USER MOD reduce.3.24.130724 H: found=0, std=0, add=1138, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1136 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 68 ASN : amide:sc= 0.433 K(o=1.1,f=-0.91) USER MOD Set 1.2: A 81 ASN : amide:sc= 0.699 K(o=1.1,f=-2.6!) USER MOD Set 2.1: A 26 THR OG1 : rot 180:sc= 0.37 USER MOD Set 2.2: A 27 ASN : amide:sc= 0.0488 X(o=0.42,f=0.76) USER MOD Single : A 1 GLY N :NH3+ -103:sc= 0.015 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 129:sc= 0.393 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 GLN : amide:sc= -3.25! C(o=-3.2!,f=-11!) USER MOD Single : A 14 CYS SG : rot 180:sc= -0.0143 USER MOD Single : A 16 GLN : amide:sc= -0.53 X(o=-0.53,f=-0.083) USER MOD Single : A 20 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 21 CYS SG : rot 74:sc= -3.18! USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 HIS : no HD1:sc= -12.7! C(o=-13!,f=-13!) USER MOD Single : A 31 THR OG1 : rot -76:sc= 1.06 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= 0 K(o=0,f=-0.77) USER MOD Single : A 42 GLN : amide:sc= -11.9! C(o=-12!,f=-9.8!) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 CYS SG : rot 120:sc= -3.24! USER MOD Single : A 52 GLN : amide:sc= -0.0106 K(o=-0.011,f=-3.2!) USER MOD Single : A 55 ASN : amide:sc= -2.55! C(o=-2.6!,f=-17!) USER MOD Single : A 56 ASN : amide:sc= -1.27 X(o=-1.3,f=-0.78) USER MOD Single : A 60 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 61 SER OG : rot 86:sc= 0.113 USER MOD Single : A 63 ASN : amide:sc= -0.0156 K(o=-0.016,f=-2) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 GLN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 73 MET CE :methyl 148:sc= -0.111 (180deg=-0.676) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=-0.0053) USER MOD Single : A 78 CYS SG : rot 180:sc= -0.0178 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 THR OG1 : rot 71:sc= 0.965 USER MOD Single : A 89 CYS SG : rot 180:sc= -0.0925 USER MOD Single : A 90 CYS SG : rot -21:sc= 0.211 USER MOD Single : A 92 THR OG1 : rot -80:sc= 0 USER MOD Single : A 95 MET CE :methyl 178:sc= 0 (180deg=-0.00904) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 114 LYS NZ :NH3+ 163:sc= -0.0291 (180deg=-0.286) USER MOD Single : A 118 THR OG1 : rot 95:sc= 1.09 USER MOD Single : A 120 SER OG : rot 37:sc= 1.43 USER MOD Single : A 123 SER OG : rot -105:sc= 1.22 USER MOD Single : A 125 THR OG1 : rot -77:sc= 1.25 USER MOD Single : A 131 THR OG1 : rot -67:sc= -0.537 USER MOD Single : A 138 SER OG : rot 35:sc= 0.566 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 142 SER OG : rot 170:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 19.613 -2.757 17.119 1.00 0.00 N ATOM 2 CA GLY A 1 18.548 -2.201 17.933 1.00 0.00 C ATOM 3 C GLY A 1 17.172 -2.488 17.364 1.00 0.00 C ATOM 4 O GLY A 1 16.999 -2.558 16.147 1.00 0.00 O ATOM 0 H1 GLY A 1 19.978 -3.621 17.568 1.00 0.00 H new ATOM 0 H2 GLY A 1 19.244 -2.987 16.174 1.00 0.00 H new ATOM 0 H3 GLY A 1 20.381 -2.062 17.030 1.00 0.00 H new ATOM 0 HA2 GLY A 1 18.614 -2.611 18.941 1.00 0.00 H new ATOM 0 HA3 GLY A 1 18.685 -1.123 18.018 1.00 0.00 H new ATOM 8 N SER A 2 16.192 -2.657 18.245 1.00 0.00 N ATOM 9 CA SER A 2 14.826 -2.945 17.824 1.00 0.00 C ATOM 10 C SER A 2 13.970 -1.682 17.860 1.00 0.00 C ATOM 11 O SER A 2 13.364 -1.301 16.858 1.00 0.00 O ATOM 12 CB SER A 2 14.209 -4.019 18.721 1.00 0.00 C ATOM 13 OG SER A 2 14.847 -5.270 18.531 1.00 0.00 O ATOM 0 H SER A 2 16.318 -2.599 19.256 1.00 0.00 H new ATOM 0 HA SER A 2 14.857 -3.313 16.799 1.00 0.00 H new ATOM 0 HB2 SER A 2 14.295 -3.718 19.765 1.00 0.00 H new ATOM 0 HB3 SER A 2 13.145 -4.113 18.502 1.00 0.00 H new ATOM 0 HG SER A 2 14.436 -5.939 19.117 1.00 0.00 H new ATOM 19 N SER A 3 13.925 -1.039 19.022 1.00 0.00 N ATOM 20 CA SER A 3 13.140 0.179 19.191 1.00 0.00 C ATOM 21 C SER A 3 13.590 1.257 18.210 1.00 0.00 C ATOM 22 O SER A 3 12.794 1.769 17.424 1.00 0.00 O ATOM 23 CB SER A 3 13.263 0.695 20.626 1.00 0.00 C ATOM 24 OG SER A 3 12.170 1.531 20.963 1.00 0.00 O ATOM 0 H SER A 3 14.422 -1.340 19.860 1.00 0.00 H new ATOM 0 HA SER A 3 12.096 -0.060 18.986 1.00 0.00 H new ATOM 0 HB2 SER A 3 13.307 -0.148 21.316 1.00 0.00 H new ATOM 0 HB3 SER A 3 14.196 1.248 20.738 1.00 0.00 H new ATOM 0 HG SER A 3 12.271 1.846 21.885 1.00 0.00 H new ATOM 30 N GLY A 4 14.875 1.596 18.262 1.00 0.00 N ATOM 31 CA GLY A 4 15.411 2.611 17.374 1.00 0.00 C ATOM 32 C GLY A 4 16.157 2.015 16.196 1.00 0.00 C ATOM 33 O GLY A 4 17.331 1.664 16.310 1.00 0.00 O ATOM 0 H GLY A 4 15.554 1.186 18.903 1.00 0.00 H new ATOM 0 HA2 GLY A 4 14.596 3.235 17.006 1.00 0.00 H new ATOM 0 HA3 GLY A 4 16.083 3.262 17.934 1.00 0.00 H new ATOM 37 N SER A 5 15.474 1.899 15.062 1.00 0.00 N ATOM 38 CA SER A 5 16.078 1.337 13.860 1.00 0.00 C ATOM 39 C SER A 5 17.394 2.037 13.534 1.00 0.00 C ATOM 40 O SER A 5 17.507 3.256 13.655 1.00 0.00 O ATOM 41 CB SER A 5 15.116 1.458 12.676 1.00 0.00 C ATOM 42 OG SER A 5 14.816 2.815 12.400 1.00 0.00 O ATOM 0 H SER A 5 14.502 2.187 14.950 1.00 0.00 H new ATOM 0 HA SER A 5 16.284 0.283 14.046 1.00 0.00 H new ATOM 0 HB2 SER A 5 15.559 0.994 11.795 1.00 0.00 H new ATOM 0 HB3 SER A 5 14.196 0.916 12.894 1.00 0.00 H new ATOM 0 HG SER A 5 14.958 2.994 11.447 1.00 0.00 H new ATOM 48 N SER A 6 18.386 1.255 13.121 1.00 0.00 N ATOM 49 CA SER A 6 19.696 1.798 12.782 1.00 0.00 C ATOM 50 C SER A 6 20.072 1.452 11.344 1.00 0.00 C ATOM 51 O SER A 6 20.284 0.287 11.009 1.00 0.00 O ATOM 52 CB SER A 6 20.759 1.260 13.742 1.00 0.00 C ATOM 53 OG SER A 6 20.436 1.571 15.087 1.00 0.00 O ATOM 0 H SER A 6 18.308 0.244 13.013 1.00 0.00 H new ATOM 0 HA SER A 6 19.647 2.883 12.876 1.00 0.00 H new ATOM 0 HB2 SER A 6 20.845 0.180 13.626 1.00 0.00 H new ATOM 0 HB3 SER A 6 21.730 1.686 13.490 1.00 0.00 H new ATOM 0 HG SER A 6 21.130 1.215 15.681 1.00 0.00 H new ATOM 59 N GLY A 7 20.152 2.474 10.498 1.00 0.00 N ATOM 60 CA GLY A 7 20.502 2.258 9.106 1.00 0.00 C ATOM 61 C GLY A 7 19.580 2.998 8.156 1.00 0.00 C ATOM 62 O GLY A 7 19.832 4.151 7.809 1.00 0.00 O ATOM 0 H GLY A 7 19.981 3.447 10.751 1.00 0.00 H new ATOM 0 HA2 GLY A 7 21.529 2.583 8.938 1.00 0.00 H new ATOM 0 HA3 GLY A 7 20.465 1.191 8.886 1.00 0.00 H new ATOM 66 N MET A 8 18.512 2.331 7.732 1.00 0.00 N ATOM 67 CA MET A 8 17.550 2.932 6.815 1.00 0.00 C ATOM 68 C MET A 8 16.126 2.521 7.174 1.00 0.00 C ATOM 69 O MET A 8 15.842 1.339 7.364 1.00 0.00 O ATOM 70 CB MET A 8 17.864 2.525 5.374 1.00 0.00 C ATOM 71 CG MET A 8 17.006 3.238 4.341 1.00 0.00 C ATOM 72 SD MET A 8 17.737 4.787 3.780 1.00 0.00 S ATOM 73 CE MET A 8 17.989 4.433 2.042 1.00 0.00 C ATOM 0 H MET A 8 18.291 1.374 8.008 1.00 0.00 H new ATOM 0 HA MET A 8 17.629 4.015 6.904 1.00 0.00 H new ATOM 0 HB2 MET A 8 18.914 2.732 5.167 1.00 0.00 H new ATOM 0 HB3 MET A 8 17.724 1.449 5.270 1.00 0.00 H new ATOM 0 HG2 MET A 8 16.855 2.581 3.484 1.00 0.00 H new ATOM 0 HG3 MET A 8 16.023 3.438 4.767 1.00 0.00 H new ATOM 0 HE1 MET A 8 18.437 5.300 1.555 1.00 0.00 H new ATOM 0 HE2 MET A 8 18.653 3.575 1.938 1.00 0.00 H new ATOM 0 HE3 MET A 8 17.031 4.209 1.574 1.00 0.00 H new ATOM 83 N GLU A 9 15.236 3.504 7.265 1.00 0.00 N ATOM 84 CA GLU A 9 13.841 3.241 7.603 1.00 0.00 C ATOM 85 C GLU A 9 13.234 2.217 6.648 1.00 0.00 C ATOM 86 O GLU A 9 13.670 2.060 5.508 1.00 0.00 O ATOM 87 CB GLU A 9 13.031 4.538 7.560 1.00 0.00 C ATOM 88 CG GLU A 9 13.485 5.574 8.575 1.00 0.00 C ATOM 89 CD GLU A 9 13.530 5.025 9.988 1.00 0.00 C ATOM 90 OE1 GLU A 9 12.450 4.830 10.583 1.00 0.00 O ATOM 91 OE2 GLU A 9 14.645 4.791 10.498 1.00 0.00 O ATOM 0 H GLU A 9 15.455 4.488 7.110 1.00 0.00 H new ATOM 0 HA GLU A 9 13.808 2.834 8.613 1.00 0.00 H new ATOM 0 HB2 GLU A 9 13.100 4.967 6.560 1.00 0.00 H new ATOM 0 HB3 GLU A 9 11.980 4.306 7.735 1.00 0.00 H new ATOM 0 HG2 GLU A 9 14.475 5.938 8.299 1.00 0.00 H new ATOM 0 HG3 GLU A 9 12.810 6.429 8.543 1.00 0.00 H new ATOM 98 N PRO A 10 12.203 1.504 7.125 1.00 0.00 N ATOM 99 CA PRO A 10 11.513 0.482 6.331 1.00 0.00 C ATOM 100 C PRO A 10 10.696 1.086 5.194 1.00 0.00 C ATOM 101 O PRO A 10 10.540 0.474 4.137 1.00 0.00 O ATOM 102 CB PRO A 10 10.593 -0.196 7.349 1.00 0.00 C ATOM 103 CG PRO A 10 10.362 0.836 8.398 1.00 0.00 C ATOM 104 CD PRO A 10 11.631 1.639 8.475 1.00 0.00 C ATOM 0 HA PRO A 10 12.212 -0.200 5.847 1.00 0.00 H new ATOM 0 HB2 PRO A 10 9.656 -0.509 6.889 1.00 0.00 H new ATOM 0 HB3 PRO A 10 11.056 -1.089 7.768 1.00 0.00 H new ATOM 0 HG2 PRO A 10 9.514 1.470 8.141 1.00 0.00 H new ATOM 0 HG3 PRO A 10 10.134 0.373 9.358 1.00 0.00 H new ATOM 0 HD2 PRO A 10 11.432 2.681 8.725 1.00 0.00 H new ATOM 0 HD3 PRO A 10 12.306 1.251 9.238 1.00 0.00 H new ATOM 112 N TRP A 11 10.179 2.288 5.417 1.00 0.00 N ATOM 113 CA TRP A 11 9.378 2.974 4.410 1.00 0.00 C ATOM 114 C TRP A 11 10.265 3.568 3.321 1.00 0.00 C ATOM 115 O TRP A 11 10.010 3.385 2.130 1.00 0.00 O ATOM 116 CB TRP A 11 8.539 4.077 5.059 1.00 0.00 C ATOM 117 CG TRP A 11 9.280 5.370 5.219 1.00 0.00 C ATOM 118 CD1 TRP A 11 10.091 5.726 6.259 1.00 0.00 C ATOM 119 CD2 TRP A 11 9.277 6.478 4.313 1.00 0.00 C ATOM 120 NE1 TRP A 11 10.591 6.989 6.053 1.00 0.00 N ATOM 121 CE2 TRP A 11 10.108 7.472 4.866 1.00 0.00 C ATOM 122 CE3 TRP A 11 8.655 6.726 3.086 1.00 0.00 C ATOM 123 CZ2 TRP A 11 10.329 8.693 4.235 1.00 0.00 C ATOM 124 CZ3 TRP A 11 8.875 7.939 2.461 1.00 0.00 C ATOM 125 CH2 TRP A 11 9.707 8.909 3.035 1.00 0.00 C ATOM 0 H TRP A 11 10.300 2.808 6.286 1.00 0.00 H new ATOM 0 HA TRP A 11 8.712 2.243 3.952 1.00 0.00 H new ATOM 0 HB2 TRP A 11 7.648 4.249 4.455 1.00 0.00 H new ATOM 0 HB3 TRP A 11 8.200 3.737 6.038 1.00 0.00 H new ATOM 0 HD1 TRP A 11 10.307 5.106 7.117 1.00 0.00 H new ATOM 0 HE1 TRP A 11 11.220 7.487 6.683 1.00 0.00 H new ATOM 0 HE3 TRP A 11 8.014 5.983 2.634 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 10.968 9.443 4.677 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 8.397 8.142 1.514 1.00 0.00 H new ATOM 0 HH2 TRP A 11 9.861 9.846 2.520 1.00 0.00 H new ATOM 136 N LYS A 12 11.307 4.280 3.735 1.00 0.00 N ATOM 137 CA LYS A 12 12.234 4.900 2.795 1.00 0.00 C ATOM 138 C LYS A 12 12.497 3.982 1.606 1.00 0.00 C ATOM 139 O LYS A 12 12.258 4.355 0.458 1.00 0.00 O ATOM 140 CB LYS A 12 13.552 5.237 3.495 1.00 0.00 C ATOM 141 CG LYS A 12 13.420 6.317 4.555 1.00 0.00 C ATOM 142 CD LYS A 12 13.661 7.700 3.975 1.00 0.00 C ATOM 143 CE LYS A 12 12.961 7.873 2.635 1.00 0.00 C ATOM 144 NZ LYS A 12 13.233 9.209 2.036 1.00 0.00 N ATOM 0 H LYS A 12 11.531 4.442 4.717 1.00 0.00 H new ATOM 0 HA LYS A 12 11.780 5.820 2.427 1.00 0.00 H new ATOM 0 HB2 LYS A 12 13.950 4.333 3.957 1.00 0.00 H new ATOM 0 HB3 LYS A 12 14.278 5.559 2.749 1.00 0.00 H new ATOM 0 HG2 LYS A 12 12.424 6.275 4.996 1.00 0.00 H new ATOM 0 HG3 LYS A 12 14.133 6.129 5.358 1.00 0.00 H new ATOM 0 HD2 LYS A 12 13.303 8.456 4.674 1.00 0.00 H new ATOM 0 HD3 LYS A 12 14.732 7.862 3.851 1.00 0.00 H new ATOM 0 HE2 LYS A 12 13.292 7.093 1.949 1.00 0.00 H new ATOM 0 HE3 LYS A 12 11.887 7.746 2.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 12.739 9.288 1.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 12.894 9.953 2.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 14.256 9.320 1.886 1.00 0.00 H new ATOM 158 N GLN A 13 12.990 2.780 1.889 1.00 0.00 N ATOM 159 CA GLN A 13 13.285 1.810 0.842 1.00 0.00 C ATOM 160 C GLN A 13 12.006 1.358 0.143 1.00 0.00 C ATOM 161 O GLN A 13 12.006 1.094 -1.060 1.00 0.00 O ATOM 162 CB GLN A 13 14.013 0.600 1.429 1.00 0.00 C ATOM 163 CG GLN A 13 13.295 -0.028 2.613 1.00 0.00 C ATOM 164 CD GLN A 13 12.377 -1.163 2.203 1.00 0.00 C ATOM 165 OE1 GLN A 13 11.204 -0.948 1.896 1.00 0.00 O ATOM 166 NE2 GLN A 13 12.907 -2.380 2.196 1.00 0.00 N ATOM 0 H GLN A 13 13.193 2.455 2.834 1.00 0.00 H new ATOM 0 HA GLN A 13 13.929 2.292 0.107 1.00 0.00 H new ATOM 0 HB2 GLN A 13 14.137 -0.152 0.650 1.00 0.00 H new ATOM 0 HB3 GLN A 13 15.012 0.904 1.741 1.00 0.00 H new ATOM 0 HG2 GLN A 13 14.032 -0.401 3.324 1.00 0.00 H new ATOM 0 HG3 GLN A 13 12.714 0.737 3.128 1.00 0.00 H new ATOM 0 HE21 GLN A 13 13.884 -2.512 2.458 1.00 0.00 H new ATOM 0 HE22 GLN A 13 12.337 -3.183 1.929 1.00 0.00 H new ATOM 175 N CYS A 14 10.921 1.272 0.903 1.00 0.00 N ATOM 176 CA CYS A 14 9.636 0.851 0.357 1.00 0.00 C ATOM 177 C CYS A 14 9.254 1.701 -0.851 1.00 0.00 C ATOM 178 O CYS A 14 8.799 1.181 -1.869 1.00 0.00 O ATOM 179 CB CYS A 14 8.547 0.947 1.427 1.00 0.00 C ATOM 180 SG CYS A 14 6.963 0.228 0.934 1.00 0.00 S ATOM 0 H CYS A 14 10.905 1.488 1.900 1.00 0.00 H new ATOM 0 HA CYS A 14 9.729 -0.186 0.035 1.00 0.00 H new ATOM 0 HB2 CYS A 14 8.895 0.447 2.331 1.00 0.00 H new ATOM 0 HB3 CYS A 14 8.394 1.996 1.682 1.00 0.00 H new ATOM 0 HG CYS A 14 6.108 0.356 1.905 1.00 0.00 H new ATOM 186 N ALA A 15 9.442 3.011 -0.729 1.00 0.00 N ATOM 187 CA ALA A 15 9.117 3.933 -1.811 1.00 0.00 C ATOM 188 C ALA A 15 9.618 3.404 -3.151 1.00 0.00 C ATOM 189 O ALA A 15 8.881 3.388 -4.136 1.00 0.00 O ATOM 190 CB ALA A 15 9.708 5.306 -1.529 1.00 0.00 C ATOM 0 H ALA A 15 9.817 3.458 0.108 1.00 0.00 H new ATOM 0 HA ALA A 15 8.032 4.021 -1.867 1.00 0.00 H new ATOM 0 HB1 ALA A 15 9.458 5.984 -2.345 1.00 0.00 H new ATOM 0 HB2 ALA A 15 9.299 5.694 -0.596 1.00 0.00 H new ATOM 0 HB3 ALA A 15 10.792 5.225 -1.444 1.00 0.00 H new ATOM 196 N GLN A 16 10.875 2.974 -3.180 1.00 0.00 N ATOM 197 CA GLN A 16 11.474 2.446 -4.400 1.00 0.00 C ATOM 198 C GLN A 16 10.566 1.404 -5.045 1.00 0.00 C ATOM 199 O GLN A 16 10.160 1.548 -6.198 1.00 0.00 O ATOM 200 CB GLN A 16 12.842 1.833 -4.099 1.00 0.00 C ATOM 201 CG GLN A 16 13.826 2.813 -3.481 1.00 0.00 C ATOM 202 CD GLN A 16 14.240 3.908 -4.444 1.00 0.00 C ATOM 203 OE1 GLN A 16 15.305 3.840 -5.059 1.00 0.00 O ATOM 204 NE2 GLN A 16 13.399 4.926 -4.582 1.00 0.00 N ATOM 0 H GLN A 16 11.498 2.981 -2.373 1.00 0.00 H new ATOM 0 HA GLN A 16 11.602 3.272 -5.099 1.00 0.00 H new ATOM 0 HB2 GLN A 16 12.711 0.988 -3.423 1.00 0.00 H new ATOM 0 HB3 GLN A 16 13.266 1.440 -5.023 1.00 0.00 H new ATOM 0 HG2 GLN A 16 13.377 3.263 -2.596 1.00 0.00 H new ATOM 0 HG3 GLN A 16 14.712 2.272 -3.149 1.00 0.00 H new ATOM 0 HE21 GLN A 16 12.527 4.942 -4.053 1.00 0.00 H new ATOM 0 HE22 GLN A 16 13.625 5.692 -5.217 1.00 0.00 H new ATOM 213 N TRP A 17 10.253 0.354 -4.294 1.00 0.00 N ATOM 214 CA TRP A 17 9.394 -0.714 -4.793 1.00 0.00 C ATOM 215 C TRP A 17 8.132 -0.143 -5.430 1.00 0.00 C ATOM 216 O TRP A 17 7.736 -0.554 -6.522 1.00 0.00 O ATOM 217 CB TRP A 17 9.020 -1.668 -3.657 1.00 0.00 C ATOM 218 CG TRP A 17 8.285 -2.888 -4.124 1.00 0.00 C ATOM 219 CD1 TRP A 17 8.756 -3.857 -4.964 1.00 0.00 C ATOM 220 CD2 TRP A 17 6.949 -3.267 -3.779 1.00 0.00 C ATOM 221 NE1 TRP A 17 7.792 -4.816 -5.162 1.00 0.00 N ATOM 222 CE2 TRP A 17 6.674 -4.478 -4.446 1.00 0.00 C ATOM 223 CE3 TRP A 17 5.958 -2.703 -2.971 1.00 0.00 C ATOM 224 CZ2 TRP A 17 5.450 -5.131 -4.328 1.00 0.00 C ATOM 225 CZ3 TRP A 17 4.743 -3.353 -2.856 1.00 0.00 C ATOM 226 CH2 TRP A 17 4.498 -4.556 -3.530 1.00 0.00 C ATOM 0 H TRP A 17 10.581 0.219 -3.338 1.00 0.00 H new ATOM 0 HA TRP A 17 9.946 -1.266 -5.554 1.00 0.00 H new ATOM 0 HB2 TRP A 17 9.927 -1.976 -3.137 1.00 0.00 H new ATOM 0 HB3 TRP A 17 8.403 -1.136 -2.933 1.00 0.00 H new ATOM 0 HD1 TRP A 17 9.741 -3.868 -5.407 1.00 0.00 H new ATOM 0 HE1 TRP A 17 7.893 -5.645 -5.747 1.00 0.00 H new ATOM 0 HE3 TRP A 17 6.138 -1.776 -2.446 1.00 0.00 H new ATOM 0 HZ2 TRP A 17 5.258 -6.058 -4.848 1.00 0.00 H new ATOM 0 HZ3 TRP A 17 3.969 -2.925 -2.235 1.00 0.00 H new ATOM 0 HH2 TRP A 17 3.539 -5.040 -3.418 1.00 0.00 H new ATOM 237 N LEU A 18 7.504 0.805 -4.743 1.00 0.00 N ATOM 238 CA LEU A 18 6.286 1.432 -5.244 1.00 0.00 C ATOM 239 C LEU A 18 6.508 2.024 -6.631 1.00 0.00 C ATOM 240 O LEU A 18 5.762 1.735 -7.567 1.00 0.00 O ATOM 241 CB LEU A 18 5.818 2.524 -4.279 1.00 0.00 C ATOM 242 CG LEU A 18 5.265 2.042 -2.938 1.00 0.00 C ATOM 243 CD1 LEU A 18 5.049 3.217 -1.996 1.00 0.00 C ATOM 244 CD2 LEU A 18 3.967 1.274 -3.140 1.00 0.00 C ATOM 0 H LEU A 18 7.818 1.156 -3.838 1.00 0.00 H new ATOM 0 HA LEU A 18 5.515 0.665 -5.317 1.00 0.00 H new ATOM 0 HB2 LEU A 18 6.656 3.193 -4.084 1.00 0.00 H new ATOM 0 HB3 LEU A 18 5.048 3.114 -4.776 1.00 0.00 H new ATOM 0 HG LEU A 18 5.995 1.370 -2.487 1.00 0.00 H new ATOM 0 HD11 LEU A 18 4.655 2.854 -1.047 1.00 0.00 H new ATOM 0 HD12 LEU A 18 5.998 3.725 -1.825 1.00 0.00 H new ATOM 0 HD13 LEU A 18 4.339 3.914 -2.441 1.00 0.00 H new ATOM 0 HD21 LEU A 18 3.588 0.939 -2.174 1.00 0.00 H new ATOM 0 HD22 LEU A 18 3.230 1.923 -3.613 1.00 0.00 H new ATOM 0 HD23 LEU A 18 4.151 0.409 -3.777 1.00 0.00 H new ATOM 256 N ILE A 19 7.540 2.852 -6.757 1.00 0.00 N ATOM 257 CA ILE A 19 7.862 3.483 -8.031 1.00 0.00 C ATOM 258 C ILE A 19 7.984 2.445 -9.142 1.00 0.00 C ATOM 259 O ILE A 19 7.489 2.647 -10.252 1.00 0.00 O ATOM 260 CB ILE A 19 9.175 4.284 -7.946 1.00 0.00 C ATOM 261 CG1 ILE A 