USER MOD reduce.3.24.130724 H: found=0, std=0, add=1011, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 1011 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 94 ASN : amide:sc= 0.152 K(o=1.8,f=0.83) USER MOD Set 1.2: A 106 TYR OH : rot -4:sc= 1.65 USER MOD Set 2.1: A 56 SER OG : rot -71:sc= 0.121 USER MOD Set 2.2: A 85 MET CE :methyl -114:sc= -0.322 (180deg=-2.55!) USER MOD Set 3.1: A 63 MET CE :methyl -107:sc= -0.19 (180deg=-0.0123) USER MOD Set 3.2: A 71 THR OG1 : rot 96:sc= 1.06 USER MOD Set 4.1: A 26 LYS NZ :NH3+ -111:sc= 0.702 (180deg=0) USER MOD Set 4.2: A 31 ASN : amide:sc= 0.638 K(o=1.3,f=-1.6) USER MOD Set 5.1: A 7 LYS NZ :NH3+ 166:sc= -0.339 (180deg=0) USER MOD Set 5.2: A 32 ASN : amide:sc= 0.931 K(o=0.59,f=-5.4!) USER MOD Single : A 1 MET CE :methyl -176:sc= 0 (180deg=-0.0273) USER MOD Single : A 1 MET N :NH3+ 167:sc= 1.21 (180deg=1.13) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 MET CE :methyl -174:sc= -0.11 (180deg=-0.221) USER MOD Single : A 23 ASN : amide:sc= 0 X(o=0,f=-0.034) USER MOD Single : A 44 ASN : amide:sc= -0.0236 X(o=-0.024,f=-0.48) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 GLN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 51 TYR OH : rot 130:sc= 0 USER MOD Single : A 59 ASN : amide:sc= 0.313 K(o=0.31,f=-0.3) USER MOD Single : A 60 MET CE :methyl -167:sc= 0 (180deg=-0.233) USER MOD Single : A 62 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 87 THR OG1 : rot 80:sc= 1.17 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0943) USER MOD Single : A 100 GLN : amide:sc= -0.0354 X(o=-0.035,f=0) USER MOD Single : A 104 SER OG : rot -63:sc= 1.25 USER MOD Single : A 109 LYS NZ :NH3+ 161:sc= -0.0295 (180deg=-0.277) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 LYS NZ :NH3+ 145:sc= 0.38 (180deg=-0.0576) USER MOD Single : A 121 ASN : amide:sc= -0.002 X(o=-0.002,f=-0.5) USER MOD Single : A 122 LYS NZ :NH3+ -164:sc=-0.00386 (180deg=-0.508) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 19.804 -14.590 1.524 1.00 0.00 N ATOM 2 CA MET A 1 20.435 -15.908 1.355 1.00 0.00 C ATOM 3 C MET A 1 19.777 -16.683 0.220 1.00 0.00 C ATOM 4 O MET A 1 20.433 -16.947 -0.786 1.00 0.00 O ATOM 5 CB MET A 1 20.458 -16.730 2.654 1.00 0.00 C ATOM 6 CG MET A 1 21.360 -17.957 2.448 1.00 0.00 C ATOM 7 SD MET A 1 21.398 -19.177 3.786 1.00 0.00 S ATOM 8 CE MET A 1 22.056 -18.176 5.140 1.00 0.00 C ATOM 0 H1 MET A 1 20.109 -14.172 2.426 1.00 0.00 H new ATOM 0 H2 MET A 1 20.087 -13.967 0.741 1.00 0.00 H new ATOM 0 H3 MET A 1 18.770 -14.698 1.525 1.00 0.00 H