077 17.887 1.00 3.29 C ATOM 1987 NE2 HIS A 192 -2.106 -12.327 18.142 1.00 3.35 N ATOM 0 H HIS A 192 -0.796 -11.427 14.609 1.00 0.64 H new ATOM 0 HA HIS A 192 -1.873 -14.073 14.097 1.00 0.72 H new ATOM 0 HB2 HIS A 192 -3.364 -11.410 14.076 1.00 1.01 H new ATOM 0 HB3 HIS A 192 -4.012 -12.990 14.466 1.00 1.01 H new ATOM 0 HD2 HIS A 192 -2.043 -14.057 16.787 1.00 2.48 H new ATOM 0 HE1 HIS A 192 -2.503 -10.281 18.617 1.00 3.29 H new ATOM 0 HE2 HIS A 192 -1.759 -12.699 19.026 1.00 3.35 H new ATOM 1995 N HIS A 193 -2.063 -14.038 11.591 1.00 0.77 N ATOM 1996 CA HIS A 193 -2.313 -14.017 10.121 1.00 0.85 C ATOM 1997 C HIS A 193 -3.810 -14.218 9.868 1.00 0.74 C ATOM 1998 O HIS A 193 -4.297 -15.330 9.814 1.00 0.78 O ATOM 1999 CB HIS A 193 -1.516 -15.138 9.443 1.00 1.28 C ATOM 2000 CG HIS A 193 -1.580 -16.386 10.280 1.00 2.09 C ATOM 2001 ND1 HIS A 193 -2.600 -16.622 11.188 1.00 2.84 N ATOM 2002 CD2 HIS A 193 -0.753 -17.479 10.354 1.00 2.99 C ATOM 2003 CE1 HIS A 193 -2.364 -17.816 11.763 1.00 3.75 C ATOM 2004 NE2 HIS A 193 -1.249 -18.381 11.290 1.00 3.87 N ATOM 0 H HIS A 193 -1.780 -14.941 11.971 1.00 0.77 H new ATOM 0 HA HIS A 193 -1.996 -13.060 9.708 1.00 0.85 H new ATOM 0 HB2 HIS A 193 -1.920 -15.334 8.450 1.00 1.28 H new ATOM 0 HB3 HIS A 193 -0.479 -14.831 9.311 1.00 1.28 H new ATOM 0 HD1 HIS A 193 -3.387 -16.003 11.385 1.00 2.84 H new ATOM 0 HD2 HIS A 193 0.147 -17.618 9.773 1.00 2.99 H new ATOM 0 HE1 HIS A 193 -2.998 -18.263 12.515 1.00 3.75 H new ATOM 2012 N MET A 194 -4.541 -13.147 9.723 1.00 0.73 N ATOM 2013 CA MET A 194 -6.008 -13.268 9.485 1.00 0.79 C ATOM 2014 C MET A 194 -6.272 -13.767 8.062 1.00 0.75 C ATOM 2015 O MET A 194 -7.087 -14.640 7.844 1.00 0.90 O ATOM 2016 CB MET A 194 -6.665 -11.895 9.659 1.00 0.91 C ATOM 2017 CG MET A 194 -6.292 -11.312 11.024 1.00 1.47 C ATOM 2018 SD MET A 194 -7.385 -9.914 11.403 1.00 2.35 S ATOM 2019 CE MET A 194 -8.501 -10.771 12.544 1.00 2.94 C ATOM 0 H MET A 194 -4.185 -12.192 9.759 1.00 0.73 H new ATOM 0 HA MET A 194 -6.425 -13.978 10.200 1.00 0.79 H new ATOM 0 HB2 MET A 194 -6.340 -11.223 8.865 1.00 0.91 H new ATOM 0 HB3 MET A 194 -7.748 -11.987 9.576 1.00 0.91 H new ATOM 0 HG2 MET A 194 -6.382 -12.077 11.795 1.00 1.47 H new ATOM 0 HG3 MET A 194 -5.252 -10.984 11.020 1.00 1.47 H new ATOM 0 HE1 MET A 194 -9.262 -10.076 12.900 1.00 2.94 H new ATOM 0 HE2 MET