19 9.084 5.338 -6.841 1.00 0.00 C ATOM 262 CG2 ILE A 19 9.483 4.938 -9.285 1.00 0.00 C ATOM 263 CD1 ILE A 19 10.409 5.996 -6.524 1.00 0.00 C ATOM 0 H ILE A 19 8.167 3.101 -5.992 1.00 0.00 H new ATOM 0 HA ILE A 19 7.044 4.165 -8.262 1.00 0.00 H new ATOM 0 HB ILE A 19 9.987 3.599 -7.702 1.00 0.00 H new ATOM 0 HG12 ILE A 19 8.369 6.105 -7.139 1.00 0.00 H new ATOM 0 HG13 ILE A 19 8.693 4.872 -5.937 1.00 0.00 H new ATOM 0 HG21 ILE A 19 10.414 5.501 -9.210 1.00 0.00 H new ATOM 0 HG22 ILE A 19 9.585 4.169 -10.051 1.00 0.00 H new ATOM 0 HG23 ILE A 19 8.671 5.614 -9.555 1.00 0.00 H new ATOM 0 HD11 ILE A 19 10.270 6.732 -5.732 1.00 0.00 H new ATOM 0 HD12 ILE A 19 11.121 5.239 -6.195 1.00 0.00 H new ATOM 0 HD13 ILE A 19 10.792 6.491 -7.416 1.00 0.00 H new ATOM 275 N HIS A 20 8.644 1.333 -8.836 1.00 0.00 N ATOM 276 CA HIS A 20 8.828 0.261 -9.808 1.00 0.00 C ATOM 277 C HIS A 20 7.513 -0.466 -10.071 1.00 0.00 C ATOM 278 O HIS A 20 7.234 -0.876 -11.198 1.00 0.00 O ATOM 279 CB HIS A 20 9.883 -0.729 -9.314 1.00 0.00 C ATOM 280 CG HIS A 20 11.277 -0.378 -9.732 1.00 0.00 C ATOM 281 ND1 HIS A 20 11.882 -0.905 -10.853 1.00 0.00 N ATOM 282 CD2 HIS A 20 12.186 0.454 -9.172 1.00 0.00 C ATOM 283 CE1 HIS A 20 13.103 -0.413 -10.964 1.00 0.00 C ATOM 284 NE2 HIS A 20 13.313 0.415 -9.957 1.00 0.00 N ATOM 0 H HIS A 20 9.060 1.150 -7.923 1.00 0.00 H new ATOM 0 HA HIS A 20 9.169 0.706 -10.743 1.00 0.00 H new ATOM 0 HB2 HIS A 20 9.841 -0.779 -8.226 1.00 0.00 H new ATOM 0 HB3 HIS A 20 9.640 -1.723 -9.689 1.00 0.00 H new ATOM 0 HD2 HIS A 20 12.051 1.040 -8.275 1.00 0.00 H new ATOM 0 HE1 HIS A 20 13.810 -0.648 -11.746 1.00 0.00 H new ATOM 0 HE2 HIS A 20 14.171 0.940 -9.789 1.00 0.00 H new ATOM 293 N CYS A 21 6.711 -0.624 -9.024 1.00 0.00 N ATOM 294 CA CYS A 21 5.426 -1.304 -9.141 1.00 0.00 C ATOM 295 C CYS A 21 4.461 -0.498 -10.005 1.00 0.00 C ATOM 296 O CYS A 21 3.348 -0.940 -10.290 1.00 0.00 O ATOM 297 CB CYS A 21 4.819 -1.534 -7.757 1.00 0.00 C ATOM 298 SG CYS A 21 5.724 -2.728 -6.744 1.00 0.00 S ATOM 0 H CYS A 21 6.928 -0.291 -8.085 1.00 0.00 H new ATOM 0 HA CYS A 21 5.596 -2.268 -9.620 1.00 0.00 H new ATOM 0 HB2 CYS A 21 4.777 -0.582 -7.228 1.00 0.00 H new ATOM 0 HB3 CYS A 21 3.792 -1.879 -7.875 1.00 0.00 H new ATOM 0 HG CYS A 21 6.830 -2.190 -6.322 1.00 0.00 H new ATOM 304 N LYS A 22 4.895 0.688 -10.418 1.00 0.00 N ATOM 305 CA LYS A 22 4.070 1.558 -11.249 1.00 0.00 C ATOM 306 C LYS A 22 2.903 2.127 -10.450 1.00 0.00 C ATOM 307 O LYS A 22 1.754 2.079 -10.890 1.00 0.00 O ATOM 308 CB LYS A 22 3.544 0.789 -12.463 1.00 0.00 C ATOM 309 CG LYS A 22 4.613 -0.013 -13.185 1.00 0.00 C ATOM 310 CD LYS A 22 5.532 0.886 -13.995 1.00 0.00 C ATOM 311 CE LYS A 22 6.130 0.147 -15.183 1.00 0.00 C ATOM 312 NZ LYS A 22 6.572 1.083 -16.253 1.00 0.00 N ATOM 0 H LYS A 22 5.813 1.069 -10.191 1.00 0.00 H new ATOM 0 HA LYS A 22 4.690 2.386 -11.592 1.00 0.00 H new ATOM 0 HB2 LYS A 22 2.752 0.114 -12.140 1.00 0.00 H new ATOM 0 HB3 LYS A 22 3.096 1.494 -13.163 1.00 0.00 H new ATOM 0 HG2 LYS A 22 5.200 -0.575 -12.459 1.00 0.00 H new ATOM 0 HG3 LYS A 22 4.140 -0.741 -13.845 1.00 0.00 H new ATOM 0 HD2 LYS A 22 4.975 1.754 -14.348 1.00 0.00 H new ATOM 0 HD3 LYS A 22 6.333 1.259 -13.357 1.00 0.00 H new ATOM 0 HE2 LYS A 22 6.979 -0.450 -14.849 1.00 0.00 H new ATOM 0 HE3 LYS A 22 5.393 -0.546 -15.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 6.973 0.541 -17.044 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 5.757 1.635 -16.589 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 7.294 1.728 -15.874 1.00 0.00 H new ATOM 326 N VAL A 23 3.205 2.668 -9.273 1.00 0.00 N ATOM 327 CA VAL A 23 2.180 3.249 -8.414 1.00 0.00 C ATOM 328 C VAL A 23 2.525 4.688 -8.044 1.00 0.00 C ATOM 329 O VAL A 23 1.639 5.501 -7.779 1.00 0.00 O ATOM 330 CB VAL A 23 1.999 2.429 -7.123 1.00 0.00 C ATOM 331 CG1 VAL A 23 1.416 1.060 -7.438 1.00 0.00 C ATOM 332 CG2 VAL A 23 3.323 2.297 -6.385 1.00 0.00 C ATOM 0 H VAL A 23 4.151 2.716 -8.893 1.00 0.00 H new ATOM 0 HA VAL A 23 1.248 3.235 -8.979 1.00 0.00 H new ATOM 0 HB VAL A 23 1.299 2.955 -6.474 1.00 0.00 H new ATOM 0 HG11 VAL A 23 1.295 0.495 -6.514 1.00 0.00 H new ATOM 0 HG12 VAL A 23 0.446 1.180 -7.920 1.00 0.00 H new ATOM 0 HG13 VAL A 23 2.089 0.523 -8.106 1.00 0.00 H new ATOM 0 HG21 VAL A 23 3.176 1.715 -5.475 1.00 0.00 H new ATOM 0 HG22 VAL A 23 4.048 1.794 -7.025 1.00 0.00 H new ATOM 0 HG23 VAL A 23 3.695 3.288 -6.125 1.00 0.00 H new ATOM 342 N LEU A 24 3.817 4.996 -8.029 1.00 0.00 N ATOM 343 CA LEU A 24 4.280 6.338 -7.693 1.00 0.00 C ATOM 344 C LEU A 24 5.307 6.830 -8.707 1.00 0.00 C ATOM 345 O LEU A 24 6.082 6.055 -9.269 1.00 0.00 O ATOM 346 CB LEU A 24 4.886 6.352 -6.288 1.00 0.00 C ATOM 347 CG LEU A 24 3.916 6.084 -5.137 1.00 0.00 C ATOM 348 CD1 LEU A 24 4.675 5.900 -3.832 1.00 0.00 C ATOM 349 CD2 LEU A 24 2.907 7.216 -5.014 1.00 0.00 C ATOM 0 H LEU A 24 4.563 4.335 -8.246 1.00 0.00 H new ATOM 0 HA LEU A 24 3.422 7.009 -7.719 1.00 0.00 H new ATOM 0 HB2 LEU A 24 5.680 5.606 -6.249 1.00 0.00 H new ATOM 0 HB3 LEU A 24 5.353 7.323 -6.125 1.00 0.00 H new ATOM 0 HG LEU A 24 3.374 5.163 -5.352 1.00 0.00 H new ATOM 0 HD11 LEU A 24 3.969 5.710 -3.024 1.00 0.00 H new ATOM 0 HD12 LEU A 24 5.357 5.055 -3.924 1.00 0.00 H new ATOM 0 HD13 LEU A 24 5.244 6.803 -3.612 1.00 0.00 H new ATOM 0 HD21 LEU A 24 2.225 7.008 -4.190 1.00 0.00 H new ATOM 0 HD22 LEU A 24 3.432 8.152 -4.823 1.00 0.00 H new ATOM 0 HD23 LEU A 24 2.340 7.301 -5.941 1.00 0.00 H new ATOM 361 N PRO A 25 5.318 8.149 -8.947 1.00 0.00 N ATOM 362 CA PRO A 25 6.247 8.775 -9.892 1.00 0.00 C ATOM 363 C PRO A 25 7.686 8.756 -9.389 1.00 0.00 C ATOM 364 O PRO A 25 7.936 8.570 -8.197 1.00 0.00 O ATOM 365 CB PRO A 25 5.735 10.214 -9.994 1.00 0.00 C ATOM 366 CG PRO A 25 5.023 10.454 -8.708 1.00 0.00 C ATOM 367 CD PRO A 25 4.423 9.132 -8.313 1.00 0.00 C ATOM 0 HA PRO A 25 6.273 8.249 -10.846 1.00 0.00 H new ATOM 0 HB2 PRO A 25 6.556 10.918 -10.129 1.00 0.00 H new ATOM 0 HB3 PRO A 25 5.066 10.337 -10.846 1.00 0.00 H new ATOM 0 HG2 PRO A 25 5.710 10.815 -7.943 1.00 0.00 H new ATOM 0 HG3 PRO A 25 4.250 11.214 -8.826 1.00 0.00 H new ATOM 0 HD2 PRO A 25 4.395 9.011 -7.230 1.00 0.00 H new ATOM 0 HD3 PRO A 25 3.398 9.032 -8.671 1.00 0.00 H new ATOM 375 N THR A 26 8.631 8.950 -10.303 1.00 0.00 N ATOM 376 CA THR A 26 10.046 8.955 -9.952 1.00 0.00 C ATOM 377 C THR A 26 10.406 10.192 -9.137 1.00 0.00 C ATOM 378 O THR A 26 11.298 10.151 -8.291 1.00 0.00 O ATOM 379 CB THR A 26 10.937 8.904 -11.208 1.00 0.00 C ATOM 380 OG1 THR A 26 10.767 10.100 -11.977 1.00 0.00 O ATOM 381 CG2 THR A 26 10.598 7.692 -12.062 1.00 0.00 C ATOM 0 H THR A 26 8.442 9.106 -11.293 1.00 0.00 H new ATOM 0 HA THR A 26 10.226 8.063 -9.352 1.00 0.00 H new ATOM 0 HB THR A 26 11.976 8.823 -10.888 1.00 0.00 H new ATOM 0 HG1 THR A 26 11.338 10.061 -12.773 1.00 0.00 H new ATOM 0 HG21 THR A 26 11.240 7.677 -12.943 1.00 0.00 H new ATOM 0 HG22 THR A 26 10.756 6.783 -11.482 1.00 0.00 H new ATOM 0 HG23 THR A 26 9.555 7.747 -12.374 1.00 0.00 H new ATOM 389 N ASN A 27 9.705 11.291 -9.397 1.00 0.00 N ATOM 390 CA ASN A 27 9.951 12.541 -8.687 1.00 0.00 C ATOM 391 C ASN A 27 8.851 12.812 -7.665 1.00 0.00 C ATOM 392 O ASN A 27 8.600 13.960 -7.297 1.00 0.00 O ATOM 393 CB ASN A 27 10.042 13.704 -9.676 1.00 0.00 C ATOM 394 CG ASN A 27 11.402 13.793 -10.341 1.00 0.00 C ATOM 395 OD1 ASN A 27 12.102 14.799 -10.217 1.00 0.00 O ATOM 396 ND2 ASN A 27 11.784 12.738 -11.051 1.00 0.00 N ATOM 0 H ASN A 27 8.962 11.341 -10.094 1.00 0.00 H new ATOM 0 HA ASN A 27 10.899 12.448 -8.157 1.00 0.00 H new ATOM 0 HB2 ASN A 27 9.274 13.588 -10.441 1.00 0.00 H new ATOM 0 HB3 ASN A 27 9.834 14.638 -9.154 1.00 0.00 H new ATOM 0 HD21 ASN A 27 12.690 12.740 -11.521 1.00 0.00 H new ATOM 0 HD22 ASN A 27 11.172 11.926 -11.127 1.00 0.00 H new ATOM 403 N HIS A 28 8.198 11.747 -7.210 1.00 0.00 N ATOM 404 CA HIS A 28 7.125 11.870 -6.230 1.00 0.00 C ATOM 405 C HIS A 28 7.579 12.692 -5.028 1.00 0.00 C ATOM 406 O HIS A 28 8.751 13.052 -4.917 1.00 0.00 O ATOM 407 CB HIS A 28 6.664 10.486 -5.771 1.00 0.00 C ATOM 408 CG HIS A 28 5.232 10.446 -5.334 1.00 0.00 C ATOM 409 ND1 HIS A 28 4.806 9.766 -4.213 1.00 0.00 N ATOM 410 CD2 HIS A 28 4.126 11.008 -5.875 1.00 0.00 C ATOM 411 CE1 HIS A 28 3.500 9.911 -4.083 1.00 0.00 C ATOM 412 NE2 HIS A 28 3.062 10.660 -5.078 1.00 0.00 N ATOM 0 H HIS A 28 8.393 10.790 -7.504 1.00 0.00 H new ATOM 0 HA HIS A 28 6.290 12.384 -6.705 1.00 0.00 H new ATOM 0 HB2 HIS A 28 6.807 9.776 -6.586 1.00 0.00 H new ATOM 0 HB3 HIS A 28 7.296 10.156 -4.947 1.00 0.00 H new ATOM 0 HD2 HIS A 28 4.087 11.616 -6.767 1.00 0.00 H new ATOM 0 HE1 HIS A 28 2.893 9.488 -3.296 1.00 0.00 H new ATOM 0 HE2 HIS A 28 2.092 10.936 -5.230 1.00 0.00 H new ATOM 421 N ARG A 29 6.644 12.985 -4.130 1.00 0.00 N ATOM 422 CA ARG A 29 6.948 13.766 -2.937 1.00 0.00 C ATOM 423 C ARG A 29 7.527 12.879 -1.839 1.00 0.00 C ATOM 424 O ARG A 29 8.450 13.276 -1.128 1.00 0.00 O ATOM 425 CB ARG A 29 5.688 14.470 -2.428 1.00 0.00 C ATOM 426 CG ARG A 29 4.615 13.515 -1.933 1.00 0.00 C ATOM 427 CD ARG A 29 3.277 14.218 -1.766 1.00 0.00 C ATOM 428 NE ARG A 29 3.326 15.250 -0.733 1.00 0.00 N ATOM 429 CZ ARG A 29 2.245 15.771 -0.164 1.00 0.00 C ATOM 430 NH1 ARG A 29 1.038 15.360 -0.524 1.00 0.00 N ATOM 431 NH2 ARG A 29 2.372 16.706 0.769 1.00 0.00 N ATOM 0 H ARG A 29 5.670 12.693 -4.206 1.00 0.00 H new ATOM 0 HA ARG A 29 7.693 14.516 -3.204 1.00 0.00 H new ATOM 0 HB2 ARG A 29 5.962 15.146 -1.618 1.00 0.00 H new ATOM 0 HB3 ARG A 29 5.275 15.083 -3.230 1.00 0.00 H new ATOM 0 HG2 ARG A 29 4.508 12.690 -2.637 1.00 0.00 H new ATOM 0 HG3 ARG A 29 4.922 13.084 -0.980 1.00 0.00 H new ATOM 0 HD2 ARG A 29 2.983 14.668 -2.714 1.00 0.00 H new ATOM 0 HD3 ARG A 29 2.512 13.485 -1.510 1.00 0.00 H new ATOM 0 HE ARG A 29 4.240 15.589 -0.433 1.00 0.00 H new ATOM 0 HH11 ARG A 29 0.937 14.641 -1.240 1.00 0.00 H new ATOM 0 HH12 ARG A 29 0.210 15.762 -0.085 1.00 0.00 H new ATOM 0 HH21 ARG A 29 3.300 17.024 1.049 1.00 0.00 H new ATOM 0 HH22 ARG A 29 1.542 17.106 1.206 1.00 0.00 H new ATOM 445 N VAL A 30 6.978 11.676 -1.707 1.00 0.00 N ATOM 446 CA VAL A 30 7.439 10.732 -0.696 1.00 0.00 C ATOM 447 C VAL A 30 8.932 10.456 -0.843 1.00 0.00 C ATOM 448 O VAL A 30 9.633 10.228 0.144 1.00 0.00 O ATOM 449 CB VAL A 30 6.672 9.399 -0.780 1.00 0.00 C ATOM 450 CG1 VAL A 30 5.172 9.641 -0.696 1.00 0.00 C ATOM 451 CG2 VAL A 30 7.030 8.658 -2.059 1.00 0.00 C ATOM 0 H VAL A 30 6.213 11.332 -2.288 1.00 0.00 H new ATOM 0 HA VAL A 30 7.250 11.191 0.275 1.00 0.00 H new ATOM 0 HB VAL A 30 6.964 8.777 0.066 1.00 0.00 H new ATOM 0 HG11 VAL A 30 4.646 8.688 -0.757 1.00 0.00 H new ATOM 0 HG12 VAL A 30 4.934 10.127 0.250 1.00 0.00 H new ATOM 0 HG13 VAL A 30 4.860 10.281 -1.521 1.00 0.00 H new ATOM 0 HG21 VAL A 30 6.479 7.719 -2.102 1.00 0.00 H new ATOM 0 HG22 VAL A 30 6.768 9.272 -2.921 1.00 0.00 H new ATOM 0 HG23 VAL A 30 8.100 8.452 -2.073 1.00 0.00 H new ATOM 461 N THR A 31 9.413 10.479 -2.082 1.00 0.00 N ATOM 462 CA THR A 31 10.822 10.230 -2.359 1.00 0.00 C ATOM 463 C THR A 31 11.710 11.243 -1.644 1.00 0.00 C ATOM 464 O THR A 31 12.705 10.877 -1.019 1.00 0.00 O ATOM 465 CB THR A 31 11.116 10.285 -3.870 1.00 0.00 C ATOM 466 OG1 THR A 31 10.884 11.607 -4.367 1.00 0.00 O ATOM 467 CG2 THR A 31 10.244 9.293 -4.626 1.00 0.00 C ATOM 0 H THR A 31 8.847 10.668 -2.910 1.00 0.00 H new ATOM 0 HA THR A 31 11.045 9.229 -1.989 1.00 0.00 H new ATOM 0 HB THR A 31 12.162 10.018 -4.025 1.00 0.00 H new ATOM 0 HG1 THR A 31 9.920 11.762 -4.447 1.00 0.00 H new ATOM 0 HG21 THR A 31 10.469 9.349 -5.691 1.00 0.00 H new ATOM 0 HG22 THR A 31 10.444 8.284 -4.266 1.00 0.00 H new ATOM 0 HG23 THR A 31 9.194 9.534 -4.463 1.00 0.00 H new ATOM 475 N TRP A 32 11.343 12.515 -1.739 1.00 0.00 N ATOM 476 CA TRP A 32 12.107 13.581 -1.100 1.00 0.00 C ATOM 477 C TRP A 32 12.329 13.280 0.378 1.00 0.00 C ATOM 478 O TRP A 32 11.403 12.884 1.086 1.00 0.00 O ATOM 479 CB TRP A 32 11.384 14.920 -1.258 1.00 0.00 C ATOM 480 CG TRP A 32 11.500 15.499 -2.635 1.00 0.00 C ATOM 481 CD1 TRP A 32 10.695 15.235 -3.706 1.00 0.00 C ATOM 482 CD2 TRP A 32 12.481 16.438 -3.090 1.00 0.00 C ATOM 483 NE1 TRP A 32 11.116 15.954 -4.799 1.00 0.00 N ATOM 484 CE2 TRP A 32 12.209 16.700 -4.447 1.00 0.00 C ATOM 485 CE3 TRP A 32 13.560 17.085 -2.482 1.00 0.00 C ATOM 486 CZ2 TRP A 32 12.979 17.580 -5.203 1.00 0.00 C ATOM 487 CZ3 TRP A 32 14.324 17.957 -3.234 1.00 0.00 C ATOM 488 CH2 TRP A 32 14.030 18.199 -4.583 1.00 0.00 C ATOM 0 H TRP A 32 10.521 12.834 -2.252 1.00 0.00 H new ATOM 0 HA TRP A 32 13.079 13.641 -1.589 1.00 0.00 H new ATOM 0 HB2 TRP A 32 10.330 14.786 -1.016 1.00 0.00 H new ATOM 0 HB3 TRP A 32 11.789 15.631 -0.538 1.00 0.00 H new ATOM 0 HD1 TRP A 32 9.852 14.560 -3.696 1.00 0.00 H new ATOM 0 HE1 TRP A 32 10.684 15.935 -5.723 1.00 0.00 H new ATOM 0 HE3 TRP A 32 13.793 16.907 -1.443 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 12.754 17.767 -6.243 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 15.162 18.461 -2.775 1.00 0.00 H new ATOM 0 HH2 TRP A 32 14.645 18.887 -5.144 1.00 0.00 H new ATOM 499 N ASP A 33 13.561 13.470 0.837 1.00 0.00 N ATOM 500 CA ASP A 33 13.904 13.220 2.232 1.00 0.00 C ATOM 501 C ASP A 33 12.885 13.866 3.167 1.00 0.00 C ATOM 502 O ASP A 33 12.362 13.218 4.074 1.00 0.00 O ATOM 503 CB ASP A 33 15.304 13.752 2.539 1.00 0.00 C ATOM 504 CG ASP A 33 15.570 15.093 1.884 1.00 0.00 C ATOM 505 OD1 ASP A 33 16.028 15.106 0.723 1.00 0.00 O ATOM 506 OD2 ASP A 33 15.321 16.131 2.534 1.00 0.00 O ATOM 0 H ASP A 33 14.339 13.796 0.263 1.00 0.00 H new ATOM 0 HA ASP A 33 13.889 12.142 2.396 1.00 0.00 H new ATOM 0 HB2 ASP A 33 15.425 13.848 3.618 1.00 0.00 H new ATOM 0 HB3 ASP A 33 16.047 13.031 2.198 1.00 0.00 H new ATOM 511 N SER A 34 12.609 15.146 2.939 1.00 0.00 N ATOM 512 CA SER A 34 11.657 15.881 3.763 1.00 0.00 C ATOM 513 C SER A 34 10.447 15.015 4.099 1.00 0.00 C ATOM 514 O SER A 34 9.893 15.101 5.195 1.00 0.00 O ATOM 515 CB SER A 34 11.204 17.153 3.044 1.00 0.00 C ATOM 516 OG SER A 34 12.186 18.171 3.142 1.00 0.00 O ATOM 0 H SER A 34 13.031 15.695 2.190 1.00 0.00 H new ATOM 0 HA SER A 34 12.155 16.155 4.693 1.00 0.00 H new ATOM 0 HB2 SER A 34 11.009 16.932 1.995 1.00 0.00 H new ATOM 0 HB3 SER A 34 10.267 17.504 3.476 1.00 0.00 H new ATOM 0 HG SER A 34 11.874 18.973 2.673 1.00 0.00 H new ATOM 522 N ALA A 35 10.042 14.180 3.147 1.00 0.00 N ATOM 523 CA ALA A 35 8.900 13.296 3.342 1.00 0.00 C ATOM 524 C ALA A 35 9.129 12.353 4.518 1.00 0.00 C ATOM 525 O ALA A 35 10.251 12.216 5.005 1.00 0.00 O ATOM 526 CB ALA A 35 8.624 12.503 2.073 1.00 0.00 C ATOM 0 H ALA A 35 10.488 14.098 2.233 1.00 0.00 H new ATOM 0 HA ALA A 35 8.030 13.912 3.569 1.00 0.00 H new ATOM 0 HB1 ALA A 35 7.768 11.847 2.233 1.00 0.00 H new ATOM 0 HB2 ALA A 35 8.407 13.190 1.255 1.00 0.00 H new ATOM 0 HB3 ALA A 35 9.499 11.904 1.821 1.00 0.00 H new ATOM 532 N GLN A 36 8.059 11.707 4.970 1.00 0.00 N ATOM 533 CA GLN A 36 8.144 10.778 6.090 1.00 0.00 C ATOM 534 C GLN A 36 7.064 9.706 5.993 1.00 0.00 C ATOM 535 O GLN A 36 6.109 9.840 5.227 1.00 0.00 O ATOM 536 CB GLN A 36 8.014 11.531 7.415 1.00 0.00 C ATOM 537 CG GLN A 36 9.207 12.420 7.731 1.00 0.00 C ATOM 538 CD GLN A 36 9.053 13.159 9.045 1.00 0.00 C ATOM 539 OE1 GLN A 36 8.331 12.716 9.939 1.00 0.00 O ATOM 540 NE2 GLN A 36 9.732 14.293 9.170 1.00 0.00 N ATOM 0 H GLN A 36 7.123 11.810 4.578 1.00 0.00 H new ATOM 0 HA GLN A 36 9.118 10.290 6.051 1.00 0.00 H new ATOM 0 HB2 GLN A 36 7.113 12.143 7.388 1.00 0.00 H new ATOM 0 HB3 GLN A 36 7.885 10.810 8.222 1.00 0.00 H new ATOM 0 HG2 GLN A 36 10.110 11.811 7.765 1.00 0.00 H new ATOM 0 HG3 GLN A 36 9.340 13.143 6.926 1.00 0.00 H new ATOM 0 HE21 GLN A 36 10.319 14.623 8.404 1.00 0.00 H new ATOM 0 HE22 GLN A 36 9.667 14.834 10.032 1.00 0.00 H new ATOM 549 N VAL A 37 7.222 8.641 6.773 1.00 0.00 N ATOM 550 CA VAL A 37 6.259 7.546 6.774 1.00 0.00 C ATOM 551 C VAL A 37 4.843 8.058 6.537 1.00 0.00 C ATOM 552 O VAL A 37 4.089 7.488 5.748 1.00 0.00 O ATOM 553 CB VAL A 37 6.296 6.769 8.104 1.00 0.00 C ATOM 554 CG1 VAL A 37 7.443 5.769 8.106 1.00 0.00 C ATOM 555 CG2 VAL A 37 6.413 7.728 9.278 1.00 0.00 C ATOM 0 H VAL A 37 8.007 8.513 7.412 1.00 0.00 H new ATOM 0 HA VAL A 37 6.540 6.876 5.961 1.00 0.00 H new ATOM 0 HB VAL A 37 5.362 6.216 8.208 1.00 0.00 H new ATOM 0 HG11 VAL A 37 7.454 5.229 9.053 1.00 0.00 H new ATOM 0 HG12 VAL A 37 7.311 5.062 7.287 1.00 0.00 H new ATOM 0 HG13 VAL A 37 8.387 6.298 7.979 1.00 0.00 H new ATOM 0 HG21 VAL A 37 6.438 7.162 10.209 1.00 0.00 H new ATOM 0 HG22 VAL A 37 7.330 8.310 9.183 1.00 0.00 H new ATOM 0 HG23 VAL A 37 5.555 8.401 9.285 1.00 0.00 H new ATOM 565 N PHE A 38 4.488 9.138 7.225 1.00 0.00 N ATOM 566 CA PHE A 38 3.161 9.728 7.090 1.00 0.00 C ATOM 567 C PHE A 38 2.829 9.991 5.623 1.00 0.00 C ATOM 568 O PHE A 38 