new ATOM 0 HA MET A 1 21.477 -15.727 1.090 1.00 0.00 H new ATOM 0 HB2 MET A 1 20.830 -16.122 3.479 1.00 0.00 H new ATOM 0 HB3 MET A 1 19.449 -17.044 2.920 1.00 0.00 H new ATOM 0 HG2 MET A 1 21.042 -18.463 1.536 1.00 0.00 H new ATOM 0 HG3 MET A 1 22.378 -17.606 2.280 1.00 0.00 H new ATOM 0 HE1 MET A 1 22.206 -18.805 6.018 1.00 0.00 H new ATOM 0 HE2 MET A 1 23.008 -17.739 4.840 1.00 0.00 H new ATOM 0 HE3 MET A 1 21.351 -17.380 5.380 1.00 0.00 H new ATOM 20 N ALA A 2 18.534 -17.124 0.411 1.00 0.00 N ATOM 21 CA ALA A 2 17.667 -17.791 -0.544 1.00 0.00 C ATOM 22 C ALA A 2 16.269 -17.497 -0.025 1.00 0.00 C ATOM 23 O ALA A 2 15.807 -18.144 0.919 1.00 0.00 O ATOM 24 CB ALA A 2 17.939 -19.295 -0.601 1.00 0.00 C ATOM 0 H ALA A 2 18.075 -17.012 1.315 1.00 0.00 H new ATOM 0 HA ALA A 2 17.821 -17.440 -1.565 1.00 0.00 H new ATOM 0 HB1 ALA A 2 17.271 -19.758 -1.327 1.00 0.00 H new ATOM 0 HB2 ALA A 2 18.973 -19.467 -0.899 1.00 0.00 H new ATOM 0 HB3 ALA A 2 17.767 -19.733 0.382 1.00 0.00 H new ATOM 30 N ASP A 3 15.667 -16.425 -0.521 1.00 0.00 N ATOM 31 CA ASP A 3 14.559 -15.740 0.126 1.00 0.00 C ATOM 32 C ASP A 3 13.693 -15.078 -0.939 1.00 0.00 C ATOM 33 O ASP A 3 14.165 -14.768 -2.038 1.00 0.00 O ATOM 34 CB ASP A 3 15.103 -14.660 1.083 1.00 0.00 C ATOM 35 CG ASP A 3 15.954 -15.231 2.215 1.00 0.00 C ATOM 36 OD1 ASP A 3 15.397 -15.630 3.265 1.00 0.00 O ATOM 37 OD2 ASP A 3 17.192 -15.340 2.068 1.00 0.00 O ATOM 0 H ASP A 3 15.943 -15.998 -1.405 1.00 0.00 H new ATOM 0 HA ASP A 3 13.967 -16.459 0.693 1.00 0.00 H new ATOM 0 HB2 ASP A 3 15.699 -13.947 0.514 1.00 0.00 H new ATOM 0 HB3 ASP A 3 14.266 -14.107 1.510 1.00 0.00 H new ATOM 42 N LYS A 4 12.438 -14.791 -0.585 1.00 0.00 N ATOM 43 CA LYS A 4 11.559 -13.915 -1.363 1.00 0.00 C ATOM 44 C LYS A 4 11.898 -12.445 -1.111 1.00 0.00 C ATOM 45 O LYS A 4 11.380 -11.586 -1.822 1.00 0.00 O ATOM 46 CB LYS A 4 10.087 -14.159 -0.995 1.00 0.00 C ATOM 47 CG LYS A 4 9.508 -15.481 -1.515 1.00 0.00 C ATOM 48 CD LYS A 4 9.961 -16.720 -0.739 1.00 0.00 C ATOM 49 CE LYS A 4 9.210 -17.939 -1.267 1.00 0.00 C ATOM 50 NZ LYS A 4 9.691 -19.185 -0.643 1.00 0.00 N ATOM 0 H LYS A 4 12.000 -15.164 0.257 1.00 0.00 H new ATOM 0 HA LYS A 4 11.712 -14.145 -2.417 1.00 0.00 H new ATOM 0 HB2 LYS A 4 9.989 -14.137 0.090 1.00 0.00 H new ATOM 0 HB3 LYS A 4 9.488 -13.337 -1.386 1.00 0.00 H new ATOM 0 HG2 LYS A 4 8.420 -15.425 -1.482 1.00 0.00 H new ATOM 0 HG3 LYS A 4 9.789 -15.600 -2.561 1.00 0.00 H new ATOM 0 HD2 LYS A 4 11.036 -16.862 -0.851 1.00 0.00 H new ATOM 0 HD3 LYS A 4 9.766 -16.590 0.325 1.00 0.00 H new ATOM 0 HE2 LYS A 4 8.144 -17.822 -1.073 1.00 0.00 H new ATOM 0 HE3 LYS A 4 9.332 -18.002 -2.