A 194 -8.982 -11.602 12.028 1.00 2.94 H new ATOM 0 HE3 MET A 194 -7.932 -11.151 13.392 1.00 2.94 H new ATOM 2029 N ALA A 195 -5.597 -13.206 7.094 1.00 0.66 N ATOM 2030 CA ALA A 195 -5.815 -13.621 5.675 1.00 0.76 C ATOM 2031 C ALA A 195 -5.914 -15.148 5.568 1.00 0.90 C ATOM 2032 O ALA A 195 -6.522 -15.674 4.657 1.00 1.11 O ATOM 2033 CB ALA A 195 -4.646 -13.117 4.821 1.00 0.82 C ATOM 0 H ALA A 195 -4.899 -12.473 7.225 1.00 0.66 H new ATOM 0 HA ALA A 195 -6.750 -13.190 5.317 1.00 0.76 H new ATOM 0 HB1 ALA A 195 -4.798 -13.416 3.784 1.00 0.82 H new ATOM 0 HB2 ALA A 195 -4.593 -12.030 4.881 1.00 0.82 H new ATOM 0 HB3 ALA A 195 -3.714 -13.546 5.190 1.00 0.82 H new ATOM 2039 N ARG A 196 -5.329 -15.864 6.488 1.00 0.89 N ATOM 2040 CA ARG A 196 -5.402 -17.353 6.421 1.00 1.09 C ATOM 2041 C ARG A 196 -6.827 -17.809 6.758 1.00 1.21 C ATOM 2042 O ARG A 196 -7.353 -18.725 6.158 1.00 1.44 O ATOM 2043 CB ARG A 196 -4.414 -17.956 7.427 1.00 1.11 C ATOM 2044 CG ARG A 196 -4.245 -19.457 7.159 1.00 1.34 C ATOM 2045 CD ARG A 196 -3.054 -19.996 7.959 1.00 1.43 C ATOM 2046 NE ARG A 196 -2.735 -21.382 7.516 1.00 1.90 N ATOM 2047 CZ ARG A 196 -1.574 -21.909 7.804 1.00 2.46 C ATOM 2048 NH1 ARG A 196 -0.690 -21.216 8.469 1.00 2.75 N ATOM 2049 NH2 ARG A 196 -1.295 -23.126 7.425 1.00 3.31 N ATOM 0 H ARG A 196 -4.807 -15.487 7.279 1.00 0.89 H new ATOM 0 HA ARG A 196 -5.144 -17.688 5.416 1.00 1.09 H new ATOM 0 HB2 ARG A 196 -3.450 -17.453 7.349 1.00 1.11 H new ATOM 0 HB3 ARG A 196 -4.775 -17.798 8.443 1.00 1.11 H new ATOM 0 HG2 ARG A 196 -5.154 -19.990 7.438 1.00 1.34 H new ATOM 0 HG3 ARG A 196 -4.088 -19.630 6.094 1.00 1.34 H new ATOM 0 HD2 ARG A 196 -2.187 -19.351 7.818 1.00 1.43 H new ATOM 0 HD3 ARG A 196 -3.286 -19.989 9.024 1.00 1.43 H new ATOM 0 HE ARG A 196 -3.422 -21.920 6.988 1.00 1.90 H new ATOM 0 HH11 ARG A 196 -0.905 -20.264 8.764 1.00 2.75 H new ATOM 0 HH12 ARG A 196 0.216 -21.627 8.694 1.00 2.75 H new ATOM 0 HH21 ARG A 196 -1.983 -23.668 6.903 1.00 3.31 H new ATOM 0 HH22 ARG A 196 -0.388 -23.535 7.651 1.00 3.31 H new ATOM 2063 N GLU A 197 -7.451 -17.180 7.717 1.00 1.18 N ATOM 2064 CA GLU A 197 -8.838 -17.577 8.098 1.00 1.45 C ATOM 2065 C GLU A 197 -9.832 -17.141 7.017 1.00 1.53 C ATOM 2066 O GLU A 197 -10.938 -17.639 6.945 1.00 1.76 O ATOM 2067 CB GLU A 197 -9.211 -16.905 9.420 1.00 1.53 C ATOM 2068 CG GLU A 