1.881 9.425 5.079 1.00 0.00 O ATOM 569 CB PHE A 38 3.076 11.033 7.885 1.00 0.00 C ATOM 570 CG PHE A 38 1.707 11.650 7.880 1.00 0.00 C ATOM 571 CD1 PHE A 38 0.575 10.857 7.978 1.00 0.00 C ATOM 572 CD2 PHE A 38 1.551 13.023 7.778 1.00 0.00 C ATOM 573 CE1 PHE A 38 -0.686 11.422 7.973 1.00 0.00 C ATOM 574 CE2 PHE A 38 0.293 13.594 7.772 1.00 0.00 C ATOM 575 CZ PHE A 38 -0.828 12.792 7.871 1.00 0.00 C ATOM 0 H PHE A 38 5.100 9.622 7.881 1.00 0.00 H new ATOM 0 HA PHE A 38 2.434 9.020 7.488 1.00 0.00 H new ATOM 0 HB2 PHE A 38 3.376 10.842 8.915 1.00 0.00 H new ATOM 0 HB3 PHE A 38 3.789 11.747 7.473 1.00 0.00 H new ATOM 0 HD1 PHE A 38 0.679 9.785 8.059 1.00 0.00 H new ATOM 0 HD2 PHE A 38 2.424 13.655 7.702 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -1.560 10.792 8.049 1.00 0.00 H new ATOM 0 HE2 PHE A 38 0.186 14.666 7.690 1.00 0.00 H new ATOM 0 HZ PHE A 38 -1.813 13.235 7.869 1.00 0.00 H new ATOM 585 N ASP A 39 3.617 10.853 4.991 1.00 0.00 N ATOM 586 CA ASP A 39 3.408 11.192 3.587 1.00 0.00 C ATOM 587 C ASP A 39 2.949 9.971 2.796 1.00 0.00 C ATOM 588 O ASP A 39 1.873 9.975 2.196 1.00 0.00 O ATOM 589 CB ASP A 39 4.694 11.754 2.980 1.00 0.00 C ATOM 590 CG ASP A 39 4.423 12.736 1.857 1.00 0.00 C ATOM 591 OD1 ASP A 39 3.657 12.386 0.934 1.00 0.00 O ATOM 592 OD2 ASP A 39 4.975 13.855 1.901 1.00 0.00 O ATOM 0 H ASP A 39 4.406 11.330 5.427 1.00 0.00 H new ATOM 0 HA ASP A 39 2.628 11.951 3.534 1.00 0.00 H new ATOM 0 HB2 ASP A 39 5.274 12.249 3.759 1.00 0.00 H new ATOM 0 HB3 ASP A 39 5.303 10.933 2.602 1.00 0.00 H new ATOM 597 N LEU A 40 3.772 8.928 2.799 1.00 0.00 N ATOM 598 CA LEU A 40 3.451 7.699 2.080 1.00 0.00 C ATOM 599 C LEU A 40 2.177 7.064 2.629 1.00 0.00 C ATOM 600 O LEU A 40 1.415 6.440 1.891 1.00 0.00 O ATOM 601 CB LEU A 40 4.612 6.708 2.181 1.00 0.00 C ATOM 602 CG LEU A 40 4.452 5.405 1.398 1.00 0.00 C ATOM 603 CD1 LEU A 40 4.220 5.694 -0.077 1.00 0.00 C ATOM 604 CD2 LEU A 40 5.674 4.518 1.583 1.00 0.00 C ATOM 0 H LEU A 40 4.666 8.908 3.291 1.00 0.00 H new ATOM 0 HA LEU A 40 3.287 7.952 1.033 1.00 0.00 H new ATOM 0 HB2 LEU A 40 5.519 7.206 1.838 1.00 0.00 H new ATOM 0 HB3 LEU A 40 4.762 6.461 3.232 1.00 0.00 H new ATOM 0 HG LEU A 40 3.581 4.876 1.785 1.00 0.00 H new ATOM 0 HD11 LEU A 40 4.108 4.755 -0.619 1.00 0.00 H new ATOM 0 HD12 LEU A 40 3.315 6.290 -0.193 1.00 0.00 H new ATOM 0 HD13 LEU A 40 5.071 6.245 -0.478 1.00 0.00 H new ATOM 0 HD21 LEU A 40 5.542 3.595 1.018 1.00 0.00 H new ATOM 0 HD22 LEU A 40 6.560 5.040 1.223 1.00 0.00 H new ATOM 0 HD23 LEU A 40 5.796 4.282 2.640 1.00 0.00 H new ATOM 616 N ALA A 41 1.950 7.231 3.928 1.00 0.00 N ATOM 617 CA ALA A 41 0.766 6.678 4.574 1.00 0.00 C ATOM 618 C ALA A 41 -0.480 7.479 4.212 1.00 0.00 C ATOM 619 O ALA A 41 -1.599 6.972 4.293 1.00 0.00 O ATOM 620 CB ALA A 41 0.956 6.645 6.083 1.00 0.00 C ATOM 0 H ALA A 41 2.571 7.745 4.554 1.00 0.00 H new ATOM 0 HA ALA A 41 0.627 5.658 4.214 1.00 0.00 H new ATOM 0 HB1 ALA A 41 0.064 6.230 6.553 1.00 0.00 H new ATOM 0 HB2 ALA A 41 1.818 6.024 6.328 1.00 0.00 H new ATOM 0 HB3 ALA A 41 1.122 7.657 6.451 1.00 0.00 H new ATOM 626 N GLN A 42 -0.279 8.731 3.816 1.00 0.00 N ATOM 627 CA GLN A 42 -1.388 9.602 3.444 1.00 0.00 C ATOM 628 C GLN A 42 -1.887 9.278 2.039 1.00 0.00 C ATOM 629 O GLN A 42 -3.062 8.970 1.841 1.00 0.00 O ATOM 630 CB GLN A 42 -0.961 11.069 3.521 1.00 0.00 C ATOM 631 CG GLN A 42 -0.526 11.503 4.911 1.00 0.00 C ATOM 632 CD GLN A 42 -0.554 13.008 5.088 1.00 0.00 C ATOM 633 OE1 GLN A 42 -1.622 13.619 5.140 1.00 0.00 O ATOM 634 NE2 GLN A 42 0.624 13.616 5.180 1.00 0.00 N ATOM 0 H GLN A 42 0.641 9.165 3.744 1.00 0.00 H new ATOM 0 HA GLN A 42 -2.203 9.431 4.148 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -0.141 11.237 2.823 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -1.790 11.698 3.196 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -1.179 11.042 5.652 1.00 0.00 H new ATOM 0 HG3 GLN A 42 0.483 11.137 5.103 1.00 0.00 H new ATOM 0 HE21 GLN A 42 1.485 13.071 5.132 1.00 0.00 H new ATOM 0 HE22 GLN A 42 0.668 14.628 5.299 1.00 0.00 H new ATOM 643 N THR A 43 -0.985 9.351 1.065 1.00 0.00 N ATOM 644 CA THR A 43 -1.333 9.068 -0.322 1.00 0.00 C ATOM 645 C THR A 43 -2.139 7.779 -0.434 1.00 0.00 C ATOM 646 O THR A 43 -2.873 7.576 -1.402 1.00 0.00 O ATOM 647 CB THR A 43 -0.076 8.953 -1.204 1.00 0.00 C ATOM 648 OG1 THR A 43 -0.415 9.193 -2.574 1.00 0.00 O ATOM 649 CG2 THR A 43 0.558 7.577 -1.067 1.00 0.00 C ATOM 0 H THR A 43 -0.008 9.604 1.211 1.00 0.00 H new ATOM 0 HA THR A 43 -1.939 9.904 -0.673 1.00 0.00 H new ATOM 0 HB THR A 43 0.643 9.701 -0.872 1.00 0.00 H new ATOM 0 HG1 THR A 43 0.390 9.120 -3.128 1.00 0.00 H new ATOM 0 HG21 THR A 43 1.444 7.520 -1.699 1.00 0.00 H new ATOM 0 HG22 THR A 43 0.842 7.409 -0.028 1.00 0.00 H new ATOM 0 HG23 THR A 43 -0.157 6.814 -1.375 1.00 0.00 H new ATOM 657 N LEU A 44 -1.998 6.910 0.561 1.00 0.00 N ATOM 658 CA LEU A 44 -2.714 5.640 0.575 1.00 0.00 C ATOM 659 C LEU A 44 -3.885 5.685 1.551 1.00 0.00 C ATOM 660 O LEU A 44 -4.902 5.023 1.347 1.00 0.00 O ATOM 661 CB LEU A 44 -1.765 4.501 0.951 1.00 0.00 C ATOM 662 CG LEU A 44 -0.408 4.497 0.245 1.00 0.00 C ATOM 663 CD1 LEU A 44 0.602 3.679 1.035 1.00 0.00 C ATOM 664 CD2 LEU A 44 -0.545 3.955 -1.170 1.00 0.00 C ATOM 0 H LEU A 44 -1.394 7.062 1.369 1.00 0.00 H new ATOM 0 HA LEU A 44 -3.107 5.462 -0.426 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -1.592 4.539 2.027 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -2.264 3.555 0.741 1.00 0.00 H new ATOM 0 HG LEU A 44 -0.047 5.524 0.186 1.00 0.00 H new ATOM 0 HD11 LEU A 44 1.561 3.687 0.518 1.00 0.00 H new ATOM 0 HD12 LEU A 44 0.722 4.110 2.029 1.00 0.00 H new ATOM 0 HD13 LEU A 44 0.248 2.652 1.125 1.00 0.00 H new ATOM 0 HD21 LEU A 44 0.430 3.959 -1.657 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -0.928 2.935 -1.133 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -1.236 4.582 -1.734 1.00 0.00 H new ATOM 676 N ARG A 45 -3.734 6.471 2.612 1.00 0.00 N ATOM 677 CA ARG A 45 -4.779 6.604 3.619 1.00 0.00 C ATOM 678 C ARG A 45 -6.162 6.594 2.973 1.00 0.00 C ATOM 679 O ARG A 45 -7.111 6.035 3.523 1.00 0.00 O ATOM 680 CB ARG A 45 -4.587 7.895 4.418 1.00 0.00 C ATOM 681 CG ARG A 45 -5.694 8.158 5.425 1.00 0.00 C ATOM 682 CD ARG A 45 -5.878 9.647 5.674 1.00 0.00 C ATOM 683 NE ARG A 45 -7.078 9.927 6.458 1.00 0.00 N ATOM 684 CZ ARG A 45 -7.610 11.138 6.580 1.00 0.00 C ATOM 685 NH1 ARG A 45 -7.052 12.175 5.971 1.00 0.00 N ATOM 686 NH2 ARG A 45 -8.704 11.313 7.311 1.00 0.00 N ATOM 0 H ARG A 45 -2.898 7.025 2.796 1.00 0.00 H new ATOM 0 HA ARG A 45 -4.706 5.752 4.295 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -3.633 7.849 4.943 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -4.530 8.735 3.726 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -6.628 7.731 5.060 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -5.460 7.657 6.364 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -5.005 10.038 6.196 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -5.939 10.169 4.719 1.00 0.00 H new ATOM 0 HE ARG A 45 -7.532 9.150 6.938 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -6.212 12.044 5.407 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -7.463 13.104 6.066 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -9.137 10.517 7.780 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -9.112 12.243 7.404 1.00 0.00 H new ATOM 700 N ASP A 46 -6.267 7.216 1.804 1.00 0.00 N ATOM 701 CA ASP A 46 -7.533 7.279 1.083 1.00 0.00 C ATOM 702 C ASP A 46 -7.995 5.883 0.674 1.00 0.00 C ATOM 703 O ASP A 46 -9.152 5.517 0.877 1.00 0.00 O ATOM 704 CB ASP A 46 -7.396 8.167 -0.154 1.00 0.00 C ATOM 705 CG ASP A 46 -6.538 9.390 0.103 1.00 0.00 C ATOM 706 OD1 ASP A 46 -5.313 9.228 0.286 1.00 0.00 O ATOM 707 OD2 ASP A 46 -7.091 10.509 0.122 1.00 0.00 O ATOM 0 H ASP A 46 -5.491 7.684 1.335 1.00 0.00 H new ATOM 0 HA ASP A 46 -8.281 7.710 1.748 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -6.962 7.587 -0.968 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -8.386 8.484 -0.482 1.00 0.00 H new ATOM 712 N GLY A 47 -7.082 5.109 0.096 1.00 0.00 N ATOM 713 CA GLY A 47 -7.415 3.763 -0.334 1.00 0.00 C ATOM 714 C GLY A 47 -7.718 3.686 -1.817 1.00 0.00 C ATOM 715 O GLY A 47 -8.405 2.772 -2.272 1.00 0.00 O ATOM 0 H GLY A 47 -6.118 5.390 -0.082 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -6.586 3.095 -0.101 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -8.278 3.408 0.229 1.00 0.00 H new ATOM 719 N VAL A 48 -7.204 4.650 -2.575 1.00 0.00 N ATOM 720 CA VAL A 48 -7.424 4.689 -4.016 1.00 0.00 C ATOM 721 C VAL A 48 -6.202 4.177 -4.772 1.00 0.00 C ATOM 722 O VAL A 48 -6.325 3.585 -5.845 1.00 0.00 O ATOM 723 CB VAL A 48 -7.750 6.115 -4.496 1.00 0.00 C ATOM 724 CG1 VAL A 48 -7.930 6.142 -6.006 1.00 0.00 C ATOM 725 CG2 VAL A 48 -8.992 6.642 -3.794 1.00 0.00 C ATOM 0 H VAL A 48 -6.632 5.414 -2.215 1.00 0.00 H new ATOM 0 HA VAL A 48 -8.275 4.041 -4.224 1.00 0.00 H new ATOM 0 HB VAL A 48 -6.913 6.765 -4.242 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -8.160 7.158 -6.327 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -7.011 5.808 -6.488 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -8.748 5.479 -6.287 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -9.208 7.651 -4.145 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -9.838 5.992 -4.015 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -8.821 6.661 -2.718 1.00 0.00 H new ATOM 735 N LEU A 49 -5.023 4.409 -4.205 1.00 0.00 N ATOM 736 CA LEU A 49 -3.777 3.971 -4.825 1.00 0.00 C ATOM 737 C LEU A 49 -3.513 2.497 -4.534 1.00 0.00 C ATOM 738 O LEU A 49 -3.308 1.700 -5.450 1.00 0.00 O ATOM 739 CB LEU A 49 -2.608 4.819 -4.321 1.00 0.00 C ATOM 740 CG LEU A 49 -1.235 4.483 -4.903 1.00 0.00 C ATOM 741 CD1 LEU A 49 -1.228 4.693 -6.409 1.00 0.00 C ATOM 742 CD2 LEU A 49 -0.154 5.324 -4.240 1.00 0.00 C ATOM 0 H LEU A 49 -4.904 4.898 -3.318 1.00 0.00 H new ATOM 0 HA LEU A 49 -3.872 4.098 -5.903 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -2.825 5.865 -4.536 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -2.555 4.721 -3.237 1.00 0.00 H new ATOM 0 HG LEU A 49 -1.024 3.433 -4.702 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -0.243 4.449 -6.806 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -1.975 4.047 -6.870 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -1.461 5.734 -6.632 1.00 0.00 H new ATOM 0 HD21 LEU A 49 0.817 5.071 -4.667 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -0.361 6.381 -4.409 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -0.143 5.123 -3.169 1.00 0.00 H new ATOM 754 N LEU A 50 -3.522 2.141 -3.255 1.00 0.00 N ATOM 755 CA LEU A 50 -3.286 0.762 -2.842 1.00 0.00 C ATOM 756 C LEU A 50 -3.879 -0.217 -3.851 1.00 0.00 C ATOM 757 O LEU A 50 -3.189 -1.112 -4.341 1.00 0.00 O ATOM 758 CB LEU A 50 -3.887 0.512 -1.458 1.00 0.00 C ATOM 759 CG LEU A 50 -2.969 0.790 -0.268 1.00 0.00 C ATOM 760 CD1 LEU A 50 -3.726 0.622 1.041 1.00 0.00 C ATOM 761 CD2 LEU A 50 -1.755 -0.127 -0.305 1.00 0.00 C ATOM 0 H LEU A 50 -3.690 2.788 -2.485 1.00 0.00 H new ATOM 0 HA LEU A 50 -2.209 0.602 -2.797 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -4.780 1.129 -1.355 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -4.210 -0.528 -1.407 1.00 0.00 H new ATOM 0 HG LEU A 50 -2.623 1.821 -0.334 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -3.056 0.824 1.877 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -4.563 1.320 1.070 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -4.102 -0.398 1.116 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -1.113 0.085 0.550 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -2.082 -1.166 -0.264 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -1.199 0.042 -1.227 1.00 0.00 H new ATOM 773 N CYS A 51 -5.159 -0.039 -4.158 1.00 0.00 N ATOM 774 CA CYS A 51 -5.845 -0.906 -5.110 1.00 0.00 C ATOM 775 C CYS A 51 -5.105 -0.942 -6.443 1.00 0.00 C ATOM 776 O CYS A 51 -4.950 -2.002 -7.049 1.00 0.00 O ATOM 777 CB CYS A 51 -7.282 -0.429 -5.323 1.00 0.00 C ATOM 778 SG CYS A 51 -8.396 -0.808 -3.950 1.00 0.00 S ATOM 0 H CYS A 51 -5.743 0.698 -3.762 1.00 0.00 H new ATOM 0 HA CYS A 51 -5.863 -1.915 -4.698 1.00 0.00 H new ATOM 0 HB2 CYS A 51 -7.276 0.649 -5.485 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -7.674 -0.885 -6.232 1.00 0.00 H new ATOM 0 HG CYS A 51 -8.882 0.297 -3.468 1.00 0.00 H new ATOM 784 N GLN A 52 -4.652 0.224 -6.894 1.00 0.00 N ATOM 785 CA GLN A 52 -3.931 0.325 -8.157 1.00 0.00 C ATOM 786 C GLN A 52 -2.751 -0.641 -8.189 1.00 0.00 C ATOM 787 O GLN A 52 -2.533 -1.339 -9.181 1.00 0.00 O ATOM 788 CB GLN A 52 -3.439 1.757 -8.374 1.00 0.00 C ATOM 789 CG GLN A 52 -4.559 2.783 -8.433 1.00 0.00 C ATOM 790 CD GLN A 52 -4.195 3.998 -9.262 1.00 0.00 C ATOM 791 OE1 GLN A 52 -3.176 4.647 -9.020 1.00 0.00 O ATOM 792 NE2 GLN A 52 -5.027 4.314 -10.247 1.00 0.00 N ATOM 0 H GLN A 52 -4.772 1.111 -6.404 1.00 0.00 H new ATOM 0 HA GLN A 52 -4.617 0.058 -8.961 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -2.756 2.024 -7.568 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -2.869 1.800 -9.302 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -5.451 2.317 -8.851 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -4.809 3.100 -7.421 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -5.860 3.749 -10.412 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -4.833 5.122 -10.839 1.00 0.00 H new ATOM 801 N LEU A 53 -1.991 -0.676 -7.100 1.00 0.00 N ATOM 802 CA LEU A 53 -0.832 -1.556 -7.003 1.00 0.00 C ATOM 803 C LEU A 53 -1.154 -2.943 -7.552 1.00 0.00 C ATOM 804 O LEU A 53 -0.547 -3.394 -8.524 1.00 0.00 O ATOM 805 CB LEU A 53 -0.370 -1.665 -5.550 1.00 0.00 C ATOM 806 CG LEU A 53 0.722 -2.699 -5.268 1.00 0.00 C ATOM 807 CD1 LEU A 53 2.033 -2.280 -5.915 1.00 0.00 C ATOM 808 CD2 LEU A 53 0.901 -2.890 -3.769 1.00 0.00 C ATOM 0 H LEU A 53 -2.157 -0.105 -6.271 1.00 0.00 H new ATOM 0 HA LEU A 53 -0.029 -1.126 -7.602 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -0.008 -0.688 -5.231 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -1.236 -1.902 -4.931 1.00 0.00 H new ATOM 0 HG LEU A 53 0.415 -3.651 -5.701 1.00 0.00 H new ATOM 0 HD11 LEU A 53 2.798 -3.027 -5.704 1.00 0.00 H new ATOM 0 HD12 LEU A 53 1.896 -2.195 -6.993 1.00 0.00 H new ATOM 0 HD13 LEU A 53 2.346 -1.317 -5.512 1.00 0.00 H new ATOM 0 HD21 LEU A 53 1.681 -3.629 -3.587 1.00 0.00 H new ATOM 0 HD22 LEU A 53 1.185 -1.942 -3.313 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -0.036 -3.236 -3.332 1.00 0.00 H new ATOM 820 N LEU A 54 -2.114 -3.613 -6.924 1.00 0.00 N ATOM 821 CA LEU A 54 -2.519 -4.948 -7.350 1.00 0.00 C ATOM 822 C LEU A 54 -2.898 -4.956 -8.828 1.00 0.00 C ATOM 823 O LEU A 54 -2.561 -5.886 -9.560 1.00 0.00 O ATOM 824 CB LEU A 54 -3.698 -5.438 -6.507 1.00 0.00 C ATOM 825 CG LEU A 54 -3.465 -5.497 -4.997 1.00 0.00 C ATOM 826 CD1 LEU A 54 -4.682 -6.073 -4.291 1.00 0.00 C ATOM 827 CD2 LEU A 54 -2.224 -6.318 -4.681 1.00 0.00 C ATOM 0 H LEU A 54 -2.626 -3.254 -6.118 1.00 0.00 H new ATOM 0 HA LEU A 54 -1.673 -5.621 -7.207 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -4.551 -4.786 -6.698 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -3.975 -6.434 -6.851 1.00 0.00 H new ATOM 0 HG LEU A 54 -3.307 -4.482 -4.633 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -4.497 -6.107 -3.217 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -5.550 -5.444 -4.490 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -4.873 -7.081 -4.659 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -2.073 -6.349 -3.602 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -2.353 -7.332 -5.059 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -1.355 -5.862 -5.155 1.00 0.00 H new ATOM 839 N ASN A 55 -3.599 -3.913 -9.260 1.00 0.00 N ATOM 840 CA ASN A 55 -4.022 -3.799 -10.651 1.00 0.00 C ATOM 841 C ASN A 55 -2.816 -3.688 -11.579 1.00 0.00 C ATOM 842 O ASN A 55 -2.890 -4.044 -12.754 1.00 0.00 O ATOM 843 CB ASN A 55 -4.932 -2.582 -10.831 1.00 0.00 C ATOM 844 CG ASN A 55 -6.172 -2.653 -9.960 1.00 0.00 C ATOM 845 OD1 ASN A 55 -6.604 -3.735 -9.563 1.00 0.00 O ATOM 846 ND2 ASN A 55 -6.750 -1.496 -9.659 1.00 0.00 N ATOM 0 H ASN A 55 -3.886 -3.135 -8.667 1.00 0.00 H new ATOM 0 HA ASN A 55 -4.577 -4.701 -10.911 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -4.375 -1.676 -10.592 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -5.230 -2.506 -11.877 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -7.587 -1.480 -9.076 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -6.357 -0.623 -10.010 1.00 0.00 H new ATOM 853 N ASN A 56 -1.707 -3.193 -11.041 1.00 0.00 N ATOM 854 CA ASN A 56 -0.484 -3.035 -11.821 1.00 0.00 C ATOM 855 C ASN