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 9.159 -19.993 -1.025 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 10.703 -19.308 -0.849 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 9.551 -19.134 0.386 1.00 0.00 H new ATOM 64 N GLU A 5 12.752 -12.180 -0.110 1.00 0.00 N ATOM 65 CA GLU A 5 13.275 -10.874 0.261 1.00 0.00 C ATOM 66 C GLU A 5 12.119 -9.878 0.365 1.00 0.00 C ATOM 67 O GLU A 5 12.204 -8.802 -0.223 1.00 0.00 O ATOM 68 CB GLU A 5 14.338 -10.438 -0.768 1.00 0.00 C ATOM 69 CG GLU A 5 15.484 -11.440 -0.993 1.00 0.00 C ATOM 70 CD GLU A 5 16.421 -10.986 -2.114 1.00 0.00 C ATOM 71 OE1 GLU A 5 16.445 -9.785 -2.471 1.00 0.00 O ATOM 72 OE2 GLU A 5 17.215 -11.798 -2.636 1.00 0.00 O ATOM 0 H GLU A 5 13.111 -12.921 0.492 1.00 0.00 H new ATOM 0 HA GLU A 5 13.761 -10.915 1.236 1.00 0.00 H new ATOM 0 HB2 GLU A 5 13.843 -10.256 -1.722 1.00 0.00 H new ATOM 0 HB3 GLU A 5 14.765 -9.489 -0.445 1.00 0.00 H new ATOM 0 HG2 GLU A 5 16.051 -11.557 -0.070 1.00 0.00 H new ATOM 0 HG3 GLU A 5 15.070 -12.418 -1.239 1.00 0.00 H new ATOM 79 N LEU A 6 11.043 -10.265 1.071 1.00 0.00 N ATOM 80 CA LEU A 6 9.697 -9.708 0.944 1.00 0.00 C ATOM 81 C LEU A 6 9.670 -8.246 0.502 1.00 0.00 C ATOM 82 O LEU A 6 10.017 -7.339 1.262 1.00 0.00 O ATOM 83 CB LEU A 6 8.860 -9.894 2.208 1.00 0.00 C ATOM 84 CG LEU A 6 7.376 -9.653 1.843 1.00 0.00 C ATOM 85 CD1 LEU A 6 6.665 -10.976 1.560 1.00 0.00 C ATOM 86 CD2 LEU A 6 6.684 -8.836 2.923 1.00 0.00 C ATOM 0 H LEU A 6 11.095 -11.004 1.772 1.00 0.00 H new ATOM 0 HA LEU A 6 9.242 -10.290 0.143 1.00 0.00 H new ATOM 0 HB2 LEU A 6 8.995 -10.899 2.609 1.00 0.00 H new ATOM 0 HB3 LEU A 6 9.180 -9.196 2.982 1.00 0.00 H new ATOM 0 HG LEU A 6 7.329 -9.068 0.924 1.00 0.00 H new ATOM 0 HD11 LEU A 6 5.623 -10.782 1.306 1.00 0.00 H new ATOM 0 HD12 LEU A 6 7.154 -11.481 0.727 1.00 0.00 H new ATOM 0 HD13 LEU A 6 6.710 -11.610 2.445 1.00 0.00 H new ATOM 0 HD21 LEU A 6 5.641 -8.677 2.647 1.00 0.00 H new ATOM 0 HD22 LEU A 6 6.731 -9.372 3.871 1.00 0.00 H new ATOM 0 HD23 LEU A 6 7.183 -7.872 3.026 1.00 0.00 H new ATOM 98 N LYS A 7 9.316 -8.057 -0.763 1.00 0.00 N ATOM 99 CA LYS A 7 9.509 -6.816 -1.480 1.00 0.00 C ATOM 100 C LYS A 7 8.267 -5.956 -1.305 1.00 0.00 C ATOM 101 O LYS A 7 7.142 -6.436 -1.489 1.00 0.00 O ATOM 102 CB LYS A 7 9.846 -7.143 -2.941 1.00 0.00 C ATOM 103 CG LYS A 7 10.484 -5.945 -3.653 1.00 0.00 C ATOM 104 CD LYS A 7 10.851 -6.278 -5.102 1.00 0.00 C ATOM 105 CE LYS A 7 12.104 -7.148 -5.257 1.00 0.00 C ATOM 106 NZ LYS A 7 13.352 -6.412 -4.946 1.00 0.00 N ATOM 0 H LYS A 7 8.876 -8.784 -1.327 1.00 0.00 H new ATOM 0 HA LYS A 7 10.346 -6.237 -1.089 1.00 0.00 H new ATOM 0 HB2 LYS A 7 10.527 -7.993 -2.977 1.00 0.00 H new ATOM 0 HB3 LYS A 7 8.938 -7.439 -3.467 1.00 0.00 H new ATOM 0 HG2 LYS A 7 9.793 -5.102 -3.637 1.00 0.00 H new ATOM 0 HG3 LYS A 7 11.379 -5.635 -3.113 1.00 0.00 H new ATOM 0 HD2 LYS A 7 10.009 -6.790 -5.568 1.00 0.00 H new ATOM 0 HD3 LYS A 7 11.001 -5.347 -5.649 1.00 0.00 H new ATOM 0 HE2 LYS A 7 12.024 -8.014 -4.600 1.00 0.00 H new ATOM 0 HE3 LYS A 7 12.155 -7.526 -6.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 14.135 -7.088 -4.834 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 13.570 -5.755 -5.722 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 13.228 -5.876 -4.064 1.00 0.00 H new ATOM 120 N PHE A 8 8.462 -4.688 -0.968 1.00 0.00 N ATOM 121 CA PHE A 8 7.390 -3.757 -0.640 1.00 0.00 C ATOM 122 C PHE A 8 7.256 -2.778 -1.791 1.00 0.00 C ATOM 123 O PHE A 8 8.102 -1.896 -1.925 1.00 0.00 O ATOM 124 CB PHE A 8 7.720 -3.014 0.664 1.00 0.00 C ATOM 125 CG PHE A 8 7.119 -3.626 1.905 1.00 0.00 C ATOM 126 CD1 PHE A 8 7.735 -4.726 2.525 1.00 0.00 C ATOM 127 CD2 PHE A 8 5.937 -3.088 2.446 1.00 0.00 C ATOM 128 CE1 PHE A 8 7.165 -5.266 3.686 1.00 0.00 C ATOM 129 CE2 PHE A 8 5.375 -3.634 3.610 1.00 0.00 C ATOM 130 CZ PHE A 8 5.993 -4.726 4.236 1.00 0.00 C ATOM 0 H PHE A 8 9.390 -4.269 -0.914 1.00 0.00 H new ATOM 0 HA PHE A 8 6.451 -4.291 -0.493 1.00 0.00 H new ATOM 0 HB2 PHE A 8 8.803 -2.977 0.781 1.00 0.00 H new ATOM 0 HB3 PHE A 8 7.373 -1.984 0.578 1.00 0.00 H new ATOM 0 HD1 PHE A 8 8.638 -5.151 2.112 1.00 0.00 H new ATOM 0 HD2 PHE A 8 5.459 -2.249 1.962 1.00 0.00 H new ATOM 0 HE1 PHE A 8 7.636 -6.112 4.165 1.00 0.00 H new ATOM 0 HE2 PHE A 8 4.469 -3.215 4.022 1.00 0.00 H new ATOM 0 HZ PHE A 8 5.570 -5.148 5.135 1.00 0.00 H new ATOM 140 N LEU A 9 6.236 -2.910 -2.639 1.00 0.00 N ATOM 141 CA LEU A 9 5.943 -1.833 -3.571 1.00 0.00 C ATOM 142 C LEU A 9 5.217 -0.730 -2.804 1.00 0.00 C ATOM 143 O LEU A 9 4.294 -1.012 -2.034 1.00 0.00 O ATOM 144 CB LEU A 9 5.118 -2.333 -4.761 1.00 0.00 C ATOM 145 CG LEU A 9 4.956 -1.227 -5.820 1.00 0.00 C ATOM 146 CD1 LEU A 9 6.285 -0.817 -6.468 1.00 0.00 C ATOM 147 CD2 LEU A 9 4.014 -1.705 -6.911 1.00 0.00 C ATOM 0 H LEU A 9 5.622 -3.722 -2.698 1.00 0.00 H new ATOM 0 HA LEU A 9 6.870 -1.440 -3.989 1.00 0.00 H new ATOM 0 HB2 LEU A 9 5.604 -3.201 -5.207 1.00 0.00 H new ATOM 0 HB3 LEU A 9 4.137 -2.659 -4.417 1.00 0.00 H new ATOM 0 HG