197 -8.267 -17.387 10.521 1.00 1.99 C ATOM 2069 CD GLU A 197 -8.571 -18.850 10.849 1.00 2.56 C ATOM 2070 OE1 GLU A 197 -9.727 -19.154 11.094 1.00 3.13 O ATOM 2071 OE2 GLU A 197 -7.642 -19.641 10.852 1.00 3.04 O ATOM 0 H GLU A 197 -7.060 -16.407 8.255 1.00 1.18 H new ATOM 0 HA GLU A 197 -8.878 -18.661 8.204 1.00 1.45 H new ATOM 0 HB2 GLU A 197 -9.147 -15.821 9.320 1.00 1.53 H new ATOM 0 HB3 GLU A 197 -10.243 -17.141 9.682 1.00 1.53 H new ATOM 0 HG2 GLU A 197 -7.231 -17.283 10.198 1.00 1.99 H new ATOM 0 HG3 GLU A 197 -8.386 -16.771 11.412 1.00 1.99 H new ATOM 2078 N LEU A 198 -9.459 -16.208 6.188 1.00 1.41 N ATOM 2079 CA LEU A 198 -10.399 -15.737 5.131 1.00 1.56 C ATOM 2080 C LEU A 198 -10.483 -16.777 4.005 1.00 1.70 C ATOM 2081 O LEU A 198 -11.508 -17.398 3.804 1.00 1.95 O ATOM 2082 CB LEU A 198 -9.910 -14.388 4.572 1.00 1.47 C ATOM 2083 CG LEU A 198 -10.433 -13.237 5.444 1.00 1.53 C ATOM 2084 CD1 LEU A 198 -9.886 -13.374 6.866 1.00 1.82 C ATOM 2085 CD2 LEU A 198 -9.974 -11.902 4.858 1.00 1.83 C ATOM 0 H LEU A 198 -8.547 -15.751 6.195 1.00 1.41 H new ATOM 0 HA LEU A 198 -11.392 -15.607 5.562 1.00 1.56 H new ATOM 0 HB2 LEU A 198 -8.820 -14.369 4.546 1.00 1.47 H new ATOM 0 HB3 LEU A 198 -10.256 -14.264 3.546 1.00 1.47 H new ATOM 0 HG LEU A 198 -11.522 -13.275 5.468 1.00 1.53 H new ATOM 0 HD11 LEU A 198 -10.260 -12.555 7.480 1.00 1.82 H new ATOM 0 HD12 LEU A 198 -10.211 -14.324 7.291 1.00 1.82 H new ATOM 0 HD13 LEU A 198 -8.797 -13.341 6.842 1.00 1.82 H new ATOM 0 HD21 LEU A 198 -10.346 -11.086 5.477 1.00 1.83 H new ATOM 0 HD22 LEU A 198 -8.885 -11.871 4.832 1.00 1.83 H new ATOM 0 HD23 LEU A 198 -10.364 -11.796 3.846 1.00 1.83 H new ATOM 2097 N HIS A 199 -9.425 -16.966 3.260 1.00 1.61 N ATOM 2098 CA HIS A 199 -9.468 -17.959 2.142 1.00 1.79 C ATOM 2099 C HIS A 199 -8.080 -18.585 1.943 1.00 1.68 C ATOM 2100 O HIS A 199 -7.309 -18.127 1.124 1.00 1.85 O ATOM 2101 CB HIS A 199 -9.882 -17.245 0.853 1.00 2.06 C ATOM 2102 CG HIS A 199 -11.053 -16.347 1.137 1.00 2.04 C ATOM 2103 ND1 HIS A 199 -12.319 -16.848 1.384 1.00 2.62 N ATOM 2104 CD2 HIS A 199 -11.167 -14.981 1.221 1.00 2.05 C ATOM 2105 CE1 HIS A 199 -13.134 -15.802 1.605 1.00 2.96 C ATOM 2106 NE2 HIS A 199 -12.482 -14.639 1.517 1.00 2.51 N ATOM 0 H HIS A 199 -8.536 -16.479 3.375 1.00 1.61 H new ATOM 0 HA HIS A 199 -10.186 -18.742 2.385 1.00 1.79 H