A 56 0.226 -4.374 -11.996 1.00 0.00 C ATOM 856 O ASN A 56 0.624 -4.739 -13.103 1.00 0.00 O ATOM 857 CB ASN A 56 0.452 -2.033 -11.143 1.00 0.00 C ATOM 858 CG ASN A 56 0.194 -0.607 -11.588 1.00 0.00 C ATOM 859 OD1 ASN A 56 0.272 -0.292 -12.776 1.00 0.00 O ATOM 860 ND2 ASN A 56 -0.116 0.263 -10.635 1.00 0.00 N ATOM 0 H ASN A 56 -1.629 -2.894 -10.069 1.00 0.00 H new ATOM 0 HA ASN A 56 -0.757 -2.657 -12.806 1.00 0.00 H new ATOM 0 HB2 ASN A 56 0.330 -2.101 -10.062 1.00 0.00 H new ATOM 0 HB3 ASN A 56 1.486 -2.298 -11.365 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -0.301 1.237 -10.874 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -0.169 -0.042 -9.663 1.00 0.00 H new ATOM 867 N LEU A 57 0.381 -5.103 -10.896 1.00 0.00 N ATOM 868 CA LEU A 57 1.043 -6.403 -10.927 1.00 0.00 C ATOM 869 C LEU A 57 0.249 -7.398 -11.767 1.00 0.00 C ATOM 870 O LEU A 57 0.777 -7.993 -12.707 1.00 0.00 O ATOM 871 CB LEU A 57 1.217 -6.942 -9.506 1.00 0.00 C ATOM 872 CG LEU A 57 1.766 -5.955 -8.476 1.00 0.00 C ATOM 873 CD1 LEU A 57 1.835 -6.601 -7.101 1.00 0.00 C ATOM 874 CD2 LEU A 57 3.138 -5.450 -8.900 1.00 0.00 C ATOM 0 H LEU A 57 0.058 -4.816 -9.972 1.00 0.00 H new ATOM 0 HA LEU A 57 2.025 -6.273 -11.383 1.00 0.00 H new ATOM 0 HB2 LEU A 57 0.250 -7.302 -9.155 1.00 0.00 H new ATOM 0 HB3 LEU A 57 1.883 -7.804 -9.545 1.00 0.00 H new ATOM 0 HG LEU A 57 1.088 -5.103 -8.420 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.228 -5.883 -6.381 1.00 0.00 H new ATOM 0 HD12 LEU A 57 0.836 -6.912 -6.795 1.00 0.00 H new ATOM 0 HD13 LEU A 57 2.490 -7.471 -7.140 1.00 0.00 H new ATOM 0 HD21 LEU A 57 3.514 -4.748 -8.155 1.00 0.00 H new ATOM 0 HD22 LEU A 57 3.825 -6.292 -8.985 1.00 0.00 H new ATOM 0 HD23 LEU A 57 3.059 -4.948 -9.864 1.00 0.00 H new ATOM 886 N ARG A 58 -1.023 -7.573 -11.423 1.00 0.00 N ATOM 887 CA ARG A 58 -1.890 -8.495 -12.146 1.00 0.00 C ATOM 888 C ARG A 58 -3.044 -7.750 -12.809 1.00 0.00 C ATOM 889 O ARG A 58 -3.406 -6.649 -12.394 1.00 0.00 O ATOM 890 CB ARG A 58 -2.437 -9.564 -11.198 1.00 0.00 C ATOM 891 CG ARG A 58 -2.722 -10.893 -11.877 1.00 0.00 C ATOM 892 CD ARG A 58 -3.779 -11.688 -11.126 1.00 0.00 C ATOM 893 NE ARG A 58 -4.393 -12.713 -11.966 1.00 0.00 N ATOM 894 CZ ARG A 58 -3.827 -13.887 -12.225 1.00 0.00 C ATOM 895 NH1 ARG A 58 -2.641 -14.182 -11.712 1.00 0.00 N ATOM 896 NH2 ARG A 58 -4.448 -14.768 -12.999 1.00 0.00 N ATOM 0 H ARG A 58 -1.476 -7.088 -10.648 1.00 0.00 H new ATOM 0 HA ARG A 58 -1.297 -8.977 -12.923 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -1.720 -9.724 -10.392 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -3.355 -9.196 -10.740 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -3.057 -10.716 -12.899 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -1.803 -11.476 -11.939 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -3.327 -12.158 -10.253 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -4.550 -11.010 -10.759 1.00 0.00 H new ATOM 0 HE ARG A 58 -5.306 -12.517 -12.376 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -2.161 -13.507 -11.117 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -2.209 -15.084 -11.912 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -5.361 -14.544 -13.396 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -4.013 -15.669 -13.197 1.00 0.00 H new ATOM 910 N ALA A 59 -3.618 -8.357 -13.843 1.00 0.00 N ATOM 911 CA ALA A 59 -4.732 -7.751 -14.563 1.00 0.00 C ATOM 912 C ALA A 59 -6.068 -8.165 -13.955 1.00 0.00 C ATOM 913 O ALA A 59 -6.231 -9.298 -13.501 1.00 0.00 O ATOM 914 CB ALA A 59 -4.679 -8.133 -16.035 1.00 0.00 C ATOM 0 H ALA A 59 -3.330 -9.268 -14.201 1.00 0.00 H new ATOM 0 HA ALA A 59 -4.643 -6.668 -14.476 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -5.516 -7.674 -16.560 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -3.742 -7.782 -16.468 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -4.740 -9.217 -16.132 1.00 0.00 H new ATOM 920 N HIS A 60 -7.022 -7.239 -13.949 1.00 0.00 N ATOM 921 CA HIS A 60 -8.345 -7.508 -13.396 1.00 0.00 C ATOM 922 C HIS A 60 -8.254 -7.847 -11.911 1.00 0.00 C ATOM 923 O HIS A 60 -9.005 -8.684 -11.409 1.00 0.00 O ATOM 924 CB HIS A 60 -9.013 -8.656 -14.154 1.00 0.00 C ATOM 925 CG HIS A 60 -9.528 -8.262 -15.504 1.00 0.00 C ATOM 926 ND1 HIS A 60 -10.666 -7.505 -15.684 1.00 0.00 N ATOM 927 CD2 HIS A 60 -9.052 -8.524 -16.744 1.00 0.00 C ATOM 928 CE1 HIS A 60 -10.869 -7.320 -16.977 1.00 0.00 C ATOM 929 NE2 HIS A 60 -9.903 -7.928 -17.641 1.00 0.00 N ATOM 0 H HIS A 60 -6.904 -6.296 -14.321 1.00 0.00 H new ATOM 0 HA HIS A 60 -8.950 -6.608 -13.508 1.00 0.00 H new ATOM 0 HB2 HIS A 60 -8.297 -9.469 -14.271 1.00 0.00 H new ATOM 0 HB3 HIS A 60 -9.839 -9.042 -13.557 1.00 0.00 H new ATOM 0 HD2 HIS A 60 -8.167 -9.096 -16.983 1.00 0.00 H new ATOM 0 HE1 HIS A 60 -11.686 -6.766 -17.416 1.00 0.00 H new ATOM 0 HE2 HIS A 60 -9.805 -7.951 -18.656 1.00 0.00 H new ATOM 938 N SER A 61 -7.331 -7.193 -11.215 1.00 0.00 N ATOM 939 CA SER A 61 -7.140 -7.428 -9.788 1.00 0.00 C ATOM 940 C SER A 61 -8.184 -6.677 -8.969 1.00 0.00 C ATOM 941 O SER A 61 -8.760 -7.222 -8.027 1.00 0.00 O ATOM 942 CB SER A 61 -5.734 -6.998 -9.363 1.00 0.00 C ATOM 943 OG SER A 61 -4.760 -7.453 -10.286 1.00 0.00 O ATOM 0 H SER A 61 -6.703 -6.496 -11.615 1.00 0.00 H new ATOM 0 HA SER A 61 -7.258 -8.495 -9.601 1.00 0.00 H new ATOM 0 HB2 SER A 61 -5.690 -5.911 -9.289 1.00 0.00 H new ATOM 0 HB3 SER A 61 -5.513 -7.394 -8.372 1.00 0.00 H new ATOM 0 HG SER A 61 -4.670 -6.803 -11.014 1.00 0.00 H new ATOM 949 N ILE A 62 -8.422 -5.422 -9.334 1.00 0.00 N ATOM 950 CA ILE A 62 -9.398 -4.595 -8.634 1.00 0.00 C ATOM 951 C ILE A 62 -10.092 -3.633 -9.593 1.00 0.00 C ATOM 952 O ILE A 62 -9.446 -2.811 -10.240 1.00 0.00 O ATOM 953 CB ILE A 62 -8.740 -3.786 -7.501 1.00 0.00 C ATOM 954 CG1 ILE A 62 -8.005 -4.721 -6.537 1.00 0.00 C ATOM 955 CG2 ILE A 62 -9.785 -2.967 -6.759 1.00 0.00 C ATOM 956 CD1 ILE A 62 -7.327 -3.999 -5.394 1.00 0.00 C ATOM 0 H ILE A 62 -7.953 -4.955 -10.110 1.00 0.00 H new ATOM 0 HA ILE A 62 -10.136 -5.273 -8.205 1.00 0.00 H new ATOM 0 HB ILE A 62 -8.013 -3.101 -7.938 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -8.715 -5.442 -6.131 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -7.258 -5.288 -7.092 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -9.304 -2.401 -5.961 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -10.268 -2.279 -7.453 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -10.533 -3.634 -6.331 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -6.827 -4.724 -4.752 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -6.593 -3.298 -5.791 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -8.072 -3.454 -4.814 1.00 0.00 H new ATOM 968 N ASN A 63 -11.414 -3.742 -9.676 1.00 0.00 N ATOM 969 CA ASN A 63 -12.198 -2.881 -10.555 1.00 0.00 C ATOM 970 C ASN A 63 -12.248 -1.455 -10.015 1.00 0.00 C ATOM 971 O ASN A 63 -12.907 -1.182 -9.011 1.00 0.00 O ATOM 972 CB ASN A 63 -13.617 -3.431 -10.708 1.00 0.00 C ATOM 973 CG ASN A 63 -14.379 -2.759 -11.835 1.00 0.00 C ATOM 974 OD1 ASN A 63 -13.839 -1.908 -12.543 1.00 0.00 O ATOM 975 ND2 ASN A 63 -15.639 -3.140 -12.007 1.00 0.00 N ATOM 0 H ASN A 63 -11.965 -4.417 -9.146 1.00 0.00 H new ATOM 0 HA ASN A 63 -11.715 -2.864 -11.532 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -13.570 -4.504 -10.894 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -14.160 -3.293 -9.773 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -16.201 -2.724 -12.750 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -16.045 -3.849 -11.396 1.00 0.00 H new ATOM 982 N LEU A 64 -11.549 -0.549 -10.689 1.00 0.00 N ATOM 983 CA LEU A 64 -11.513 0.851 -10.279 1.00 0.00 C ATOM 984 C LEU A 64 -12.919 1.370 -9.992 1.00 0.00 C ATOM 985 O LEU A 64 -13.121 2.177 -9.084 1.00 0.00 O ATOM 986 CB LEU A 64 -10.854 1.705 -11.363 1.00 0.00 C ATOM 987 CG LEU A 64 -9.403 1.360 -11.699 1.00 0.00 C ATOM 988 CD1 LEU A 64 -8.948 2.113 -12.939 1.00 0.00 C ATOM 989 CD2 LEU A 64 -8.493 1.673 -10.519 1.00 0.00 C ATOM 0 H LEU A 64 -10.999 -0.758 -11.522 1.00 0.00 H new ATOM 0 HA LEU A 64 -10.925 0.920 -9.364 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -11.447 1.621 -12.274 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -10.895 2.748 -11.051 1.00 0.00 H new ATOM 0 HG LEU A 64 -9.343 0.291 -11.906 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -7.913 1.854 -13.162 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -9.581 1.839 -13.783 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -9.024 3.186 -12.761 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -7.464 1.421 -10.776 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -8.558 2.735 -10.281 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -8.804 1.087 -9.654 1.00 0.00 H new ATOM 1001 N LYS A 65 -13.888 0.899 -10.769 1.00 0.00 N ATOM 1002 CA LYS A 65 -15.276 1.311 -10.598 1.00 0.00 C ATOM 1003 C LYS A 65 -15.808 0.877 -9.236 1.00 0.00 C ATOM 1004 O LYS A 65 -16.620 1.573 -8.627 1.00 0.00 O ATOM 1005 CB LYS A 65 -16.146 0.720 -11.709 1.00 0.00 C ATOM 1006 CG LYS A 65 -15.685 1.095 -13.107 1.00 0.00 C ATOM 1007 CD LYS A 65 -15.873 2.579 -13.377 1.00 0.00 C ATOM 1008 CE LYS A 65 -15.175 3.005 -14.659 1.00 0.00 C ATOM 1009 NZ LYS A 65 -15.699 4.301 -15.172 1.00 0.00 N ATOM 0 H LYS A 65 -13.737 0.231 -11.525 1.00 0.00 H new ATOM 0 HA LYS A 65 -15.315 2.399 -10.654 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -16.151 -0.366 -11.616 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -17.174 1.056 -11.572 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -14.634 0.833 -13.227 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -16.244 0.517 -13.843 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -16.937 2.805 -13.448 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -15.480 3.155 -12.539 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -14.104 3.093 -14.477 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -15.307 2.234 -15.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -15.198 4.556 -16.047 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -16.716 4.210 -15.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -15.550 5.043 -14.458 1.00 0.00 H new ATOM 1023 N GLU A 66 -15.344 -0.275 -8.764 1.00 0.00 N ATOM 1024 CA GLU A 66 -15.773 -0.800 -7.473 1.00 0.00 C ATOM 1025 C GLU A 66 -15.253 0.069 -6.332 1.00 0.00 C ATOM 1026 O GLU A 66 -15.815 0.074 -5.236 1.00 0.00 O ATOM 1027 CB GLU A 66 -15.287 -2.240 -7.295 1.00 0.00 C ATOM 1028 CG GLU A 66 -16.068 -3.252 -8.115 1.00 0.00 C ATOM 1029 CD GLU A 66 -17.336 -3.711 -7.421 1.00 0.00 C ATOM 1030 OE1 GLU A 66 -17.231 -4.330 -6.342 1.00 0.00 O ATOM 1031 OE2 GLU A 66 -18.433 -3.452 -7.959 1.00 0.00 O ATOM 0 H GLU A 66 -14.671 -0.863 -9.256 1.00 0.00 H new ATOM 0 HA GLU A 66 -16.863 -0.787 -7.449 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -14.234 -2.296 -7.572 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -15.354 -2.510 -6.241 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -16.325 -2.813 -9.079 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -15.435 -4.116 -8.317 1.00 0.00 H new ATOM 1038 N ILE A 67 -14.177 0.801 -6.597 1.00 0.00 N ATOM 1039 CA ILE A 67 -13.581 1.674 -5.593 1.00 0.00 C ATOM 1040 C ILE A 67 -13.894 3.138 -5.882 1.00 0.00 C ATOM 1041 O ILE A 67 -13.774 3.597 -7.017 1.00 0.00 O ATOM 1042 CB ILE A 67 -12.053 1.491 -5.524 1.00 0.00 C ATOM 1043 CG1 ILE A 67 -11.434 1.659 -6.913 1.00 0.00 C ATOM 1044 CG2 ILE A 67 -11.708 0.127 -4.945 1.00 0.00 C ATOM 1045 CD1 ILE A 67 -9.922 1.714 -6.898 1.00 0.00 C ATOM 0 H ILE A 67 -13.700 0.807 -7.498 1.00 0.00 H new ATOM 0 HA ILE A 67 -14.016 1.395 -4.633 1.00 0.00 H new ATOM 0 HB ILE A 67 -11.640 2.257 -4.868 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -11.753 0.832 -7.547 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -11.818 2.573 -7.365 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -10.625 0.013 -4.903 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -12.121 0.043 -3.940 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -12.131 -0.654 -5.577 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -9.552 1.834 -7.916 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -9.595 2.558 -6.291 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -9.528 0.789 -6.476 1.00 0.00 H new ATOM 1057 N ASN A 68 -14.295 3.867 -4.846 1.00 0.00 N ATOM 1058 CA ASN A 68 -14.624 5.281 -4.988 1.00 0.00 C ATOM 1059 C ASN A 68 -13.363 6.117 -5.183 1.00 0.00 C ATOM 1060 O ASN A 68 -12.767 6.597 -4.217 1.00 0.00 O ATOM 1061 CB ASN A 68 -15.391 5.774 -3.758 1.00 0.00 C ATOM 1062 CG ASN A 68 -16.564 4.878 -3.412 1.00 0.00 C ATOM 1063 OD1 ASN A 68 -17.646 5.004 -3.985 1.00 0.00 O ATOM 1064 ND2 ASN A 68 -16.354 3.967 -2.468 1.00 0.00 N ATOM 0 H ASN A 68 -14.400 3.502 -3.899 1.00 0.00 H new ATOM 0 HA ASN A 68 -15.253 5.394 -5.871 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -14.713 5.825 -2.906 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -15.752 6.786 -3.940 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -17.106 3.336 -2.192 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -15.440 3.898 -2.020 1.00 0.00 H new ATOM 1071 N LEU A 69 -12.961 6.287 -6.437 1.00 0.00 N ATOM 1072 CA LEU A 69 -11.770 7.065 -6.760 1.00 0.00 C ATOM 1073 C LEU A 69 -11.820 8.437 -6.096 1.00 0.00 C ATOM 1074 O LEU A 69 -10.798 8.958 -5.648 1.00 0.00 O ATOM 1075 CB LEU A 69 -11.636 7.224 -8.276 1.00 0.00 C ATOM 1076 CG LEU A 69 -11.293 5.955 -9.056 1.00 0.00 C ATOM 1077 CD1 LEU A 69 -11.646 6.120 -10.526 1.00 0.00 C ATOM 1078 CD2 LEU A 69 -9.819 5.613 -8.896 1.00 0.00 C ATOM 0 H LEU A 69 -13.442 5.897 -7.247 1.00 0.00 H new ATOM 0 HA LEU A 69 -10.901 6.528 -6.379 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -12.574 7.622 -8.664 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -10.866 7.969 -8.476 1.00 0.00 H new ATOM 0 HG LEU A 69 -11.883 5.133 -8.651 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -11.395 5.207 -11.065 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -12.714 6.317 -10.624 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -11.083 6.955 -10.944 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -9.593 4.707 -9.458 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -9.212 6.435 -9.274 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -9.595 5.451 -7.842 1.00 0.00 H new ATOM 1090 N ARG A 70 -13.014 9.016 -6.035 1.00 0.00 N ATOM 1091 CA ARG A 70 -13.197 10.328 -5.424 1.00 0.00 C ATOM 1092 C ARG A 70 -14.017 10.220 -4.142 1.00 0.00 C ATOM 1093 O ARG A 70 -15.241 10.358 -4.145 1.00 0.00 O ATOM 1094 CB ARG A 70 -13.886 11.279 -6.404 1.00 0.00 C ATOM 1095 CG ARG A 70 -13.687 12.748 -6.069 1.00 0.00 C ATOM 1096 CD ARG A 70 -12.521 13.343 -6.843 1.00 0.00 C ATOM 1097 NE ARG A 70 -12.520 12.921 -8.242 1.00 0.00 N ATOM 1098 CZ ARG A 70 -11.432 12.901 -9.003 1.00 0.00 C ATOM 1099 NH1 ARG A 70 -10.263 13.278 -8.504 1.00 0.00 N ATOM 1100 NH2 ARG A 70 -11.512 12.504 -10.266 1.00 0.00 N ATOM 0 H ARG A 70 -13.869 8.598 -6.401 1.00 0.00 H new ATOM 0 HA ARG A 70 -12.213 10.725 -5.174 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -13.507 11.090 -7.408 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -14.954 11.060 -6.420 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -14.598 13.301 -6.299 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -13.509 12.857 -4.999 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -12.570 14.431 -6.793 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -11.584 13.044 -6.373 1.00 0.00 H new ATOM 0 HE ARG A 70 -13.404 12.626 -8.657 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -10.198 13.584 -7.533 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -9.429 13.262 -9.091 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -12.410 12.214 -10.653 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -10.676 12.489 -10.850 1.00 0.00 H new ATOM 1114 N PRO A 71 -13.329 9.968 -3.018 1.00 0.00 N ATOM 1115 CA PRO A 71 -13.974 9.837 -1.708 1.00 0.00 C ATOM 1116 C PRO A 71 -14.517 11.165 -1.193 1.00 0.00 C ATOM 1117 O PRO A 71 -15.500 11.199 -0.454 1.00 0.00 O ATOM 1118 CB PRO A 71 -12.843 9.336 -0.805 1.00 0.00 C ATOM 1119 CG PRO A 71 -11.594 9.814 -1.462 1.00 0.00 C ATOM 1120 CD PRO A 71 -11.869 9.792 -2.940 1.00 0.00 C ATOM 0 HA PRO A 71 -14.837 9.172 -1.744 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -12.937 9.735 0.205 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -12.855 8.249 -0.721 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -11.337 10.819 -1.128 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -10.751 9.170 -1.212 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -11.340 10.591 -3.459 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -11.553 8.853 -3.394 1.00 0.00 H new ATOM 1128 N GLN A 72 -13.871 12.257 -1.589 1.00 0.00 N ATOM 1129 CA GLN A 72 -14.290 13.588 -1.167 1.00 0.00 C ATOM 1130 C GLN A 72 -14.241 13.718 0.352 1.00 0.00 C ATOM 1131 O GLN A 72 -15.075 14.394 0.954 1.00 0.00 O ATOM 1132 CB GLN A 72 -15.704 13.884 -1.671 1.00 0.00 C ATOM 1133 CG GLN A 72 -15.740 14.473 -3.072 1.00 0.00 C ATOM 1134 CD GLN A 72 -17.114 14.985 -3.454 1.00 0.00 C ATOM 1135 OE1 GLN A 72 -18.133 14.424 -3.051 1.00 0.00 O ATOM 1136 NE2 GLN A 72 -17.150 16.057 -4.238 1.00 0.00 N ATOM 0 H GLN A 72 -13.055 12.246 -2.201 1.00 0.00 H new ATOM 0 HA GLN A 72 -13.599 14.313 -1.598 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -16.286 12.962 -1.658 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -16.189 14.576 -0.982 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -15.021 15.290 -3.137 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -15.427 13.714 -3.789 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -16.281 16.491 -4.549 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -18.047 16.446 -4.529 1.00 0.00 H new ATOM 1145 N MET A 73 -13.259 13.066 0.965 1.00 0.00 N ATOM 1146 CA MET A 73 -13.102 13.109 2.414 1.00 0.00 C ATOM 1147 C MET A 73 -14.324 12.521 3.112 1.00 0.00 C ATOM 1148 O MET A 73 -14.895 13.139 4.010 1.00 0.00 O ATOM 1149 CB MET A 73 -12.877 14.549 2.881 1.00 0.00 C ATOM 1150 CG MET A 73 -11.512 15.104 2.506 1.00 0.00 C ATOM 1151 SD MET A 73 -10.253 14.746 3.746 1.00 0.00 S ATOM 1152 CE MET A 73 -9.457 13.317 3.017 1.00 0.00 C ATOM 0 H MET A 73 -12.560 12.502 0.481 1.00 0.00 H new ATOM 0 HA MET A 73 -12.232 12.508 2.678 1.00 0.00 H new ATOM 0 HB2 MET A 73 -13.650 15.186 2.451 1.00 0.00 H new ATOM 0 HB3 MET A 73 -12.993 14.593 3.964 1.00 0.00 H new ATOM 0 HG2 MET A 73 -11.204 14.684 1.549 1.00 0.00 H new ATOM 0 HG3 MET A 73 -11.587 16.183 2.371 1.00 0.00 H new ATOM 0 HE1 MET A 73 -8.401 13.311 3.287 1.00 0.00 H new ATOM 0 HE2 MET A 73 -9.931 12.408 3.387 1.00 0.00 H new ATOM 0 HE3 MET A 73 -9.554 13.361 1.932 1.00 0.00 H new ATOM 1162 N SER A 74 -14.720 11.324 2.693 1.00 0.00 N ATOM 1163 CA SER A 74 -15.877 10.654 3.275 1.00 0.00 C ATOM 1164 C SER A 74 -15.462 9.366 3.979 1.00 0.00 C ATOM 1165 O SER A 74 -15.384 8.306 3.360 1.00 0.00 O ATOM 1166 CB SER A 74 -16.913 10.346 2.192 1.00 0.00 C ATOM 1167 OG SER A 74 -17.790 11.441 1.999 1.00 0.00 O ATOM 0 H SER A 74 -14.257 10.798 1.952 1.00 0.00 H new ATOM 0 HA SER A 74 -16.321 11.323 4.012 1.00 0.00 H new ATOM 0 HB2 SER A 74 -16.406 10.113 1.256 1.00 0.00 H new ATOM 0 HB3 SER A 74 -17.486 9.462 2.473 1.00 0.00 H new ATOM 0 HG SER A 74 -18.441 11.220 1.301 1.00 0.00 H new ATOM 1173 N GLN A 75 -15.197 9.468 5.278 1.00 0.00 N ATOM 1174 CA GLN A 75 -14.789 8.312 6.067 1.00 0.00 C ATOM 1175 C GLN A 75 -15.504 7.050 5.593 1.00 0.00 C ATOM 1176 O GLN A 75 -14.877 6.012 5.381 1.00 0.00 O ATOM 1177 CB GLN A 75 -15.080 8.551 7.549 1.00 0.00 C ATOM 1178 CG GLN A 75 -14.892 7.315 8.413 1.00 0.00 C ATOM 1179 CD GLN A 75 -15.587 7.430 9.756 1.00 0.00 C ATOM 1180 OE1 GLN A 75 -16.808 7.575 9.826 1.00 0.00 O ATOM 1181 NE2 GLN A 75 -14.811 7.366 10.832 1.00 0.00 N ATOM 0 H GLN A 75 -15.258 10.339 5.806 1.00 0.00 H new ATOM 0 HA GLN A 75 -13.716 8.172 5.933 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -14.427 9.343 7.916 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -16.105 8.907 7.657 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -15.277 6.444 7.883 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -13.827 7.147 8.573 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -13.804 7.245 10.728 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -15.223 7.438 11.763 1.00 0.00 H new ATOM 1190 N PHE A 76 -16.819 7.147 5.430 1.00 0.00 N ATOM 1191 CA PHE A 76 -17.620 6.013 4.983 1.00 0.00 C ATOM 1192 C PHE A 76 -17.034 5.400 3.715 1.00 0.00 C ATOM 1193 O PHE A 76 -16.832 4.188 3.633 1.00 0.00 O ATOM 1194 CB PHE A 76 -19.065 6.449 4.732 1.00 0.00 C ATOM 1195 CG PHE A 76 -19.943 6.343 5.946 1.00 0.00 C ATOM 1196 CD1 PHE A 76 -19.602 6.990 7.122 1.00 0.00 C ATOM 1197 CD2 PHE A 76 -21.109 5.596 5.910 1.00 0.00 C ATOM 1198 CE1 PHE A 76 -20.408 6.893 8.241 1.00 0.00 C ATOM 1199 CE2 PHE A 76 -21.919 5.495 7.025 1.00 0.00 C ATOM 1200 CZ PHE A 76 -21.569 6.145 8.192 1.00 0.00 C ATOM 0 H PHE A 76 -17.353 7.999 5.601 1.00 0.00 H new ATOM 0 HA PHE A 76 -17.607 5.259 5.770 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -19.069 7.481 4.380 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -19.487 5.838 3.934 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -18.696 7.577 7.165 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -21.388 5.086 5.000 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -20.131 7.401 9.153 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -22.825 4.908 6.984 1.00 0.00 H new ATOM 0 HZ PHE A 76 -22.201 6.069 9.064 1.00 0.00 H new ATOM 1210 N LEU A 77 -16.763 6.246 2.727 1.00 0.00 N ATOM 1211 CA LEU A 77 -16.200 5.789 1.461 1.00 0.00 C ATOM 1212 C LEU A 77 -14.745 5.365 1.633 1.00 0.00 C ATOM 1213 O LEU A 77 -14.376 4.233 1.317 1.00 0.00 O ATOM 1214 CB LEU A 77 -16.300 6.893 0.407 1.00 0.00 C ATOM 1215 CG LEU A 77 -17.711 7.380 0.077 1.00 0.00 C ATOM 1216 CD1 LEU A 77 -17.657 8.597 -0.833 1.00 0.00 C ATOM 1217 CD2 LEU A 77 -18.522 6.265 -0.569 1.00 0.00 C ATOM 0 H LEU A 77 -16.924 7.252 2.778 1.00 0.00 H new ATOM 0 HA LEU A 77 -16.774 4.924 1.128 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -15.713 7.746 0.747 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -15.837 6.533 -0.512 1.00 0.00 H new ATOM 0 HG LEU A 77 -18.202 7.669 1.007 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -18.671 8.929 -1.057 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -17.114 9.400 -0.335 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -17.148 8.335 -1.761 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -19.524 6.629 -0.797 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -18.033 5.946 -1.490 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -18.590 5.421 0.117 1.00 0.00 H new ATOM 1229 N CYS A 78 -13.924 6.278 2.139 1.00 0.00 N ATOM 1230 CA CYS A 78 -12.509 5.999 2.355 1.00 0.00 C ATOM 1231 C CYS A 78 -12.317 4.628 2.995 1.00 0.00 C ATOM 1232 O CYS A 78 -11.616 3.771 2.455 1.00 0.00 O ATOM 1233 CB CYS A 78 -11.883 7.079 3.238 1.00 0.00 C ATOM 1234 SG CYS A 78 -11.319 8.538 2.332 1.00 0.00 S ATOM 0 H CYS A 78 -14.214 7.218 2.408 1.00 0.00 H new ATOM 0 HA CYS A 78 -12.012 6.000 1.385 1.00 0.00 H new ATOM 0 HB2 CYS A 78 -12.612 7.389 3.987 1.00 0.00 H new ATOM 0 HB3 CYS A 78 -11.038 6.649 3.775 1.00 0.00 H new ATOM 0 HG CYS A 78 -10.807 9.395 3.165 1.00 0.00 H new ATOM 1240 N LEU A 79 -12.943 4.427 4.149 1.00 0.00 N ATOM 1241 CA LEU A 79 -12.840 3.159 4.865 1.00 0.00 C ATOM 1242 C LEU A 79 -13.190 1.989 3.952 1.00 0.00 C ATOM 1243 O LEU A 79 -12.465 0.996 3.891 1.00 0.00 O ATOM 1244 CB LEU A 79 -13.764 3.164 6.084 1.00 0.00 C ATOM 1245 CG LEU A 79 -13.199 3.805 7.352 1.00 0.00 C ATOM 1246 CD1 LEU A 79 -14.269 3.893 8.428 1.00 0.00 C ATOM 1247 CD2 LEU A 79 -11.996 3.021 7.856 1.00 0.00 C ATOM 0 H LEU A 79 -13.527 5.125 4.609 1.00 0.00 H new ATOM 0 HA LEU A 79 -11.809 3.040 5.198 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -14.683 3.685 5.816 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -14.037 2.134 6.312 1.00 0.00 H new ATOM 0 HG LEU A 79 -12.873 4.816 7.110 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -13.848 4.352 9.323 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -15.100 4.499 8.066 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -14.627 2.892 8.668 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -11.607 3.492 8.759 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -12.297 1.998 8.081 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -11.221 3.011 7.090 1.00 0.00 H new ATOM 1259 N LYS A 80 -14.306 2.112 3.240 1.00 0.00 N ATOM 1260 CA LYS A 80 -14.751 1.067 2.327 1.00 0.00 C ATOM 1261 C LYS A 80 -13.664 0.734 1.310 1.00 0.00 C ATOM 1262 O LYS A 80 -13.245 -0.416 1.191 1.00 0.00 O ATOM 1263 CB LYS A 80 -16.026 1.504 1.602 1.00 0.00 C ATOM 1264 CG LYS A 80 -16.883 0.344 1.126 1.00 0.00 C ATOM 1265 CD LYS A 80 -16.372 -0.225 -0.187 1.00 0.00 C ATOM 1266 CE LYS A 80 -16.800 0.629 -1.370 1.00 0.00 C ATOM 1267 NZ LYS A 80 -18.209 0.357 -1.769 1.00 0.00 N ATOM 0 H LYS A 80 -14.919 2.926 3.279 1.00 0.00 H new ATOM 0 HA LYS A 80 -14.962 0.173 2.913 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -16.617 2.131 2.270 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -15.754 2.119 0.745 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -16.891 -0.439 1.884 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -17.913 0.678 1.002 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -15.284 -0.289 -0.158 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -16.748 -1.240 -0.315 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -16.692 1.683 -1.115 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -16.139 0.436 -2.215 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -18.463 0.959 -2.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -18.307 -0.643 -2.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -18.842 0.565 -0.971 1.00 0.00 H new ATOM 1281 N ASN A 81 -13.212 1.748 0.580 1.00 0.00 N ATOM 1282 CA ASN A 81 -12.173 1.562 -0.427 1.00 0.00 C ATOM 1283 C ASN A 81 -11.065 0.654 0.097 1.00 0.00 C ATOM 1284 O ASN A 81 -10.788 -0.399 -0.478 1.00 0.00 O ATOM 1285 CB ASN A 81 -11.587 2.914 -0.840 1.00 0.00 C ATOM 1286 CG ASN A 81 -12.638 3.853 -1.400 1.00 0.00 C ATOM 1287 OD1 ASN A 81 -13.828 3.537 -1.408 1.00 0.00 O ATOM 1288 ND2 ASN A 81 -12.202 5.014 -1.873 1.00 0.00 N ATOM 0 H ASN A 81 -13.549 2.707 0.667 1.00 0.00 H new ATOM 0 HA ASN A 81 -12.626 1.088 -1.298 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -11.111 3.379 0.023 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -10.809 2.757 -1.587 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -12.863 5.686 -2.263 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -11.206 5.234 -1.846 1.00 0.00 H new ATOM 1295 N ILE A 82 -10.435 1.068 1.192 1.00 0.00 N ATOM 1296 CA ILE A 82 -9.359 0.291 1.794 1.00 0.00 C ATOM 1297 C ILE A 82 -9.694 -1.197 1.803 1.00 0.00 C ATOM 1298 O ILE A 82 -8.988 -2.006 1.202 1.00 0.00 O ATOM 1299 CB ILE A 82 -9.072 0.750 3.235 1.00 0.00 C ATOM 1300 CG1 ILE A 82 -8.658 2.223 3.251 1.00 0.00 C ATOM 1301 CG2 ILE A 82 -7.989 -0.116 3.861 1.00 0.00 C ATOM 1302 CD1 ILE A 82 -8.726 2.855 4.624 1.00 0.00 C ATOM 0 H ILE A 82 -10.652 1.937 1.680 1.00 0.00 H new ATOM 0 HA ILE A 82 -8.470 0.457 1.185 1.00 0.00 H new ATOM 0 HB ILE A 82 -9.983 0.641 3.824 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -7.641 2.310 2.870 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -9.302 2.780 2.571 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -7.797 0.221 4.880 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -8.319 -1.155 3.878 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -7.074 -0.035 3.274 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -8.419 3.899 4.560 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -9.748 2.800 5.000 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -8.060 2.322 5.303 1.00 0.00 H new ATOM 1314 N ARG A 83 -10.777 -1.549 2.489 1.00 0.00 N ATOM 1315 CA ARG A 83 -11.206 -2.940 2.576 1.00 0.00 C ATOM 1316 C ARG A 83 -11.039 -3.646 1.234 1.00 0.00 C ATOM 1317 O ARG A 83 -10.388 -4.688 1.144 1.00 0.00 O ATOM 1318 CB ARG A 83 -12.666 -3.018 3.027 1.00 0.00 C ATOM 1319 CG ARG A 83 -12.954 -2.233 4.296 1.00 0.00 C ATOM 1320 CD ARG A 83 -14.071 -2.873 5.105 1.00 0.00 C ATOM 1321 NE ARG A 83 -13.766 -4.257 5.459 1.00 0.00 N ATOM 1322 CZ ARG A 83 -14.441 -4.949 6.370 1.00 0.00 C ATOM 1323 NH1 ARG A 83 -15.454 -4.388 7.017 1.00 0.00 N ATOM 1324 NH2 ARG A 83 -14.104 -6.204 6.637 1.00 0.00 N ATOM 0 H ARG A 83 -11.373 -0.891 2.992 1.00 0.00 H new ATOM 0 HA ARG A 83 -10.578 -3.442 3.312 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -13.305 -2.645 2.226 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -12.933 -4.063 3.188 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -12.050 -2.176 4.903 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -13.230 -1.211 4.038 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -14.238 -2.295 6.014 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -14.998 -2.841 4.532 1.00 0.00 H new ATOM 0 HE ARG A 83 -12.992 -4.717 4.980 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -15.716 -3.423 6.815 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -15.971 -4.922 7.716 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -13.325 -6.639 6.142 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -14.624 -6.734 7.337 1.00 0.00 H new ATOM 1338 N THR A 84 -11.631 -3.072 0.191 1.00 0.00 N ATOM 1339 CA THR A 84 -11.549 -3.647 -1.146 1.00 0.00 C ATOM 1340 C THR A 84 -10.161 -4.215 -1.416 1.00 0.00 C ATOM 1341 O THR A 84 -10.012 -5.398 -1.724 1.00 0.00 O ATOM 1342 CB THR A 84 -11.883 -2.602 -2.228 1.00 0.00 C ATOM 1343 OG1 THR A 84 -13.152 -1.999 -1.951 1.00 0.00 O ATOM 1344 CG2 THR A 84 -11.910 -3.242 -3.608 1.00 0.00 C ATOM 0 H THR A 84 -12.172 -2.209 0.247 1.00 0.00 H new ATOM 0 HA THR A 84 -12.283 -4.452 -1.189 1.00 0.00 H new ATOM 0 HB THR A 84 -11.107 -1.837 -2.215 1.00 0.00 H new ATOM 0 HG1 THR A 84 -13.356 -1.335 -2.642 1.00 0.00 H new ATOM 0 HG21 THR A 84 -12.148 -2.485 -4.355 1.00 0.00 H new ATOM 0 HG22 THR A 84 -10.934 -3.675 -3.828 1.00 0.00 H new ATOM 0 HG23 THR A 84 -12.668 -4.025 -3.631 1.00 0.00 H new ATOM 1352 N PHE A 85 -9.145 -3.365 -1.299 1.00 0.00 N ATOM 1353 CA PHE A 85 -7.768 -3.783 -1.531 1.00 0.00 C ATOM 1354 C PHE A 85 -7.415 -4.995 -0.674 1.00 0.00 C ATOM 1355 O PHE A 85 -7.040 -6.048 -1.191 1.00 0.00 O ATOM 1356 CB PHE A 85 -6.806 -2.633 -1.228 1.00 0.00 C ATOM 1357 CG PHE A 85 -5.383 -3.076 -1.035 1.00 0.00 C ATOM 1358 CD1 PHE A 85 -4.570 -3.334 -2.127 1.00 0.00 C ATOM 1359 CD2 PHE A 85 -4.860 -3.234 0.238 1.00 0.00 C ATOM 1360 CE1 PHE A 85 -3.262 -3.743 -1.952 1.00 0.00 C ATOM 1361 CE2 PHE A 85 -3.552 -3.642 0.419 1.00 0.00 C ATOM 1362 CZ PHE A 85 -2.751 -3.895 -0.678 1.00 0.00 C ATOM 0 H PHE A 85 -9.250 -2.383 -1.045 1.00 0.00 H new ATOM 0 HA PHE A 85 -7.672 -4.062 -2.580 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -6.846 -1.912 -2.044 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -7.142 -2.116 -0.329 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -4.963 -3.214 -3.126 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -5.481 -3.036 1.099 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -2.639 -3.944 -2.811 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -3.156 -3.763 1.417 1.00 0.00 H new ATOM 0 HZ PHE A 85 -1.728 -4.211 -0.540 1.00 0.00 H new ATOM 1372 N LEU A 86 -7.538 -4.839 0.640 1.00 0.00 N ATOM 1373 CA LEU A 86 -7.233 -5.919 1.571 1.00 0.00 C ATOM 1374 C LEU A 86 -7.959 -7.201 1.176 1.00 0.00 C ATOM 1375 O LEU A 86 -7.465 -8.305 1.405 1.00 0.00 O ATOM 1376 CB LEU A 86 -7.621 -5.517 2.995 1.00 0.00 C ATOM 1377 CG LEU A 86 -7.042 -4.196 3.501 1.00 0.00 C ATOM 1378 CD1 LEU A 86 -7.827 -3.694 4.703 1.00 0.00 C ATOM 1379 CD2 LEU A 86 -5.570 -4.359 3.854 1.00 0.00 C ATOM 0 H LEU A 86 -7.847 -3.974 1.084 1.00 0.00 H new ATOM 0 HA LEU A 86 -6.160 -6.105 1.533 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -8.708 -5.459 3.051 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -7.308 -6.311 3.673 1.00 0.00 H new ATOM 0 HG LEU A 86 -7.125 -3.457 2.704 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -7.400 -2.753 5.049 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -8.868 -3.538 4.418 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -7.777 -4.431 5.504 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -5.174 -3.409 4.212 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -5.464 -5.113 4.634 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -5.016 -4.672 2.969 1.00 0.00 H new ATOM 1391 N THR A 87 -9.137 -7.047 0.578 1.00 0.00 N ATOM 1392 CA THR A 87 -9.932 -8.191 0.149 1.00 0.00 C ATOM 1393 C THR A 87 -9.286 -8.895 -1.039 1.00 0.00 C ATOM 1394 O THR A 87 -8.984 -10.086 -0.977 1.00 0.00 O ATOM 1395 CB THR A 87 -11.362 -7.768 -0.235 1.00 0.00 C ATOM 1396 OG1 THR A 87 -11.850 -6.791 0.692 1.00 0.00 O ATOM 1397 CG2 THR A 87 -12.295 -8.970 -0.250 1.00 0.00 C ATOM 0 H THR A 87 -9.561 -6.141 0.380 1.00 0.00 H new ATOM 0 HA THR A 87 -9.979 -8.878 0.994 1.00 0.00 H new ATOM 0 HB THR A 87 -11.334 -7.336 -1.235 1.00 0.00 H new ATOM 0 HG1 THR A 87 -11.382 -5.942 