new ATOM 0 HB2 HIS A 199 -9.048 -16.662 0.463 1.00 2.06 H new ATOM 0 HB3 HIS A 199 -10.146 -17.975 0.088 1.00 2.06 H new ATOM 0 HD2 HIS A 199 -10.358 -14.279 1.079 1.00 2.05 H new ATOM 0 HE1 HIS A 199 -14.187 -15.891 1.827 1.00 2.96 H new ATOM 0 HE2 HIS A 199 -12.866 -13.702 1.640 1.00 2.51 H new ATOM 2114 N PRO A 200 -7.755 -19.619 2.683 1.00 1.59 N ATOM 2115 CA PRO A 200 -6.431 -20.293 2.565 1.00 1.65 C ATOM 2116 C PRO A 200 -6.362 -21.263 1.374 1.00 1.89 C ATOM 2117 O PRO A 200 -5.297 -21.693 0.979 1.00 2.44 O ATOM 2118 CB PRO A 200 -6.295 -21.037 3.898 1.00 1.85 C ATOM 2119 CG PRO A 200 -7.700 -21.360 4.306 1.00 1.95 C ATOM 2120 CD PRO A 200 -8.599 -20.260 3.714 1.00 1.72 C ATOM 0 HA PRO A 200 -5.625 -19.584 2.379 1.00 1.65 H new ATOM 0 HB2 PRO A 200 -5.698 -21.942 3.786 1.00 1.85 H new ATOM 0 HB3 PRO A 200 -5.799 -20.419 4.646 1.00 1.85 H new ATOM 0 HG2 PRO A 200 -7.994 -22.341 3.934 1.00 1.95 H new ATOM 0 HG3 PRO A 200 -7.790 -21.390 5.392 1.00 1.95 H new ATOM 0 HD2 PRO A 200 -9.508 -20.678 3.281 1.00 1.72 H new ATOM 0 HD3 PRO A 200 -8.909 -19.545 4.476 1.00 1.72 H new ATOM 2128 N GLU A 201 -7.482 -21.612 0.798 1.00 1.95 N ATOM 2129 CA GLU A 201 -7.454 -22.550 -0.362 1.00 2.41 C ATOM 2130 C GLU A 201 -6.558 -21.972 -1.462 1.00 2.20 C ATOM 2131 O GLU A 201 -6.155 -22.667 -2.374 1.00 2.62 O ATOM 2132 CB GLU A 201 -8.879 -22.749 -0.910 1.00 2.93 C ATOM 2133 CG GLU A 201 -9.655 -21.416 -0.881 1.00 3.65 C ATOM 2134 CD GLU A 201 -10.357 -21.245 0.471 1.00 4.31 C ATOM 2135 OE1 GLU A 201 -10.029 -21.985 1.385 1.00 4.64 O ATOM 2136 OE2 GLU A 201 -11.212 -20.379 0.568 1.00 4.86 O ATOM 0 H GLU A 201 -8.409 -21.291 1.078 1.00 1.95 H new ATOM 0 HA GLU A 201 -7.059 -23.513 -0.036 1.00 2.41 H new ATOM 0 HB2 GLU A 201 -8.834 -23.129 -1.931 1.00 2.93 H new ATOM 0 HB3 GLU A 201 -9.404 -23.496 -0.315 1.00 2.93 H new ATOM 0 HG2 GLU A 201 -8.971 -20.584 -1.052 1.00 3.65 H new ATOM 0 HG3 GLU A 201 -10.389 -21.396 -1.686 1.00 3.65 H new ATOM 2143 N TYR A 202 -6.246 -20.707 -1.386 1.00 1.91 N ATOM 2144 CA TYR A 202 -5.380 -20.088 -2.432 1.00 2.02 C ATOM 2145 C TYR A 202 -3.917 -20.463 -2.177 1.00 2.17 C ATOM 2146 O TYR A 202 -3.149 -20.653 -3.099 1.00 2.63 O ATOM 2147 CB TYR A 202 -5.538 -18.565 -2.384 1.00 2.25 C ATOM 2148 CG TYR A 202 -6.844 -18.170 -3.035 1.00 2.62 C ATOM 2149 CD1 TYR A 202 -6.917 -18.025 -4.426 1.00 3.00 C ATOM 2150 CD2 TYR A 202 -7.980 -17.949 -2.247 1.00 2.97 C ATOM 2151 CE1 TYR A 202 -8.127 -17.659 -5.029 1.00 3.60 C ATOM 2152 CE2 TYR A 202 -9.188 -17.581 -2.850 1.00 3.63 C ATOM 2153 CZ TYR A 202 -9.262 -17.437 -4.240 1.00 3.90 C ATOM 2154 OH TYR A 202 -10.454 -17.074 -4.833 1.00 4.66 O ATOM 0 H TYR A 202 -6.552 -20.075 -0.646 1.00 1.91 H new ATOM 0 HA TYR A 202 -5.677 -20.454 -3.415 1.00 2.02 H new ATOM 0 HB2 TYR A 202 -5.516 -18.219 -1.350 1.00 2.25 H new ATOM 0 HB3 TYR A 202 -4.704 -18.086 -2.898 1.00 2.25 H new ATOM 0 HD1 TYR A 202 -6.041 -18.195 -5.034 1.00 3.00 H new ATOM 0 HD2 TYR A 202 -7.924 -18.062 -1.174 1.00 2.97 H new ATOM 0 HE1 TYR A 202 -8.184 -17.548 -6.102 1.00 3.60 H new ATOM 0 HE2 TYR A 202 -10.064 -17.408 -2.242 1.00 3.63 H new ATOM 0 HH TYR A 202 -11.141 -16.960 -4.144 1.00 4.66 H new ATOM 2164 N PHE A 203 -3.522 -20.574 -0.935 1.00 2.24 N ATOM 2165 CA PHE A 203 -2.107 -20.942 -0.629 1.00 2.91 C ATOM 2166 C PHE A 203 -1.992 -22.466 -0.544 1.00 3.51 C ATOM 2167 O PHE A 203 -2.687 -23.189 -1.233 1.00 4.00 O ATOM 2168 CB PHE A 203 -1.695 -20.331 0.710 1.00 3.09 C ATOM 2169 CG PHE A 203 -2.088 -18.869 0.745 1.00 2.66 C ATOM 2170 CD1 PHE A 203 -1.569 -17.982 -0.205 1.00 2.71 C ATOM 2171 CD2 PHE A 203 -2.965 -18.400 1.732 1.00 2.55 C ATOM 2172 CE1 PHE A 203 -1.927 -16.629 -0.171 1.00 2.44 C ATOM 2173 CE2 PHE A 203 -3.324 -17.047 1.768 1.00 2.24 C ATOM 2174 CZ PHE A 203 -2.804 -16.160 0.817 1.00 2.05 C ATOM 0 H PHE A 203 -4.117 -20.426 -0.120 1.00 2.24 H new ATOM 0 HA PHE A 203 -1.455 -20.564 -1.416 1.00 2.91 H new ATOM 0 HB2 PHE A 203 -2.176 -20.867 1.529 1.00 3.09 H new ATOM 0 HB3 PHE A 203 -0.619 -20.432 0.851 1.00 3.09 H new ATOM 0 HD1 PHE A 203 -0.891 -18.342 -0.965 1.00 2.71 H new ATOM 0 HD2 PHE A 203 -3.365 -19.083 2.466 1.00 2.55 H new ATOM 0 HE1 PHE A 203 -1.527 -15.946 -0.906 1.00 2.44 H new ATOM 0 HE2 PHE A 203 -4.001 -16.688 2.529 1.00 2.24 H new ATOM 0 HZ PHE A 203 -3.078 -15.116 0.845 1.00 2.05 H new ATOM 2184 N LYS A 204 -1.123 -22.964 0.295 1.00 3.84 N ATOM 2185 CA LYS A 204 -0.972 -24.443 0.417 1.00 4.59 C ATOM 2186 C LYS A 204 -2.071 -24.992 1.331 1.00 5.09 C ATOM 2187 O LYS A 204 -2.519 -24.330 2.247 1.00 5.47 O ATOM 2188 CB LYS A 204 0.405 -24.775 1.008 1.00 5.01 C ATOM 2189 CG LYS A 204 0.493 -24.266 2.449 1.00 5.49 C ATOM 2190 CD LYS A 204 1.935 -24.396 2.943 1.00 6.17 C ATOM 2191 CE LYS A 204 2.007 -24.000 4.418 1.00 6.89 C ATOM 2192 NZ LYS A 204 1.698 -22.549 4.557 1.00 7.32 N ATOM 0 H LYS A 204 -0.513 -22.413 0.899 1.00 3.84 H new ATOM 0 HA LYS A 204 -1.058 -24.899 -0.569 1.00 4.59 H new ATOM 0 HB2 LYS A 204 0.570 -25.852 0.983 1.00 5.01 H new ATOM 0 HB3 LYS A 204 1.189 -24.318 0.404 1.00 5.01 H new ATOM 0 HG2 LYS A 204 0.171 -23.226 2.500 1.00 5.49 H new ATOM 0 HG3 LYS A 204 -0.177 -24.839 3.091 1.00 5.49 H new ATOM 0 HD2 LYS A 204 2.284 -25.420 2.813 1.00 6.17 H new ATOM 0 HD3 LYS A 204 2.592 -23.758 2.352 1.00 6.17 H new ATOM 0 HE2 LYS A 204 1.299 -24.591 4.999 1.00 6.89 H new ATOM 0 HE3 LYS A 204 3.000 -24.211 4.814 1.00 6.89 H new ATOM 0 HZ1 LYS A 204 2.004 -22.217 5.494 1.00 7.32 H new ATOM 0 HZ2 LYS A 204 2.200 -22.015 3.819 1.00 7.32 H new ATOM 0 HZ3 LYS A 204 0.674 -22.401 4.455 1.00 7.32 H new ATOM 2206 N ASN A 205 -2.511 -26.196 1.085 1.00 5.49 N ATOM 2207 CA ASN A 205 -3.582 -26.790 1.934 1.00 6.31 C ATOM 2208 C ASN A 205 -3.056 -26.991 3.358 1.00 6.66 C ATOM 2209 O ASN A 205 -2.275 -26.206 3.859 1.00 6.90 O ATOM 2210 CB ASN A 205 -4.002 -28.140 1.347 1.00 6.97 C ATOM 2211 CG ASN A 205 -4.269 -27.986 -0.152 1.00 7.47 C ATOM 2212 OD1 ASN A 205 -4.563 -26.808 -0.632 1.00 7.58 O flip ATOM 2213 ND2 ASN A 205 -4.211 -28.947 -0.894 1.00 8.08 N flip ATOM 0 H ASN A 205 -2.174 -26.795 0.331 1.00 5.49 H new ATOM 0 HA ASN A 205 -4.441 -26.120 1.959 1.00 6.31 H new ATOM 0 HB2 ASN A 205 -3.219 -28.880 1.513 1.00 6.97 H new ATOM 0 HB3 ASN A 205 -4.897 -28.505 1.851 1.00 6.97 H new ATOM 0 HD21 ASN A 205 -3.981 -29.867 -0.519 1.00 8.08 H new ATOM 0 HD22 ASN A 205 -4.392 -28.833 -1.891 1.00 8.08 H new ATOM 2220 N ALA A 206 -3.480 -28.037 4.013 1.00 7.01 N ATOM 2221 CA ALA A 206 -3.009 -28.292 5.404 1.00 7.67 C ATOM 2222 C ALA A 206 -1.635 -28.964 5.360 1.00 7.99 C ATOM 2223 O ALA A 206 -0.965 -28.833 4.350 1.00 8.32 O ATOM 2224 CB ALA A 206 -4.002 -29.213 6.115 1.00 8.33 C ATOM 2225 OXT ALA A 206 -1.276 -29.599 6.338 1.00 8.16 O ATOM 0 H ALA A 206 -4.134 -28.728 3.644 1.00 7.01 H new ATOM 0 HA ALA A 206 -2.936 -27.348 5.943 1.00 7.67 H new ATOM 0 HB1 ALA A 206 -3.660 -29.401 7.133 1.00 8.33 H new ATOM 0 HB2 ALA A 206 -4.982 -28.738 6.144 1.00 8.33 H new ATOM 0 HB3 ALA A 206 -4.073 -30.158 5.576 1.00 8.33 H new TER 2231 ALA A 206