0.549 1.00 0.00 H new ATOM 0 HG21 THR A 87 -13.300 -8.647 -0.524 1.00 0.00 H new ATOM 0 HG22 THR A 87 -11.937 -9.699 -0.977 1.00 0.00 H new ATOM 0 HG23 THR A 87 -12.317 -9.426 0.740 1.00 0.00 H new ATOM 1405 N ALA A 88 -9.076 -8.150 -2.120 1.00 0.00 N ATOM 1406 CA ALA A 88 -8.464 -8.703 -3.321 1.00 0.00 C ATOM 1407 C ALA A 88 -7.206 -9.496 -2.981 1.00 0.00 C ATOM 1408 O ALA A 88 -7.010 -10.608 -3.471 1.00 0.00 O ATOM 1409 CB ALA A 88 -8.139 -7.592 -4.307 1.00 0.00 C ATOM 0 H ALA A 88 -9.321 -7.162 -2.188 1.00 0.00 H new ATOM 0 HA ALA A 88 -9.178 -9.385 -3.782 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -7.682 -8.020 -5.200 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -9.056 -7.071 -4.583 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -7.446 -6.888 -3.846 1.00 0.00 H new ATOM 1415 N CYS A 89 -6.357 -8.916 -2.140 1.00 0.00 N ATOM 1416 CA CYS A 89 -5.116 -9.568 -1.735 1.00 0.00 C ATOM 1417 C CYS A 89 -5.354 -11.040 -1.417 1.00 0.00 C ATOM 1418 O CYS A 89 -4.432 -11.855 -1.475 1.00 0.00 O ATOM 1419 CB CYS A 89 -4.518 -8.861 -0.518 1.00 0.00 C ATOM 1420 SG CYS A 89 -3.432 -7.475 -0.928 1.00 0.00 S ATOM 0 H CYS A 89 -6.505 -7.996 -1.725 1.00 0.00 H new ATOM 0 HA CYS A 89 -4.413 -9.504 -2.565 1.00 0.00 H new ATOM 0 HB2 CYS A 89 -5.329 -8.498 0.113 1.00 0.00 H new ATOM 0 HB3 CYS A 89 -3.957 -9.587 0.071 1.00 0.00 H new ATOM 0 HG CYS A 89 -2.978 -6.941 0.167 1.00 0.00 H new ATOM 1426 N CYS A 90 -6.595 -11.374 -1.081 1.00 0.00 N ATOM 1427 CA CYS A 90 -6.954 -12.749 -0.752 1.00 0.00 C ATOM 1428 C CYS A 90 -7.751 -13.389 -1.884 1.00 0.00 C ATOM 1429 O CYS A 90 -7.761 -14.610 -2.034 1.00 0.00 O ATOM 1430 CB CYS A 90 -7.764 -12.790 0.545 1.00 0.00 C ATOM 1431 SG CYS A 90 -8.362 -14.437 0.990 1.00 0.00 S ATOM 0 H CYS A 90 -7.369 -10.712 -1.029 1.00 0.00 H new ATOM 0 HA CYS A 90 -6.033 -13.316 -0.615 1.00 0.00 H new ATOM 0 HB2 CYS A 90 -7.147 -12.407 1.358 1.00 0.00 H new ATOM 0 HB3 CYS A 90 -8.618 -12.119 0.449 1.00 0.00 H new ATOM 0 HG CYS A 90 -8.387 -15.190 -0.069 1.00 0.00 H new ATOM 1437 N GLU A 91 -8.418 -12.556 -2.676 1.00 0.00 N ATOM 1438 CA GLU A 91 -9.220 -13.042 -3.792 1.00 0.00 C ATOM 1439 C GLU A 91 -8.381 -13.136 -5.064 1.00 0.00 C ATOM 1440 O GLU A 91 -8.270 -14.201 -5.671 1.00 0.00 O ATOM 1441 CB GLU A 91 -10.420 -12.121 -4.026 1.00 0.00 C ATOM 1442 CG GLU A 91 -11.016 -11.562 -2.746 1.00 0.00 C ATOM 1443 CD GLU A 91 -12.500 -11.275 -2.870 1.00 0.00 C ATOM 1444 OE1 GLU A 91 -12.910 -10.707 -3.904 1.00 0.00 O ATOM 1445 OE2 GLU A 91 -13.251 -11.619 -1.933 1.00 0.00 O ATOM 0 H GLU A 91 -8.419 -11.542 -2.566 1.00 0.00 H new ATOM 0 HA GLU A 91 -9.581 -14.039 -3.540 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -10.113 -11.293 -4.666 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -11.191 -12.672 -4.565 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -10.853 -12.271 -1.934 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -10.493 -10.644 -2.477 1.00 0.00 H new ATOM 1452 N THR A 92 -7.793 -12.012 -5.462 1.00 0.00 N ATOM 1453 CA THR A 92 -6.967 -11.965 -6.662 1.00 0.00 C ATOM 1454 C THR A 92 -5.679 -12.759 -6.473 1.00 0.00 C ATOM 1455 O THR A 92 -5.315 -13.580 -7.314 1.00 0.00 O ATOM 1456 CB THR A 92 -6.612 -10.516 -7.044 1.00 0.00 C ATOM 1457 OG1 THR A 92 -7.808 -9.755 -7.241 1.00 0.00 O ATOM 1458 CG2 THR A 92 -5.768 -10.481 -8.309 1.00 0.00 C ATOM 0 H THR A 92 -7.874 -11.122 -4.971 1.00 0.00 H new ATOM 0 HA THR A 92 -7.552 -12.411 -7.466 1.00 0.00 H new ATOM 0 HB THR A 92 -6.034 -10.080 -6.229 1.00 0.00 H new ATOM 0 HG1 THR A 92 -8.171 -9.941 -8.132 1.00 0.00 H new ATOM 0 HG21 THR A 92 -5.530 -9.447 -8.559 1.00 0.00 H new ATOM 0 HG22 THR A 92 -4.845 -11.037 -8.146 1.00 0.00 H new ATOM 0 HG23 THR A 92 -6.324 -10.934 -9.130 1.00 0.00 H new ATOM 1466 N PHE A 93 -4.993 -12.509 -5.363 1.00 0.00 N ATOM 1467 CA PHE A 93 -3.744 -13.200 -5.063 1.00 0.00 C ATOM 1468 C PHE A 93 -3.993 -14.410 -4.168 1.00 0.00 C ATOM 1469 O PHE A 93 -3.814 -15.553 -4.586 1.00 0.00 O ATOM 1470 CB PHE A 93 -2.757 -12.246 -4.387 1.00 0.00 C ATOM 1471 CG PHE A 93 -2.260 -11.156 -5.294 1.00 0.00 C ATOM 1472 CD1 PHE A 93 -3.103 -10.131 -5.692 1.00 0.00 C ATOM 1473 CD2 PHE A 93 -0.951 -11.158 -5.747 1.00 0.00 C ATOM 1474 CE1 PHE A 93 -2.648 -9.126 -6.526 1.00 0.00 C ATOM 1475 CE2 PHE A 93 -0.491 -10.156 -6.581 1.00 0.00 C ATOM 1476 CZ PHE A 93 -1.341 -9.139 -6.972 1.00 0.00 C ATOM 0 H PHE A 93 -5.281 -11.833 -4.656 1.00 0.00 H new ATOM 0 HA PHE A 93 -3.316 -13.547 -6.003 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -3.237 -11.795 -3.519 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -1.905 -12.818 -4.019 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -4.126 -10.117 -5.347 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -0.283 -11.951 -5.445 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -3.314 -8.332 -6.828 1.00 0.00 H new ATOM 0 HE2 PHE A 93 0.532 -10.168 -6.927 1.00 0.00 H new ATOM 0 HZ PHE A 93 -0.984 -8.356 -7.625 1.00 0.00 H new ATOM 1486 N GLY A 94 -4.409 -14.149 -2.932 1.00 0.00 N ATOM 1487 CA GLY A 94 -4.675 -15.225 -1.996 1.00 0.00 C ATOM 1488 C GLY A 94 -3.665 -15.275 -0.867 1.00 0.00 C ATOM 1489 O GLY A 94 -3.003 -16.292 -0.663 1.00 0.00 O ATOM 0 H GLY A 94 -4.566 -13.211 -2.563 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -5.675 -15.101 -1.580 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -4.667 -16.176 -2.529 1.00 0.00 H new ATOM 1493 N MET A 95 -3.546 -14.174 -0.132 1.00 0.00 N ATOM 1494 CA MET A 95 -2.609 -14.097 0.982 1.00 0.00 C ATOM 1495 C MET A 95 -3.320 -14.342 2.309 1.00 0.00 C ATOM 1496 O MET A 95 -4.522 -14.605 2.340 1.00 0.00 O ATOM 1497 CB MET A 95 -1.920 -12.731 1.004 1.00 0.00 C ATOM 1498 CG MET A 95 -0.737 -12.632 0.055 1.00 0.00 C ATOM 1499 SD MET A 95 -0.129 -10.944 -0.123 1.00 0.00 S ATOM 1500 CE MET A 95 0.691 -10.711 1.452 1.00 0.00 C ATOM 0 H MET A 95 -4.087 -13.323 -0.288 1.00 0.00 H new ATOM 0 HA MET A 95 -1.856 -14.873 0.845 1.00 0.00 H new ATOM 0 HB2 MET A 95 -2.648 -11.962 0.746 1.00 0.00 H new ATOM 0 HB3 MET A 95 -1.580 -12.521 2.018 1.00 0.00 H new ATOM 0 HG2 MET A 95 0.070 -13.268 0.419 1.00 0.00 H new ATOM 0 HG3 MET A 95 -1.028 -13.014 -0.923 1.00 0.00 H new ATOM 0 HE1 MET A 95 1.150 -9.723 1.481 1.00 0.00 H new ATOM 0 HE2 MET A 95 -0.038 -10.796 2.258 1.00 0.00 H new ATOM 0 HE3 MET A 95 1.461 -11.472 1.578 1.00 0.00 H new ATOM 1510 N ARG A 96 -2.570 -14.255 3.403 1.00 0.00 N ATOM 1511 CA ARG A 96 -3.129 -14.469 4.732 1.00 0.00 C ATOM 1512 C ARG A 96 -3.662 -13.163 5.314 1.00 0.00 C ATOM 1513 O ARG A 96 -2.901 -12.231 5.576 1.00 0.00 O ATOM 1514 CB ARG A 96 -2.071 -15.062 5.664 1.00 0.00 C ATOM 1515 CG ARG A 96 -1.738 -16.514 5.363 1.00 0.00 C ATOM 1516 CD ARG A 96 -0.845 -17.115 6.437 1.00 0.00 C ATOM 1517 NE ARG A 96 -1.055 -18.553 6.581 1.00 0.00 N ATOM 1518 CZ ARG A 96 -2.150 -19.086 7.112 1.00 0.00 C ATOM 1519 NH1 ARG A 96 -3.130 -18.304 7.544 1.00 0.00 N ATOM 1520 NH2 ARG A 96 -2.268 -20.404 7.209 1.00 0.00 N ATOM 0 H ARG A 96 -1.573 -14.038 3.395 1.00 0.00 H new ATOM 0 HA ARG A 96 -3.958 -15.171 4.642 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -1.161 -14.467 5.591 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -2.421 -14.984 6.693 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -2.659 -17.092 5.289 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -1.241 -16.581 4.395 1.00 0.00 H new ATOM 0 HD2 ARG A 96 0.199 -16.924 6.189 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -1.042 -16.623 7.389 1.00 0.00 H new ATOM 0 HE ARG A 96 -0.321 -19.182 6.256 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -3.044 -17.290 7.469 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -3.969 -18.716 7.951 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -1.518 -21.009 6.876 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -3.109 -20.812 7.617 1.00 0.00 H new ATOM 1534 N LYS A 97 -4.974 -13.102 5.514 1.00 0.00 N ATOM 1535 CA LYS A 97 -5.610 -11.912 6.066 1.00 0.00 C ATOM 1536 C LYS A 97 -4.885 -11.441 7.323 1.00 0.00 C ATOM 1537 O LYS A 97 -4.729 -10.241 7.548 1.00 0.00 O ATOM 1538 CB LYS A 97 -7.079 -12.195 6.388 1.00 0.00 C ATOM 1539 CG LYS A 97 -7.962 -10.961 6.339 1.00 0.00 C ATOM 1540 CD LYS A 97 -9.263 -11.175 7.094 1.00 0.00 C ATOM 1541 CE LYS A 97 -9.930 -9.853 7.441 1.00 0.00 C ATOM 1542 NZ LYS A 97 -10.830 -9.383 6.352 1.00 0.00 N ATOM 0 H LYS A 97 -5.618 -13.864 5.302 1.00 0.00 H new ATOM 0 HA LYS A 97 -5.555 -11.122 5.318 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -7.461 -12.933 5.682 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -7.145 -12.639 7.381 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -7.427 -10.113 6.767 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -8.180 -10.710 5.301 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -9.941 -11.778 6.490 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -9.067 -11.736 8.008 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -10.502 -9.966 8.362 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -9.166 -9.099 7.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -11.265 -8.479 6.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -10.280 -9.251 5.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -11.575 -10.090 6.188 1.00 0.00 H new ATOM 1556 N SER A 98 -4.444 -12.394 8.138 1.00 0.00 N ATOM 1557 CA SER A 98 -3.737 -12.076 9.374 1.00 0.00 C ATOM 1558 C SER A 98 -2.538 -11.174 9.098 1.00 0.00 C ATOM 1559 O SER A 98 -2.192 -10.318 9.911 1.00 0.00 O ATOM 1560 CB SER A 98 -3.275 -13.359 10.067 1.00 0.00 C ATOM 1561 OG SER A 98 -2.609 -13.071 11.283 1.00 0.00 O ATOM 0 H SER A 98 -4.564 -13.392 7.965 1.00 0.00 H new ATOM 0 HA SER A 98 -4.426 -11.545 10.031 1.00 0.00 H new ATOM 0 HB2 SER A 98 -4.135 -14.000 10.263 1.00 0.00 H new ATOM 0 HB3 SER A 98 -2.608 -13.913 9.406 1.00 0.00 H new ATOM 0 HG SER A 98 -2.325 -13.908 11.707 1.00 0.00 H new ATOM 1567 N GLU A 99 -1.909 -11.373 7.944 1.00 0.00 N ATOM 1568 CA GLU A 99 -0.749 -10.578 7.560 1.00 0.00 C ATOM 1569 C GLU A 99 -1.162 -9.159 7.181 1.00 0.00 C ATOM 1570 O GLU A 99 -0.457 -8.194 7.480 1.00 0.00 O ATOM 1571 CB GLU A 99 -0.016 -11.237 6.390 1.00 0.00 C ATOM 1572 CG GLU A 99 0.622 -12.570 6.744 1.00 0.00 C ATOM 1573 CD GLU A 99 1.446 -12.503 8.015 1.00 0.00 C ATOM 1574 OE1 GLU A 99 2.225 -11.540 8.168 1.00 0.00 O ATOM 1575 OE2 GLU A 99 1.310 -13.415 8.858 1.00 0.00 O ATOM 0 H GLU A 99 -2.183 -12.078 7.259 1.00 0.00 H new ATOM 0 HA GLU A 99 -0.078 -10.525 8.417 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -0.719 -11.386 5.570 1.00 0.00 H new ATOM 0 HB3 GLU A 99 0.757 -10.559 6.028 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -0.158 -13.322 6.860 1.00 0.00 H new ATOM 0 HG3 GLU A 99 1.258 -12.895 5.920 1.00 0.00 H new ATOM 1582 N LEU A 100 -2.308 -9.040 6.521 1.00 0.00 N ATOM 1583 CA LEU A 100 -2.817 -7.739 6.099 1.00 0.00 C ATOM 1584 C LEU A 100 -2.892 -6.775 7.280 1.00 0.00 C ATOM 1585 O LEU A 100 -2.844 -7.191 8.438 1.00 0.00 O ATOM 1586 CB LEU A 100 -4.199 -7.891 5.462 1.00 0.00 C ATOM 1587 CG LEU A 100 -4.306 -8.910 4.327 1.00 0.00 C ATOM 1588 CD1 LEU A 100 -5.715 -8.927 3.756 1.00 0.00 C ATOM 1589 CD2 LEU A 100 -3.290 -8.601 3.236 1.00 0.00 C ATOM 0 H LEU A 100 -2.903 -9.828 6.266 1.00 0.00 H new ATOM 0 HA LEU A 100 -2.127 -7.329 5.361 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -4.908 -8.170 6.242 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -4.510 -6.918 5.081 1.00 0.00 H new ATOM 0 HG LEU A 100 -4.088 -9.899 4.730 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -5.772 -9.658 2.949 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -6.422 -9.196 4.540 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -5.962 -7.939 3.368 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -3.380 -9.336 2.436 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -3.477 -7.605 2.836 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -2.284 -8.641 3.654 1.00 0.00 H new ATOM 1601 N PHE A 101 -3.012 -5.487 6.978 1.00 0.00 N ATOM 1602 CA PHE A 101 -3.095 -4.464 8.014 1.00 0.00 C ATOM 1603 C PHE A 101 -4.550 -4.144 8.347 1.00 0.00 C ATOM 1604 O PHE A 101 -5.461 -4.509 7.605 1.00 0.00 O ATOM 1605 CB PHE A 101 -2.372 -3.193 7.565 1.00 0.00 C ATOM 1606 CG PHE A 101 -2.860 -2.659 6.248 1.00 0.00 C ATOM 1607 CD1 PHE A 101 -3.942 -1.794 6.195 1.00 0.00 C ATOM 1608 CD2 PHE A 101 -2.238 -3.022 5.065 1.00 0.00 C ATOM 1609 CE1 PHE A 101 -4.393 -1.300 4.985 1.00 0.00 C ATOM 1610 CE2 PHE A 101 -2.685 -2.531 3.852 1.00 0.00 C ATOM 1611 CZ PHE A 101 -3.764 -1.670 3.812 1.00 0.00 C ATOM 0 H PHE A 101 -3.054 -5.127 6.025 1.00 0.00 H new ATOM 0 HA PHE A 101 -2.612 -4.851 8.911 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -2.497 -2.425 8.328 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -1.304 -3.399 7.491 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -4.438 -1.503 7.109 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -1.395 -3.696 5.090 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -5.236 -0.626 4.957 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -2.191 -2.821 2.937 1.00 0.00 H new ATOM 0 HZ PHE A 101 -4.115 -1.287 2.865 1.00 0.00 H new ATOM 1621 N GLU A 102 -4.758 -3.461 9.468 1.00 0.00 N ATOM 1622 CA GLU A 102 -6.101 -3.094 9.900 1.00 0.00 C ATOM 1623 C GLU A 102 -6.646 -1.940 9.063 1.00 0.00 C ATOM 1624 O GLU A 102 -5.911 -1.021 8.701 1.00 0.00 O ATOM 1625 CB GLU A 102 -6.097 -2.706 11.380 1.00 0.00 C ATOM 1626 CG GLU A 102 -5.922 -3.888 12.319 1.00 0.00 C ATOM 1627 CD GLU A 102 -7.183 -4.720 12.451 1.00 0.00 C ATOM 1628 OE1 GLU A 102 -7.751 -5.107 11.408 1.00 0.00 O ATOM 1629 OE2 GLU A 102 -7.601 -4.983 13.598 1.00 0.00 O ATOM 0 H GLU A 102 -4.014 -3.151 10.093 1.00 0.00 H new ATOM 0 HA GLU A 102 -6.748 -3.960 9.760 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -5.294 -1.990 11.557 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -7.033 -2.200 11.617 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -5.111 -4.519 11.955 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -5.626 -3.525 13.303 1.00 0.00 H new ATOM 1636 N ALA A 103 -7.938 -1.996 8.758 1.00 0.00 N ATOM 1637 CA ALA A 103 -8.582 -0.957 7.965 1.00 0.00 C ATOM 1638 C ALA A 103 -8.389 0.417 8.599 1.00 0.00 C ATOM 1639 O ALA A 103 -8.327 1.430 7.903 1.00 0.00 O ATOM 1640 CB ALA A 103 -10.063 -1.260 7.799 1.00 0.00 C ATOM 0 H ALA A 103 -8.560 -2.751 9.048 1.00 0.00 H new ATOM 0 HA ALA A 103 -8.113 -0.944 6.981 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -10.531 -0.475 7.204 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -10.184 -2.218 7.294 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -10.538 -1.304 8.779 1.00 0.00 H new ATOM 1646 N PHE A 104 -8.296 0.443 9.925 1.00 0.00 N ATOM 1647 CA PHE A 104 -8.112 1.693 10.654 1.00 0.00 C ATOM 1648 C PHE A 104 -6.653 2.137 10.612 1.00 0.00 C ATOM 1649 O PHE A 104 -6.344 3.252 10.192 1.00 0.00 O ATOM 1650 CB PHE A 104 -8.567 1.532 12.106 1.00 0.00 C ATOM 1651 CG PHE A 104 -8.970 2.826 12.754 1.00 0.00 C ATOM 1652 CD1 PHE A 104 -10.165 3.441 12.419 1.00 0.00 C ATOM 1653 CD2 PHE A 104 -8.153 3.427 13.698 1.00 0.00 C ATOM 1654 CE1 PHE A 104 -10.539 4.632 13.014 1.00 0.00 C ATOM 1655 CE2 PHE A 104 -8.521 4.617 14.296 1.00 0.00 C ATOM 1656 CZ PHE A 104 -9.715 5.221 13.953 1.00 0.00 C ATOM 0 H PHE A 104 -8.345 -0.387 10.516 1.00 0.00 H new ATOM 0 HA PHE A 104 -8.720 2.459 10.173 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -9.408 0.840 12.140 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -7.760 1.081 12.684 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -10.812 2.985 11.684 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -7.218 2.960 13.969 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -11.474 5.101 12.745 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -7.876 5.075 15.031 1.00 0.00 H new ATOM 0 HZ PHE A 104 -10.004 6.152 14.418 1.00 0.00 H new ATOM 1666 N ASP A 105 -5.760 1.257 11.051 1.00 0.00 N ATOM 1667 CA ASP A 105 -4.333 1.557 11.065 1.00 0.00 C ATOM 1668 C ASP A 105 -3.950 2.428 9.873 1.00 0.00 C ATOM 1669 O ASP A 105 -3.193 3.390 10.011 1.00 0.00 O ATOM 1670 CB ASP A 105 -3.518 0.262 11.049 1.00 0.00 C ATOM 1671 CG ASP A 105 -2.173 0.434 10.372 1.00 0.00 C ATOM 1672 OD1 ASP A 105 -1.567 1.515 10.522 1.00 0.00 O ATOM 1673 OD2 ASP A 105 -1.726 -0.513 9.690 1.00 0.00 O ATOM 0 H ASP A 105 -5.999 0.330 11.402 1.00 0.00 H new ATOM 0 HA ASP A 105 -4.111 2.106 11.980 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -3.365 -0.081 12.072 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -4.084 -0.514 10.534 1.00 0.00 H new ATOM 1678 N LEU A 106 -4.477 2.085 8.702 1.00 0.00 N ATOM 1679 CA LEU A 106 -4.189 2.835 7.485 1.00 0.00 C ATOM 1680 C LEU A 106 -4.947 4.159 7.469 1.00 0.00 C ATOM 1681 O LEU A 106 -4.381 5.207 7.156 1.00 0.00 O ATOM 1682 CB LEU A 106 -4.560 2.008 6.253 1.00 0.00 C ATOM 1683 CG LEU A 106 -4.264 2.652 4.898 1.00 0.00 C ATOM 1684 CD1 LEU A 106 -2.785 2.536 4.564 1.00 0.00 C ATOM 1685 CD2 LEU A 106 -5.110 2.012 3.807 1.00 0.00 C ATOM 0 H LEU A 106 -5.106 1.293 8.570 1.00 0.00 H new ATOM 0 HA LEU A 106 -3.120 3.049 7.464 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -4.029 1.058 6.305 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -5.625 1.781 6.300 1.00 0.00 H new ATOM 0 HG LEU A 106 -4.521 3.710 4.956 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -2.593 3.000 3.596 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -2.198 3.041 5.331 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.502 1.484 4.525 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -4.886 2.483 2.850 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -4.884 0.947 3.749 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -6.166 2.147 4.039 1.00 0.00 H new ATOM 1697 N PHE A 107 -6.230 4.105 7.811 1.00 0.00 N ATOM 1698 CA PHE A 107 -7.065 5.300 7.838 1.00 0.00 C ATOM 1699 C PHE A 107 -6.498 6.338 8.802 1.00 0.00 C ATOM 1700 O PHE A 107 -6.207 7.469 8.412 1.00 0.00 O ATOM 1701 CB PHE A 107 -8.496 4.939 8.243 1.00 0.00 C ATOM 1702 CG PHE A 107 -9.493 6.022 7.949 1.00 0.00 C ATOM 1703 CD1 PHE A 107 -9.536 6.624 6.702 1.00 0.00 C ATOM 1704 CD2 PHE A 107 -10.389 6.439 8.921 1.00 0.00 C ATOM 1705 CE1 PHE A 107 -10.452 7.622 6.430 1.00 0.00 C ATOM 1706 CE2 PHE A 107 -11.308 7.436 8.654 1.00 0.00 C ATOM 1707 CZ PHE A 107 -11.340 8.028 7.407 1.00 0.00 C ATOM 0 H PHE A 107 -6.714 3.246 8.073 1.00 0.00 H new ATOM 0 HA PHE A 107 -7.076 5.728 6.836 1.00 0.00 H new ATOM 0 HB2 PHE A 107 -8.794 4.030 7.721 1.00 0.00 H new ATOM 0 HB3 PHE A 107 -8.518 4.716 9.310 1.00 0.00 H new ATOM 0 HD1 PHE A 107 -8.845 6.310 5.933 1.00 0.00 H new ATOM 0 HD2 PHE A 107 -10.369 5.979 9.898 1.00 0.00 H new ATOM 0 HE1 PHE A 107 -10.474 8.084 5.454 1.00 0.00 H new ATOM 0 HE2 PHE A 107 -12.001 7.752 9.420 1.00 0.00 H new ATOM 0 HZ PHE A 107 -12.058 8.807 7.196 1.00 0.00 H new ATOM 1717 N ASP A 108 -6.346 5.945 10.062 1.00 0.00 N ATOM 1718 CA ASP A 108 -5.814 6.841 11.082 1.00 0.00 C ATOM 1719 C ASP A 108 -4.290 6.771 11.125 1.00 0.00 C ATOM 1720 O ASP A 108 -3.664 7.228 12.082 1.00 0.00 O ATOM 1721 CB ASP A 108 -6.392 6.487 12.453 1.00 0.00 C ATOM 1722 CG ASP A 108 -7.719 7.171 12.716 1.00 0.00 C ATOM 1723 OD1 ASP A 108 -8.578 7.166 11.809 1.00 0.00 O ATOM 1724 OD2 ASP A 108 -7.899 7.711 13.827 1.00 0.00 O ATOM 0 H ASP A 108 -6.583 5.013 10.401 1.00 0.00 H new ATOM 0 HA ASP A 108 -6.106 7.859 10.825 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -6.524 5.407 12.521 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -5.680 6.771 13.228 1.00 0.00 H new ATOM 1729 N VAL A 109 -3.699 6.196 10.083 1.00 0.00 N ATOM 1730 CA VAL A 109 -2.249 6.066 10.002 1.00 0.00 C ATOM 1731 C VAL A 109 -1.642 5.814 11.377 1.00 0.00 C ATOM 1732 O VAL A 109 -0.701 6.495 11.786 1.00 0.00 O ATOM 1733 CB VAL A 109 -1.607 7.326 9.392 1.00 0.00 C ATOM 1734 CG1 VAL A 109 -0.166 7.050 8.991 1.00 0.00 C ATOM 1735 CG2 VAL A 109 -2.417 7.813 8.200 1.00 0.00 C ATOM 0 H VAL A 109 -4.202 5.813 9.283 1.00 0.00 H new ATOM 0 HA VAL A 109 -2.043 5.213 9.356 1.00 0.00 H new ATOM 0 HB VAL A 109 -1.605 8.113 10.146 1.00 0.00 H new ATOM 0 HG11 VAL A 109 0.271 7.952 8.562 1.00 0.00 H new ATOM 0 HG12 VAL A 109 0.406 6.752 9.870 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -0.141 6.248 8.253 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -1.949 8.704 7.782 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -2.453 7.032 7.441 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -3.430 8.053 8.522 1.00 0.00 H new ATOM 1745 N ARG A 110 -2.187 4.832 12.087 1.00 0.00 N ATOM 1746 CA ARG A 110 -1.699 4.490 13.418 1.00 0.00 C ATOM 1747 C ARG A 110 -0.418 3.664 13.332 1.00 0.00 C ATOM 1748 O ARG A 110 0.638 4.089 13.801 1.00 0.00 O ATOM 1749 CB ARG A 110 -2.767 3.715 14.192 1.00 0.00 C ATOM 1750 CG ARG A 110 -4.112 4.420 14.246 1.00 0.00 C ATOM 1751 CD ARG A 110 -4.185 5.393 15.412 1.00 0.00 C ATOM 1752 NE ARG A 110 -3.626 6.699 15.071 1.00 0.00 N ATOM 1753 CZ ARG A 110 -3.260 7.600 15.975 1.00 0.00 C ATOM 1754 NH1 ARG A 110 -3.395 7.339 17.268 1.00 0.00 N ATOM 1755 NH2 ARG A 110 -2.759 8.766 15.587 1.00 0.00 N ATOM 0 H ARG A 110 -2.966 4.259 11.763 1.00 0.00 H new ATOM 0 HA ARG A 110 -1.478 5.418 13.946 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -2.898 2.736 13.732 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -2.415 3.545 15.209 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -4.281 4.956 13.312 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -4.908 3.681 14.337 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -5.224 5.513 15.720 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -3.646 4.979 16.264 1.00 0.00 H new ATOM 0 HE ARG A 110 -3.511 6.931 14.085 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -3.781 6.444 17.570 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -3.113 8.033 17.960 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -2.655 8.971 14.593 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -2.478 9.457 16.283 1.00 0.00 H new ATOM 1769 N ASP A 111 -0.521 2.484 12.732 1.00 0.00 N ATOM 1770 CA ASP A 111 0.629 1.599 12.584 1.00 0.00 C ATOM 1771 C ASP A 111 0.909 1.313 11.112 1.00 0.00 C ATOM 1772 O ASP A 111 0.715 0.193 10.639 1.00 0.00 O ATOM 1773 CB ASP A 111 0.390 0.288 13.335 1.00 0.00 C ATOM 1774 CG ASP A 111 0.238 0.496 14.829 1.00 0.00 C ATOM 1775 OD1 ASP A 111 -0.622 1.307 15.230 1.00 0.00 O ATOM 1776 OD2 ASP A 111 0.979 -0.153 15.597 1.00 0.00 O ATOM 0 H ASP A 111 -1.389 2.118 12.340 1.00 0.00 H new ATOM 0 HA ASP A 111 1.499 2.099 13.010 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -0.507 -0.192 12.945 1.00 0.00 H new ATOM 0 HB3 ASP A 111 1.222 -0.391 13.148 1.00 0.00 H new ATOM 1781 N PHE A 112 1.365 2.333 10.393 1.00 0.00 N ATOM 1782 CA PHE A 112 1.670 2.192 8.974 1.00 0.00 C ATOM 1783 C PHE A 112 2.511 0.945 8.720 1.00 0.00 C ATOM 1784 O PHE A 112 2.382 0.296 7.682 1.00 0.00 O ATOM 1785 CB PHE A 112 2.408 3.431 8.463 1.00 0.00 C ATOM 1786 CG PHE A 112 2.601 3.443 6.974 1.00 0.00 C ATOM 1787 CD1 PHE A 112 1.523 3.268 6.121 1.00 0.00 C ATOM 1788 CD2 PHE A 112 3.860 3.629 6.427 1.00 0.00 C ATOM 1789 CE1 PHE A 112 1.699 3.277 4.750 1.00 0.00 C ATOM 1790 CE2 PHE A 112 4.042 3.640 5.056 1.00 0.00 C ATOM 1791 CZ PHE A 112 2.959 3.465 4.217 1.00 0.00 C ATOM 0 H PHE A 112 1.532 3.266 10.769 1.00 0.00 H new ATOM 0 HA PHE A 112 0.728 2.090 8.434 1.00 0.00 H new ATOM 0 HB2 PHE A 112 1.852 4.322 8.756 1.00 0.00 H new ATOM 0 HB3 PHE A 112 3.382 3.489 8.948 1.00 0.00 H new ATOM 0 HD1 PHE A 112 0.535 3.123 6.532 1.00 0.00 H new ATOM 0 HD2 PHE A 112 4.710 3.767 7.079 1.00 0.00 H new ATOM 0 HE1 PHE A 112 0.851 3.137 4.096 1.00 0.00 H new ATOM 0 HE2 PHE A 112 5.029 3.785 4.642 1.00 0.00 H new ATOM 0 HZ PHE A 112 3.097 3.475 3.146 1.00 0.00 H new ATOM 1801 N GLY A 113 3.375 0.616 9.676 1.00 0.00 N ATOM 1802 CA GLY A 113 4.226 -0.552 9.537 1.00 0.00 C ATOM 1803 C GLY A 113 3.481 -1.749 8.979 1.00 0.00 C ATOM 1804 O GLY A 113 3.922 -2.367 8.010 1.00 0.00 O ATOM 0 H GLY A 113 3.501 1.137 10.544 1.00 0.00 H new ATOM 0 HA2 GLY A 113 5.064 -0.312 8.882 1.00 0.00 H new ATOM 0 HA3 GLY A 113 4.645 -0.810 10.509 1.00 0.00 H new ATOM 1808 N LYS A 114 2.350 -2.079 9.593 1.00 0.00 N ATOM 1809 CA LYS A 114 1.542 -3.210 9.153 1.00 0.00 C ATOM 1810 C LYS A 114 1.309 -3.159 7.647 1.00 0.00 C ATOM 1811 O LYS A 114 1.246 -4.194 6.983 1.00 0.00 O ATOM 1812 CB LYS A 114 0.200 -3.220 9.888 1.00 0.00 C ATOM 1813 CG LYS A 114 0.265 -3.855 11.266 1.00 0.00 C ATOM 1814 CD LYS A 114 0.682 -2.848 12.325 1.00 0.00 C ATOM 1815 CE LYS A 114 0.908 -3.517 13.672 1.00 0.00 C ATOM 1816 NZ LYS A 114 2.051 -4.472 13.632 1.00 0.00 N ATOM 0 H LYS A 114 1.972 -1.579 10.397 1.00 0.00 H new ATOM 0 HA LYS A 114 2.085 -4.126 9.388 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -0.158 -2.195 9.986 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -0.531 -3.757 9.284 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -0.709 -4.271 11.522 1.00 0.00 H new ATOM 0 HG3 LYS A 114 0.972 -4.684 11.253 1.00 0.00 H new ATOM 0 HD2 LYS A 114 1.596 -2.344 12.010 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -0.087 -2.082 12.423 1.00 0.00 H new ATOM 0 HE2 LYS A 114 1.097 -2.756 14.429 1.00 0.00 H new ATOM 0 HE3 LYS A 114 0.003 -4.046 13.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 2.358 -4.687 14.602 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 1.753 -5.350 13.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 2.840 -4.047 13.105 1.00 0.00 H new ATOM 1830 N VAL A 115 1.183 -1.948 7.112 1.00 0.00 N ATOM 1831 CA VAL A 115 0.960 -1.763 5.684 1.00 0.00 C ATOM 1832 C VAL A 115 2.240 -2.004 4.892 1.00 0.00 C ATOM 1833 O VAL A 115 2.210 -2.586 3.807 1.00 0.00 O ATOM 1834 CB VAL A 115 0.437 -0.347 5.377 1.00 0.00 C ATOM 1835 CG1 VAL A 115 -0.016 -0.247 3.928 1.00 0.00 C ATOM 1836 CG2 VAL A 115 -0.695 0.020 6.324 1.00 0.00 C ATOM 0 H VAL A 115 1.232 -1.081 7.647 1.00 0.00 H new ATOM 0 HA VAL A 115 0.208 -2.493 5.383 1.00 0.00 H new ATOM 0 HB VAL A 115 1.251 0.362 5.528 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -0.382 0.760 3.730 1.00 0.00 H new ATOM 0 HG12 VAL A 115 0.824 -0.464 3.268 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -0.815 -0.966 3.746 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -1.052 1.023 6.093 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -1.512 -0.692 6.207 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -0.333 -0.008 7.352 1.00 0.00 H new ATOM 1846 N ILE A 116 3.362 -1.552 5.440 1.00 0.00 N ATOM 1847 CA ILE A 116 4.654 -1.719 4.786 1.00 0.00 C ATOM 1848 C ILE A 116 5.056 -3.189 4.731 1.00 0.00 C ATOM 1849 O ILE A 116 5.432 -3.701 3.677 1.00 0.00 O ATOM 1850 CB ILE A 116 5.758 -0.923 5.506 1.00 0.00 C ATOM 1851 CG1 ILE A 116 5.343 0.542 5.659 1.00 0.00 C ATOM 1852 CG2 ILE A 116 7.070 -1.031 4.745 1.00 0.00 C ATOM 1853 CD1 ILE A 116 6.332 1.370 6.449 1.00 0.00 C ATOM 0 H ILE A 116 3.403 -1.067 6.336 1.00 0.00 H new ATOM 0 HA ILE A 116 4.545 -1.336 3.771 1.00 0.00 H new ATOM 0 HB ILE A 116 5.902 -1.346 6.500 1.00 0.00 H new ATOM 0 HG12 ILE A 116 5.222 0.982 4.669 1.00 0.00 H new ATOM 0 HG13 ILE A 116 4.370 0.587 6.149 1.00 0.00 H new ATOM 0 HG21 ILE A 116 7.841 -0.463 5.266 1.00 0.00 H new ATOM 0 HG22 ILE A 116 7.370 -2.077 4.683 1.00 0.00 H new ATOM 0 HG23 ILE A 116 6.941 -0.630 3.740 1.00 0.00 H new ATOM 0 HD11 ILE A 116 5.974 2.397 6.518 1.00 0.00 H new ATOM 0 HD12 ILE A 116 6.436 0.954 7.451 1.00 0.00 H new ATOM 0 HD13 ILE A 116 7.300 1.356 5.948 1.00 0.00 H new ATOM 1865 N GLU A 117 4.971 -3.863 5.874 1.00 0.00 N ATOM 1866 CA GLU A 117 5.325 -5.275 5.956 1.00 0.00 C ATOM 1867 C GLU A 117 4.496 -6.102 4.976 1.00 0.00 C ATOM 1868 O GLU A 117 5.037 -6.877 4.187 1.00 0.00 O ATOM 1869 CB GLU A 117 5.118 -5.794 7.380 1.00 0.00 C ATOM 1870 CG GLU A 117 5.932 -7.037 7.699 1.00 0.00 C ATOM 1871 CD GLU A 117 5.459 -8.257 6.932 1.00 0.00 C ATOM 1872 OE1 GLU A 117 4.230 -8.436 6.803 1.00 0.00 O ATOM 1873 OE2 GLU A 117 6.318 -9.032 6.460 1.00 0.00 O ATOM 0 H GLU A 117 4.660 -3.454 6.755 1.00 0.00 H new ATOM 0 HA GLU A 117 6.377 -5.375 5.690 1.00 0.00 H new ATOM 0 HB2 GLU A 117 5.381 -5.007 8.086 1.00 0.00 H new ATOM 0 HB3 GLU A 117 4.061 -6.015 7.527 1.00 0.00 H new ATOM 0 HG2 GLU A 117 6.980 -6.850 7.466 1.00 0.00 H new ATOM 0 HG3 GLU A 117 5.874 -7.240 8.768 1.00 0.00 H new ATOM 1880 N THR A 118 3.179 -5.931 5.033 1.00 0.00 N ATOM 1881 CA THR A 118 2.275 -6.661 4.154 1.00 0.00 C ATOM 1882 C THR A 118 2.851 -6.779 2.748 1.00 0.00 C ATOM 1883 O THR A 118 2.929 -7.873 2.187 1.00 0.00 O ATOM 1884 CB THR A 118 0.896 -5.979 4.076 1.00 0.00 C ATOM 1885 OG1 THR A 118 0.350 -5.825 5.390 1.00 0.00 O ATOM 1886 CG2 THR A 118 -0.061 -6.791 3.215 1.00 0.00 C ATOM 0 H THR A 118 2.715 -5.293 5.679 1.00 0.00 H new ATOM 0 HA THR A 118 2.156 -7.657 4.579 1.00 0.00 H new ATOM 0 HB THR A 118 1.026 -4.997 3.621 1.00 0.00 H new ATOM 0 HG1 THR A 118 0.565 -4.932 5.731 1.00 0.00 H new ATOM 0 HG21 THR A 118 -1.028 -6.290 3.174 1.00 0.00 H new ATOM 0 HG22 THR A 118 0.344 -6.881 2.207 1.00 0.00 H new ATOM 0 HG23 THR A 118 -0.185 -7.784 3.646 1.00 0.00 H new ATOM 1894 N LEU A 119 3.255 -5.647 2.182 1.00 0.00 N ATOM 1895 CA LEU A 119 3.826 -5.623 0.840 1.00 0.00 C ATOM 1896 C LEU A 119 5.041 -6.542 0.749 1.00 0.00 C ATOM 1897 O LEU A 119 5.180 -7.310 -0.203 1.00 0.00 O ATOM 1898 CB LEU A 119 4.222 -4.196 0.458 1.00 0.00 C ATOM 1899 CG LEU A 119 3.168 -3.117 0.709 1.00 0.00 C ATOM 1900 CD1 LEU A 119 3.718 -1.743 0.359 1.00 0.00 C ATOM 1901 CD2 LEU A 119 1.907 -3.408 -0.091 1.00 0.00 C ATOM 0 H LEU A 119 3.198 -4.733 2.632 1.00 0.00 H new ATOM 0 HA LEU A 119 3.069 -5.982 0.143 1.00 0.00 H new ATOM 0 HB2 LEU A 119 5.124 -3.930 1.010 1.00 0.00 H new ATOM 0 HB3 LEU A 119 4.481 -4.183 -0.601 1.00 0.00 H new ATOM 0 HG LEU A 119 2.912 -3.125 1.769 1.00 0.00 H new ATOM 0 HD11 LEU A 119 2.954 -0.988 0.544 1.00 0.00 H new ATOM 0 HD12 LEU A 119 4.592 -1.533 0.975 1.00 0.00 H new ATOM 0 HD13 LEU A 119 4.002 -1.722 -0.693 1.00 0.00 H new ATOM 0 HD21 LEU A 119 1.168 -2.630 0.100 1.00 0.00 H new ATOM 0 HD22 LEU A 119 2.147 -3.428 -1.154 1.00 0.00 H new ATOM 0 HD23 LEU A 119 1.502 -4.375 0.208 1.00 0.00 H new ATOM 1913 N SER A 120 5.915 -6.458 1.746 1.00 0.00 N ATOM 1914 CA SER A 120 7.119 -7.281 1.778 1.00 0.00 C ATOM 1915 C SER A 120 6.797 -8.729 1.418 1.00 0.00 C ATOM 1916 O SER A 120 7.506 -9.356 0.631 1.00 0.00 O ATOM 1917 CB SER A 120 7.768 -7.220 3.162 1.00 0.00 C ATOM 1918 OG SER A 120 9.027 -7.871 3.164 1.00 0.00 O ATOM 0 H SER A 120 5.813 -5.829 2.542 1.00 0.00 H new ATOM 0 HA SER A 120 7.818 -6.888 1.040 1.00 0.00 H new ATOM 0 HB2 SER A 120 7.892 -6.180 3.463 1.00 0.00 H new ATOM 0 HB3 SER A 120 7.112 -7.688 3.896 1.00 0.00 H new ATOM 0 HG SER A 120 9.485 -7.700 2.315 1.00 0.00 H new ATOM 1924 N ARG A 121 5.723 -9.252 2.001 1.00 0.00 N ATOM 1925 CA ARG A 121 5.308 -10.625 1.744 1.00 0.00 C ATOM 1926 C ARG A 121 4.707 -10.759 0.347 1.00 0.00 C ATOM 1927 O ARG A 121 5.131 -11.603 -0.444 1.00 0.00 O ATOM 1928 CB ARG A 121 4.290 -11.077 2.793 1.00 0.00 C ATOM 1929 CG ARG A 121 4.882 -11.241 4.184 1.00 0.00 C ATOM 1930 CD ARG A 121 3.811 -11.583 5.208 1.00 0.00 C ATOM 1931 NE ARG A 121 4.339 -12.393 6.302 1.00 0.00 N ATOM 1932 CZ ARG A 121 4.581 -13.695 6.203 1.00 0.00 C ATOM 1933 NH1 ARG A 121 4.343 -14.332 5.064 1.00 0.00 N ATOM 1934 NH2 ARG A 121 5.062 -14.364 7.243 1.00 0.00 N ATOM 0 H ARG A 121 5.125 -8.746 2.654 1.00 0.00 H new ATOM 0 HA ARG A 121 6.190 -11.262 1.805 1.00 0.00 H new ATOM 0 HB2 ARG A 121 3.478 -10.351 2.836 1.00 0.00 H new ATOM 0 HB3 ARG A 121 3.853 -12.025 2.479 1.00 0.00 H new ATOM 0 HG2 ARG A 121 5.637 -12.027 4.169 1.00 0.00 H new ATOM 0 HG3 ARG A 121 5.386 -10.320 4.477 1.00 0.00 H new ATOM 0 HD2 ARG A 121 3.387 -10.663 5.610 1.00 0.00 H new ATOM 0 HD3 ARG A 121 2.999 -12.121 4.718 1.00 0.00 H new ATOM 0 HE ARG A 121 4.533 -11.933 7.192 1.00 0.00 H new ATOM 0 HH11 ARG A 121 3.973 -13.822 4.262 1.00 0.00 H new ATOM 0 HH12 ARG A 121 4.530 -15.332 4.990 1.00 0.00 H new ATOM 0 HH21 ARG A 121 5.247 -13.878 8.121 1.00 0.00 H new ATOM 0 HH22 ARG A 121 5.247 -15.364 7.165 1.00 0.00 H new ATOM 1948 N LEU A 122 3.719 -9.922 0.051 1.00 0.00 N ATOM 1949 CA LEU A 122 3.060 -9.947 -1.250 1.00 0.00 C ATOM 1950 C LEU A 122 4.068 -10.201 -2.367 1.00 0.00 C ATOM 1951 O LEU A 122 3.887 -11.101 -3.186 1.00 0.00 O ATOM 1952 CB LEU A 122 2.329 -8.626 -1.499 1.00 0.00 C ATOM 1953 CG LEU A 122 2.060 -8.273 -2.962 1.00 0.00 C ATOM 1954 CD1 LEU A 122 1.036 -9.223 -3.561 1.00 0.00 C ATOM 1955 CD2 LEU A 122 1.589 -6.831 -3.084 1.00 0.00 C ATOM 0 H LEU A 122 3.357 -9.218 0.694 1.00 0.00 H new ATOM 0 HA LEU A 122 2.336 -10.762 -1.247 1.00 0.00 H new ATOM 0 HB2 LEU A 122 1.375 -8.657 -0.972 1.00 0.00 H new ATOM 0 HB3 LEU A 122 2.913 -7.821 -1.053 1.00 0.00 H new ATOM 0 HG LEU A 122 2.991 -8.379 -3.519 1.00 0.00 H new ATOM 0 HD11 LEU A 122 0.858 -8.956 -4.603 1.00 0.00 H new ATOM 0 HD12 LEU A 122 1.412 -10.245 -3.508 1.00 0.00 H new ATOM 0 HD13 LEU A 122 0.103 -9.151 -3.003 1.00 0.00 H new ATOM 0 HD21 LEU A 122 1.402 -6.597 -4.132 1.00 0.00 H new ATOM 0 HD22 LEU A 122 0.670 -6.699 -2.513 1.00 0.00 H new ATOM 0 HD23 LEU A 122 2.357 -6.163 -2.694 1.00 0.00 H new ATOM 1967 N SER A 123 5.130 -9.403 -2.391 1.00 0.00 N ATOM 1968 CA SER A 123 6.167 -9.540 -3.407 1.00 0.00 C ATOM 1969 C SER A 123 6.416 -11.010 -3.734 1.00 0.00 C ATOM 1970 O SER A 123 6.575 -11.380 -4.897 1.00 0.00 O ATOM 1971 CB SER A 123 7.465 -8.884 -2.934 1.00 0.00 C ATOM 1972 OG SER A 123 8.085 -9.654 -1.918 1.00 0.00 O ATOM 0 H SER A 123 5.295 -8.654 -1.718 1.00 0.00 H new ATOM 0 HA SER A 123 5.824 -9.037 -4.311 1.00 0.00 H new ATOM 0 HB2 SER A 123 8.147 -8.771 -3.777 1.00 0.00 H new ATOM 0 HB3 SER A 123 7.254 -7.883 -2.558 1.00 0.00 H new ATOM 0 HG SER A 123 7.947 -9.221 -1.050 1.00 0.00 H new ATOM 1978 N ARG A 124 6.448 -11.842 -2.699 1.00 0.00 N ATOM 1979 CA ARG A 124 6.679 -13.271 -2.874 1.00 0.00 C ATOM 1980 C ARG A 124 5.805 -13.829 -3.994 1.00 0.00 C ATOM 1981 O ARG A 124 6.278 -14.574 -4.853 1.00 0.00 O ATOM 1982 CB ARG A 124 6.395 -14.019 -1.570 1.00 0.00 C ATOM 1983 CG ARG A 124 7.481 -13.848 -0.521 1.00 0.00 C ATOM 1984 CD ARG A 124 8.681 -14.736 -0.812 1.00 0.00 C ATOM 1985 NE ARG A 124 8.325 -16.152 -0.820 1.00 0.00 N ATOM 1986 CZ ARG A 124 9.215 -17.134 -0.737 1.00 0.00 C ATOM 1987 NH1 ARG A 124 10.508 -16.856 -0.640 1.00 0.00 N ATOM 1988 NH2 ARG A 124 8.813 -18.399 -0.750 1.00 0.00 N ATOM 0 H ARG A 124 6.317 -11.551 -1.730 1.00 0.00 H new ATOM 0 HA ARG A 124 7.725 -13.414 -3.146 1.00 0.00 H new ATOM 0 HB2 ARG A 124 5.447 -13.670 -1.160 1.00 0.00 H new ATOM 0 HB3 ARG A 124 6.276 -15.080 -1.788 1.00 0.00 H new ATOM 0 HG2 ARG A 124 7.797 -12.805 -0.490 1.00 0.00 H new ATOM 0 HG3 ARG A 124 7.079 -14.089 0.463 1.00 0.00 H new ATOM 0 HD2 ARG A 124 9.107 -14.464 -1.778 1.00 0.00 H new ATOM 0 HD3 ARG A 124 9.452 -14.560 -0.062 1.00 0.00 H new ATOM 0 HE ARG A 124 7.338 -16.401 -0.893 1.00 0.00 H new ATOM 0 HH11 ARG A 124 10.822 -15.885 -0.629 1.00 0.00 H new ATOM 0 HH12 ARG A 124 11.189 -17.613 -0.576 1.00 0.00 H new ATOM 0 HH21 ARG A 124 7.819 -18.618 -0.824 1.00 0.00 H new ATOM 0 HH22 ARG A 124 9.498 -19.152 -0.686 1.00 0.00 H new ATOM 2002 N THR A 125 4.527 -13.465 -3.978 1.00 0.00 N ATOM 2003 CA THR A 125 3.587 -13.930 -4.990 1.00 0.00 C ATOM 2004 C THR A 125 4.259 -14.046 -6.353 1.00 0.00 C ATOM 2005 O THR A 125 5.163 -13.283 -6.693 1.00 0.00 O ATOM 2006 CB THR A 125 2.375 -12.987 -5.107 1.00 0.00 C ATOM 2007 OG1 THR A 125 2.807 -11.681 -5.505 1.00 0.00 O ATOM 2008 CG2 THR A 125 1.628 -12.898 -3.784 1.00 0.00 C ATOM 0 H THR A 125 4.119 -12.849 -3.275 1.00 0.00 H new ATOM 0 HA THR A 125 3.243 -14.914 -4.672 1.00 0.00 H new ATOM 0 HB THR A 125 1.700 -13.392 -5.861 1.00 0.00 H new ATOM 0 HG1 THR A 125 3.192 -11.215 -4.734 1.00 0.00 H new ATOM 0 HG21 THR A 125 0.776 -12.226 -3.892 1.00 0.00 H new ATOM 0 HG22 THR A 125 1.275 -13.889 -3.498 1.00 0.00 H new ATOM 0 HG23 THR A 125 2.297 -12.515 -3.013 1.00 0.00 H new ATOM 2016 N PRO A 126 3.809 -15.024 -7.154 1.00 0.00 N ATOM 2017 CA PRO A 126 4.353 -15.262 -8.494 1.00 0.00 C ATOM 2018 C PRO A 126 3.984 -14.154 -9.475 1.00 0.00 C ATOM 2019 O PRO A 126 4.381 -14.186 -10.640 1.00 0.00 O ATOM 2020 CB PRO A 126 3.703 -16.583 -8.911 1.00 0.00 C ATOM 2021 CG PRO A 126 2.441 -16.650 -8.122 1.00 0.00 C ATOM 2022 CD PRO A 126 2.734 -15.971 -6.813 1.00 0.00 C ATOM 0 HA PRO A 126 5.443 -15.289 -8.492 1.00 0.00 H new ATOM 0 HB2 PRO A 126 3.502 -16.604 -9.982 1.00 0.00 H new ATOM 0 HB3 PRO A 126 4.353 -17.430 -8.692 1.00 0.00 H new ATOM 0 HG2 PRO A 126 1.626 -16.151 -8.646 1.00 0.00 H new ATOM 0 HG3 PRO A 126 2.133 -17.684 -7.965 1.00 0.00 H new ATOM 0 HD2 PRO A 126 1.856 -15.458 -6.421 1.00 0.00 H new ATOM 0 HD3 PRO A 126 3.053 -16.684 -6.053 1.00 0.00 H new ATOM 2030 N ILE A 127 3.224 -13.175 -8.996 1.00 0.00 N ATOM 2031 CA ILE A 127 2.803 -12.057 -9.831 1.00 0.00 C ATOM 2032 C ILE A 127 3.716 -10.851 -9.635 1.00 0.00 C ATOM 2033 O ILE A 127 4.013 -10.124 -10.583 1.00 0.00 O ATOM 2034 CB ILE A 127 1.352 -11.642 -9.528 1.00 0.00 C ATOM 2035 CG1 ILE A 127 0.403 -12.820 -9.759 1.00 0.00 C ATOM 2036 CG2 ILE A 127 0.949 -10.454 -10.388 1.00 0.00 C ATOM 2037 CD1 ILE A 127 0.192 -13.677 -8.530 1.00 0.00 C ATOM 0 H ILE A 127 2.887 -13.133 -8.034 1.00 0.00 H new ATOM 0 HA ILE A 127 2.867 -12.395 -10.865 1.00 0.00 H new ATOM 0 HB ILE A 127 1.286 -11.346 -8.481 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -0.561 -12.439 -10.096 1.00 0.00 H new ATOM 0 HG13 ILE A 127 0.798 -13.442 -10.562 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -0.080 -10.173 -10.162 1.00 0.00 H new ATOM 0 HG22 ILE A 127 1.609 -9.613 -10.179 1.00 0.00 H new ATOM 0 HG23 ILE A 127 1.028 -10.724 -11.441 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -0.491 -14.492 -8.768 1.00 0.00 H new ATOM 0 HD12 ILE A 127 1.148 -14.088 -8.205 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -0.232 -13.069 -7.731 1.00 0.00 H new ATOM 2049 N ALA A 128 4.159 -10.646 -8.399 1.00 0.00 N ATOM 2050 CA ALA A 128 5.042 -9.531 -8.080 1.00 0.00 C ATOM 2051 C ALA A 128 6.437 -9.753 -8.653 1.00 0.00 C ATOM 2052 O ALA A 128 7.062 -8.825 -9.170 1.00 0.00 O ATOM 2053 CB ALA A 128 5.114 -9.330 -6.573 1.00 0.00 C ATOM 0 H ALA A 128 3.921 -11.237 -7.603 1.00 0.00 H new ATOM 0 HA ALA A 128 4.630 -8.631 -8.537 1.00 0.00 H new ATOM 0 HB1 ALA A 128 5.777 -8.494 -6.349 1.00 0.00 H new ATOM 0 HB2 ALA A 128 4.117 -9.117 -6.186 1.00 0.00 H new ATOM 0 HB3 ALA A 128 5.499 -10.235 -6.103 1.00 0.00 H new ATOM 2059 N LEU A 129 6.921 -10.986 -8.559 1.00 0.00 N ATOM 2060 CA LEU A 129 8.244 -11.330 -9.068 1.00 0.00 C ATOM 2061 C LEU A 129 8.242 -11.392 -10.592 1.00 0.00 C ATOM 2062 O LEU A 129 9.198 -10.970 -11.242 1.00 0.00 O ATOM 2063 CB LEU A 129 8.701 -12.672 -8.493 1.00 0.00 C ATOM 2064 CG LEU A 129 8.682 -12.790 -6.968 1.00 0.00 C ATOM 2065 CD1 LEU A 129 8.987 -14.217 -6.540 1.00 0.00 C ATOM 2066 CD2 LEU A 129 9.675 -11.820 -6.346 1.00 0.00 C ATOM 0 H LEU A 129 6.417 -11.765 -8.135 1.00 0.00 H new ATOM 0 HA LEU A 129 8.940 -10.552 -8.755 1.00 0.00 H new ATOM 0 HB2 LEU A 129 8.067 -13.456 -8.906 1.00 0.00 H new ATOM 0 HB3 LEU A 129 9.716 -12.867 -8.840 1.00 0.00 H new ATOM 0 HG LEU A 129 7.684 -12.532 -6.614 1.00 0.00 H new ATOM 0 HD11 LEU A 129 8.969 -14.282 -5.452 1.00 0.00 H new ATOM 0 HD12 LEU A 129 8.237 -14.890 -6.956 1.00 0.00 H new ATOM 0 HD13 LEU A 129 9.974 -14.503 -6.905 1.00 0.00 H new ATOM 0 HD21 LEU A 129 9.648 -11.918 -5.261 1.00 0.00 H new ATOM 0 HD22 LEU A 129 10.679 -12.046 -6.706 1.00 0.00 H new ATOM 0 HD23 LEU A 129 9.411 -10.800 -6.625 1.00 0.00 H new ATOM 2078 N ALA A 130 7.160 -11.918 -11.156 1.00 0.00 N ATOM 2079 CA ALA A 130 7.031 -12.031 -12.604 1.00 0.00 C ATOM 2080 C ALA A 130 7.540 -10.773 -13.300 1.00 0.00 C ATOM 2081 O ALA A 130 8.296 -10.850 -14.269 1.00 0.00 O ATOM 2082 CB ALA A 130 5.583 -12.298 -12.986 1.00 0.00 C ATOM 0 H ALA A 130 6.360 -12.273 -10.632 1.00 0.00 H new ATOM 0 HA ALA A 130 7.643 -12.871 -12.934 1.00 0.00 H new ATOM 0 HB1 ALA A 130 5.502 -12.380 -14.070 1.00 0.00 H new ATOM 0 HB2 ALA A 130 5.251 -13.229 -12.526 1.00 0.00 H new ATOM 0 HB3 ALA A 130 4.957 -11.477 -12.636 1.00 0.00 H new ATOM 2088 N THR A 131 7.121 -9.615 -12.800 1.00 0.00 N ATOM 2089 CA THR A 131 7.533 -8.340 -13.374 1.00 0.00 C ATOM 2090 C THR A 131 9.047 -8.171 -13.308 1.00 0.00 C ATOM 2091 O THR A 131 9.654 -7.571 -14.194 1.00 0.00 O ATOM 2092 CB THR A 131 6.863 -7.156 -12.653 1.00 0.00 C ATOM 2093 OG1 THR A 131 7.378 -7.038 -11.322 1.00 0.00 O ATOM 2094 CG2 THR A 131 5.353 -7.335 -12.605 1.00 0.00 C ATOM 0 H THR A 131 6.496 -9.534 -11.998 1.00 0.00 H new ATOM 0 HA THR A 131 7.216 -8.346 -14.417 1.00 0.00 H new ATOM 0 HB THR A 131 7.087 -6.246 -13.210 1.00 0.00 H new ATOM 0 HG1 THR A 131 7.101 -7.816 -10.794 1.00 0.00 H new ATOM 0 HG21 THR A 131 4.902 -6.486 -12.091 1.00 0.00 H new ATOM 0 HG22 THR A 131 4.961 -7.394 -13.620 1.00 0.00 H new ATOM 0 HG23 THR A 131 5.112 -8.253 -12.069 1.00 0.00 H new ATOM 2102 N GLY A 132 9.652 -8.705 -12.251 1.00 0.00 N ATOM 2103 CA GLY A 132 11.090 -8.602 -12.089 1.00 0.00 C ATOM 2104 C GLY A 132 11.500 -7.363 -11.317 1.00 0.00 C ATOM 2105 O GLY A 132 12.607 -6.853 -11.491 1.00 0.00 O ATOM 0 H GLY A 132 9.172 -9.207 -11.504 1.00 0.00 H new ATOM 0 HA2 GLY A 132 11.458 -9.487 -11.571 1.00 0.00 H new ATOM 0 HA3 GLY A 132 11.563 -8.587 -13.071 1.00 0.00 H new ATOM 2109 N ILE A 133 10.605 -6.876 -10.464 1.00 0.00 N ATOM 2110 CA ILE A 133 10.879 -5.689 -9.664 1.00 0.00 C ATOM 2111 C ILE A 133 11.664 -6.044 -8.405 1.00 0.00 C ATOM 2112 O ILE A 133 11.439 -7.089 -7.796 1.00 0.00 O ATOM 2113 CB ILE A 133 9.579 -4.970 -9.259 1.00 0.00 C ATOM 2114 CG1 ILE A 133 8.808 -4.524 -10.504 1.00 0.00 C ATOM 2115 CG2 ILE A 133 9.889 -3.778 -8.366 1.00 0.00 C ATOM 2116 CD1 ILE A 133 7.328 -4.333 -10.262 1.00 0.00 C ATOM 0 H ILE A 133 9.684 -7.285 -10.309 1.00 0.00 H new ATOM 0 HA ILE A 133 11.475 -5.021 -10.285 1.00 0.00 H new ATOM 0 HB ILE A 133 8.955 -5.666 -8.698 1.00 0.00 H new ATOM 0 HG12 ILE A 133 9.232 -3.588 -10.868 1.00 0.00 H new ATOM 0 HG13 ILE A 133 8.946 -5.265 -11.292 1.00 0.00 H new ATOM 0 HG21 ILE A 133 8.960 -3.280 -8.088 1.00 0.00 H new ATOM 0 HG22 ILE A 133 10.400 -4.121 -7.466 1.00 0.00 H new ATOM 0 HG23 ILE A 133 10.529 -3.078 -8.903 1.00 0.00 H new ATOM 0 HD11 ILE A 133 6.846 -4.017 -11.187 1.00 0.00 H new ATOM 0 HD12 ILE A 133 6.890 -5.273 -9.927 1.00 0.00 H new ATOM 0 HD13 ILE A 133 7.180 -3.571 -9.497 1.00 0.00 H new ATOM 2128 N ARG A 134 12.584 -5.165 -8.021 1.00 0.00 N ATOM 2129 CA ARG A 134 13.402 -5.385 -6.834 1.00 0.00 C ATOM 2130 C ARG A 134 12.611 -6.123 -5.759 1.00 0.00 C ATOM 2131 O ARG A 134 11.855 -5.528 -4.990 1.00 0.00 O ATOM 2132 CB ARG A 134 13.908 -4.050 -6.284 1.00 0.00 C ATOM 2133 CG ARG A 134 15.004 -3.420 -7.128 1.00 0.00 C ATOM 2134 CD ARG A 134 15.456 -2.088 -6.551 1.00 0.00 C ATOM 2135 NE ARG A 134 16.538 -2.249 -5.584 1.00 0.00 N ATOM 2136 CZ ARG A 134 17.788 -2.545 -5.922 1.00 0.00 C ATOM 2137 NH1 ARG A 134 18.111 -2.711 -7.197 1.00 0.00 N ATOM 2138 NH2 ARG A 134 18.717 -2.676 -4.984 1.00 0.00 N ATOM 0 H ARG A 134 12.782 -4.294 -8.514 1.00 0.00 H new ATOM 0 HA ARG A 134 14.256 -6.000 -7.119 1.00 0.00 H new ATOM 0 HB2 ARG A 134 13.071 -3.355 -6.213 1.00 0.00 H new ATOM 0 HB3 ARG A 134 14.283 -4.202 -5.272 1.00 0.00 H new ATOM 0 HG2 ARG A 134 15.854 -4.099 -7.188 1.00 0.00 H new ATOM 0 HG3 ARG A 134 14.642 -3.273 -8.145 1.00 0.00 H new ATOM 0 HD2 ARG A 134 15.787 -1.436 -7.360 1.00 0.00 H new ATOM 0 HD3 ARG A 134 14.611 -1.596 -6.070 1.00 0.00 H new ATOM 0 HE ARG A 134 16.322 -2.128 -4.595 1.00 0.00 H new ATOM 0 HH11 ARG A 134 17.399 -2.611 -7.921 1.00 0.00 H new ATOM 0 HH12 ARG A 134 19.071 -2.938 -7.454 1.00 0.00 H new ATOM 0 HH21 ARG A 134 18.472 -2.549 -4.002 1.00 0.00 H new ATOM 0 HH22 ARG A 134 19.677 -2.903 -5.245 1.00 0.00 H new ATOM 2152 N PRO A 135 12.787 -7.452 -5.701 1.00 0.00 N ATOM 2153 CA PRO A 135 12.099 -8.300 -4.724 1.00 0.00 C ATOM 2154 C PRO A 135 12.603 -8.074 -3.303 1.00 0.00 C ATOM 2155 O PRO A 135 13.791 -7.832 -3.086 1.00 0.00 O ATOM 2156 CB PRO A 135 12.432 -9.720 -5.190 1.00 0.00 C ATOM 2157 CG PRO A 135 13.715 -9.582 -5.936 1.00 0.00 C ATOM 2158 CD PRO A 135 13.672 -8.228 -6.586 1.00 0.00 C ATOM 0 HA PRO A 135 11.030 -8.090 -4.683 1.00 0.00 H new ATOM 0 HB2 PRO A 135 12.537 -10.400 -4.345 1.00 0.00 H new ATOM 0 HB3 PRO A 135 11.645 -10.123 -5.827 1.00 0.00 H new ATOM 0 HG2 PRO A 135 14.569 -9.665 -5.263 1.00 0.00 H new ATOM 0 HG3 PRO A 135 13.819 -10.370 -6.682 1.00 0.00 H new ATOM 0 HD2 PRO A 135 14.665 -7.783 -6.652 1.00 0.00 H new ATOM 0 HD3 PRO A 135 13.278 -8.282 -7.601 1.00 0.00 H new ATOM 2166 N PHE A 136 11.694 -8.154 -2.337 1.00 0.00 N ATOM 2167 CA PHE A 136 12.047 -7.958 -0.936 1.00 0.00 C ATOM 2168 C PHE A 136 13.121 -8.950 -0.502 1.00 0.00 C ATOM 2169 O PHE A 136 13.233 -10.055 -1.033 1.00 0.00 O ATOM 2170 CB PHE A 136 10.808 -8.108 -0.050 1.00 0.00 C ATOM 2171 CG PHE A 136 10.023 -6.837 0.103 1.00 0.00 C ATOM 2172 CD1 PHE A 136 9.118 -6.445 -0.870 1.00 0.00 C ATOM 2173 CD2 PHE A 136 10.189 -6.035 1.220 1.00 0.00 C ATOM 2174 CE1 PHE A 136 8.393 -5.276 -0.732 1.00 0.00 C ATOM 2175 CE2 PHE A 136 9.467 -4.865 1.364 1.00 0.00 C ATOM 2176 CZ PHE A 136 8.569 -4.485 0.386 1.00 0.00 C ATOM 0 H PHE A 136 10.707 -8.353 -2.499 1.00 0.00 H new ATOM 0 HA PHE A 136 12.444 -6.949 -0.825 1.00 0.00 H new ATOM 0 HB2 PHE A 136 10.161 -8.877 -0.472 1.00 0.00 H new ATOM 0 HB3 PHE A 136 11.116 -8.456 0.936 1.00 0.00 H new ATOM 0 HD1 PHE A 136 8.977 -7.060 -1.747 1.00 0.00 H new ATOM 0 HD2 PHE A 136 10.891 -6.327 1.987 1.00 0.00 H new ATOM 0 HE1 PHE A 136 7.690 -4.982 -1.497 1.00 0.00 H new ATOM 0 HE2 PHE A 136 9.605 -4.249 2.240 1.00 0.00 H new ATOM 0 HZ PHE A 136 8.005 -3.570 0.495 1.00 0.00 H new ATOM 2186 N PRO A 137 13.932 -8.548 0.488 1.00 0.00 N ATOM 2187 CA PRO A 137 15.012 -9.387 1.017 1.00 0.00 C ATOM 2188 C PRO A 137 14.485 -10.583 1.802 1.00 0.00 C ATOM 2189 O PRO A 137 13.417 -10.517 2.411 1.00 0.00 O ATOM 2190 CB PRO A 137 15.778 -8.437 1.941 1.00 0.00 C ATOM 2191 CG PRO A 137 14.777 -7.411 2.345 1.00 0.00 C ATOM 2192 CD PRO A 137 13.856 -7.244 1.168 1.00 0.00 C ATOM 0 HA PRO A 137 15.622 -9.815 0.222 1.00 0.00 H new ATOM 0 HB2 PRO A 137 16.176 -8.964 2.808 1.00 0.00 H new ATOM 0 HB3 PRO A 137 16.625 -7.983 1.427 1.00 0.00 H new ATOM 0 HG2 PRO A 137 14.226 -7.731 3.229 1.00 0.00 H new ATOM 0 HG3 PRO A 137 15.264 -6.469 2.596 1.00 0.00 H new ATOM 0 HD2 PRO A 137 12.838 -7.014 1.483 1.00 0.00 H new ATOM 0 HD3 PRO A 137 14.179 -6.432 0.517 1.00 0.00 H new ATOM 2200 N SER A 138 15.241 -11.676 1.784 1.00 0.00 N ATOM 2201 CA SER A 138 14.849 -12.889 2.492 1.00 0.00 C ATOM 2202 C SER A 138 16.057 -13.785 2.746 1.00 0.00 C ATOM 2203 O SER A 138 17.031 -13.760 1.995 1.00 0.00 O ATOM 2204 CB SER A 138 13.793 -13.653 1.691 1.00 0.00 C ATOM 2205 OG SER A 138 12.485 -13.231 2.038 1.00 0.00 O ATOM 0 H SER A 138 16.129 -11.746 1.287 1.00 0.00 H new ATOM 0 HA SER A 138 14.426 -12.598 3.454 1.00 0.00 H new ATOM 0 HB2 SER A 138 13.958 -13.497 0.625 1.00 0.00 H new ATOM 0 HB3 SER A 138 13.895 -14.722 1.876 1.00 0.00 H new ATOM 0 HG SER A 138 12.493 -12.271 2.236 1.00 0.00 H new ATOM 2211 N GLY A 139 15.986 -14.576 3.813 1.00 0.00 N ATOM 2212 CA GLY A 139 17.080 -15.469 4.148 1.00 0.00 C ATOM 2213 C GLY A 139 17.669 -16.148 2.928 1.00 0.00 C ATOM 2214 O GLY A 139 16.988 -16.375 1.928 1.00 0.00 O ATOM 0 H GLY A 139 15.191 -14.614 4.451 1.00 0.00 H new ATOM 0 HA2 GLY A 139 17.861 -14.906 4.659 1.00 0.00 H new ATOM 0 HA3 GLY A 139 16.725 -16.227 4.846 1.00 0.00 H new ATOM 2218 N PRO A 140 18.966 -16.483 3.001 1.00 0.00 N ATOM 2219 CA PRO A 140 19.676 -17.143 1.902 1.00 0.00 C ATOM 2220 C PRO A 140 19.215 -18.582 1.696 1.00 0.00 C ATOM 2221 O PRO A 140 19.025 -19.027 0.565 1.00 0.00 O ATOM 2222 CB PRO A 140 21.138 -17.109 2.353 1.00 0.00 C ATOM 2223 CG PRO A 140 21.075 -17.036 3.840 1.00 0.00 C ATOM 2224 CD PRO A 140 19.839 -16.242 4.162 1.00 0.00 C ATOM 0 HA PRO A 140 19.499 -16.648 0.947 1.00 0.00 H new ATOM 0 HB2 PRO A 140 21.675 -17.998 2.023 1.00 0.00 H new ATOM 0 HB3 PRO A 140 21.661 -16.248 1.936 1.00 0.00 H new ATOM 0 HG2 PRO A 140 21.024 -18.033 4.278 1.00 0.00 H new ATOM 0 HG3 PRO A 140 21.965 -16.555 4.245 1.00 0.00 H new ATOM 0 HD2 PRO A 140 19.376 -16.578 5.090 1.00 0.00 H new ATOM 0 HD3 PRO A 140 20.063 -15.182 4.283 1.00 0.00 H new ATOM 2232 N SER A 141 19.038 -19.305 2.798 1.00 0.00 N ATOM 2233 CA SER A 141 18.602 -20.695 2.737 1.00 0.00 C ATOM 2234 C SER A 141 17.630 -20.911 1.582 1.00 0.00 C ATOM 2235 O SER A 141 17.773 -21.853 0.803 1.00 0.00 O ATOM 2236 CB SER A 141 17.943 -21.103 4.056 1.00 0.00 C ATOM 2237 OG SER A 141 18.911 -21.293 5.073 1.00 0.00 O ATOM 0 H SER A 141 19.190 -18.951 3.743 1.00 0.00 H new ATOM 0 HA SER A 141 19.481 -21.318 2.569 1.00 0.00 H new ATOM 0 HB2 SER A 141 17.233 -20.335 4.364 1.00 0.00 H new ATOM 0 HB3 SER A 141 17.376 -22.023 3.913 1.00 0.00 H new ATOM 0 HG SER A 141 18.464 -21.551 5.906 1.00 0.00 H new ATOM 2243 N SER A 142 16.640 -20.029 1.477 1.00 0.00 N ATOM 2244 CA SER A 142 15.641 -20.124 0.420 1.00 0.00 C ATOM 2245 C SER A 142 16.286 -19.961 -0.953 1.00 0.00 C ATOM 2246 O SER A 142 17.059 -19.032 -1.182 1.00 0.00 O ATOM 2247 CB SER A 142 14.557 -19.062 0.616 1.00 0.00 C ATOM 2248 OG SER A 142 13.425 -19.333 -0.191 1.00 0.00 O ATOM 0 H SER A 142 16.509 -19.241 2.111 1.00 0.00 H new ATOM 0 HA SER A 142 15.185 -21.112 0.473 1.00 0.00 H new ATOM 0 HB2 SER A 142 14.261 -19.030 1.664 1.00 0.00 H new ATOM 0 HB3 SER A 142 14.957 -18.079 0.368 1.00 0.00 H new ATOM 0 HG SER A 142 12.689 -18.740 0.068 1.00 0.00 H new ATOM 2254 N GLY A 143 15.961 -20.872 -1.865 1.00 0.00 N ATOM 2255 CA GLY A 143 16.517 -20.813 -3.205 1.00 0.00 C ATOM 2256 C GLY A 143 17.651 -21.798 -3.406 1.00 0.00 C ATOM 2257 O GLY A 143 18.645 -21.767 -2.681 1.00 0.00 O ATOM 0 H GLY A 143 15.322 -21.650 -1.700 1.00 0.00 H new ATOM 0 HA2 GLY A 143 15.730 -21.017 -3.931 1.00 0.00 H new ATOM 0 HA3 GLY A 143 16.878 -19.803 -3.401 1.00 0.00 H new TER 2261 GLY A 143