LEU A 9 4.556 -0.354 -5.304 1.00 0.00 H new ATOM 0 HD11 LEU A 9 6.104 -0.035 -7.205 1.00 0.00 H new ATOM 0 HD12 LEU A 9 6.964 -0.443 -5.701 1.00 0.00 H new ATOM 0 HD13 LEU A 9 6.732 -1.681 -6.959 1.00 0.00 H new ATOM 0 HD21 LEU A 9 3.899 -0.922 -7.661 1.00 0.00 H new ATOM 0 HD22 LEU A 9 4.424 -2.599 -7.380 1.00 0.00 H new ATOM 0 HD23 LEU A 9 3.042 -1.937 -6.476 1.00 0.00 H new ATOM 159 N VAL A 10 5.640 0.515 -3.017 1.00 0.00 N ATOM 160 CA VAL A 10 5.102 1.689 -2.346 1.00 0.00 C ATOM 161 C VAL A 10 4.903 2.763 -3.419 1.00 0.00 C ATOM 162 O VAL A 10 5.883 3.141 -4.066 1.00 0.00 O ATOM 163 CB VAL A 10 6.077 2.140 -1.237 1.00 0.00 C ATOM 164 CG1 VAL A 10 5.482 3.269 -0.397 1.00 0.00 C ATOM 165 CG2 VAL A 10 6.507 1.011 -0.280 1.00 0.00 C ATOM 0 H VAL A 10 6.385 0.737 -3.678 1.00 0.00 H new ATOM 0 HA VAL A 10 4.148 1.484 -1.860 1.00 0.00 H new ATOM 0 HB VAL A 10 6.961 2.480 -1.776 1.00 0.00 H new ATOM 0 HG11 VAL A 10 6.194 3.563 0.374 1.00 0.00 H new ATOM 0 HG12 VAL A 10 5.267 4.125 -1.037 1.00 0.00 H new ATOM 0 HG13 VAL A 10 4.560 2.926 0.072 1.00 0.00 H new ATOM 0 HG21 VAL A 10 7.191 1.410 0.469 1.00 0.00 H new ATOM 0 HG22 VAL A 10 5.628 0.599 0.215 1.00 0.00 H new ATOM 0 HG23 VAL A 10 7.007 0.225 -0.846 1.00 0.00 H new ATOM 175 N VAL A 11 3.668 3.218 -3.636 1.00 0.00 N ATOM 176 CA VAL A 11 3.285 4.153 -4.694 1.00 0.00 C ATOM 177 C VAL A 11 2.385 5.232 -4.078 1.00 0.00 C ATOM 178 O VAL A 11 1.231 5.414 -4.479 1.00 0.00 O ATOM 179 CB VAL A 11 2.634 3.417 -5.901 1.00 0.00 C ATOM 180 CG1 VAL A 11 2.727 4.284 -7.161 1.00 0.00 C ATOM 181 CG2 VAL A 11 3.280 2.048 -6.165 1.00 0.00 C ATOM 0 H VAL A 11 2.877 2.934 -3.057 1.00 0.00 H new ATOM 0 HA VAL A 11 4.168 4.639 -5.109 1.00 0.00 H new ATOM 0 HB VAL A 11 1.588 3.245 -5.647 1.00 0.00 H new ATOM 0 HG11 VAL A 11 2.268 3.759 -7.999 1.00 0.00 H new ATOM 0 HG12 VAL A 11 2.205 5.226 -6.994 1.00 0.00 H new ATOM 0 HG13 VAL A 11 3.774 4.485 -7.388 1.00 0.00 H new ATOM 0 HG21 VAL A 11 2.792 1.573 -7.016 1.00 0.00 H new ATOM 0 HG22 VAL A 11 4.340 2.182 -6.383 1.00 0.00 H new ATOM 0 HG23 VAL A 11 3.167 1.417 -5.284 1.00 0.00 H new ATOM 191 N ASP A 12 2.884 5.925 -3.052 1.00 0.00 N ATOM 192 CA ASP A 12 2.247 7.151 -2.587 1.00 0.00 C ATOM 193 C ASP A 12 2.352 8.175 -3.718 1.00 0.00 C ATOM 194 O ASP A 12 3.352 8.219 -4.441 1.00 0.00 O ATOM 195 CB ASP A 12 2.888 7.755 -1.329 1.00 0.00 C ATOM 196 CG ASP A 12 3.026 6.790 -0.151 1.00 0.00 C ATOM 197 OD1 ASP A 12 3.853 5.860 -0.275 1.00 0.00 O ATOM 198 OD2 ASP A 12 2.379 7.021 0.890 1.00 0.00 O ATOM 0 H ASP A 12 3.721 5.658 -2.533 1.00 0.00 H new ATOM 0 HA ASP A 12 1.219 6.904 -2.321 1.00 0.00 H new ATOM 0 HB2 ASP A 12 3.877 8.133 -1.588 1.00 0.00 H new ATOM 0 HB3 ASP A 12 2.293 8.611 -1.011 1.00 0.00 H new ATOM 203 N ASP A 13 1.347 9.034 -3.854 1.00 0.00 N ATOM 204 CA ASP A 13 1.362 10.160 -4.782 1.00 0.00 C ATOM 205 C ASP A 13 2.379 11.191 -4.299 1.00 0.00 C ATOM 206 O ASP A 13 3.321 11.537 -5.011 1.00 0.00 O ATOM 207 CB ASP A 13 -0.046 10.763 -4.860 1.00 0.00 C ATOM 208 CG ASP A 13 -0.031 12.234 -5.262 1.00 0.00 C ATOM 209 OD1 ASP A 13 0.344 12.541 -6.413 1.00 0.00 O ATOM 210 OD2 ASP A 13 -0.433 13.079 -4.426 1.00 0.00 O ATOM 0 H ASP A 13 0.485 8.966 -3.313 1.00 0.00 H new ATOM 0 HA ASP A 13 1.652 9.831 -5.780 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -0.640 10.199 -5.580 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -0.536 10.659 -3.892 1.00 0.00 H new ATOM 215 N PHE A 14 2.189 11.683 -3.077 1.00 0.00 N ATOM 216 CA PHE A 14 3.057 12.673 -2.473 1.00 0.00 C ATOM 217 C PHE A 14 4.376 12.007 -2.092 1.00 0.00 C ATOM 218 O PHE A 14 4.399 11.164 -1.196 1.00 0.00 O ATOM 219 CB PHE A 14 2.339 13.272 -1.261 1.00 0.00 C ATOM 220 CG PHE A 14 3.155 14.226 -0.417 1.00 0.00 C ATOM 221 CD1 PHE A 14 3.860 15.290 -1.009 1.00 0.00 C ATOM 222 CD2 PHE A 14 3.178 14.068 0.980 1.00 0.00 C ATOM 223 CE1 PHE A 14 4.584 16.184 -0.203 1.00 0.00 C ATOM 224 CE2 PHE A 14 3.912 14.951 1.779 1.00 0.00 C ATOM 225 CZ PHE A 14 4.596 16.027 1.190 1.00 0.00 C ATOM 0 H PHE A 14 1.416 11.397 -2.476 1.00 0.00 H new ATOM 0 HA PHE A 14 3.284 13.483 -3.167 1.00 0.00 H new ATOM 0 HB2 PHE A 14 1.450 13.796 -1.612 1.00 0.00 H new ATOM 0 HB3 PHE A 14 1.997 12.456 -0.625 1.00 0.00 H new ATOM 0 HD1 PHE A 14 3.845 15.419 -2.081 1.00 0.00 H new ATOM 0 HD2 PHE A 14 2.626 13.261 1.439 1.00 0.00 H new ATOM 0 HE1 PHE A 14 5.133 16.995 -0.658 1.00 0.00 H new ATOM 0 HE2 PHE A 14 3.953 14.805 2.848 1.00 0.00 H new ATOM 0 HZ PHE A 14 5.130 16.732 1.809 1.00 0.00 H new ATOM 235 N SER A 15 5.483 12.393 -2.731 1.00 0.00 N ATOM 236 CA SER A 15 6.786 11.773 -2.514 1.00 0.00 C ATOM 237 C SER A 15 7.147 11.682 -1.029 1.00 0.00 C ATOM 238 O SER A 15 7.457 10.592 -0.544 1.00 0.00 O ATOM 239 CB SER A 15 7.859 12.520 -3.311 1.00 0.00 C ATOM 240 OG SER A 15 7.495 12.584 -4.678 1.00 0.00 O ATOM 0 H SER A 15 5.497 13.148 -3.416 1.00 0.00 H new ATOM 0 HA SER A 15 6.734 10.746 -2.876 1.00 0.00 H new ATOM 0 HB2 SER A 15 7.984 13.527 -2.913 1.00 0.00 H new ATOM 0 HB3 SER A 15 8.819 12.014 -3.206 1.00 0.00 H new ATOM 0 HG SER A 15 8.187 13.065 -5.179 1.00 0.00 H new ATOM 246 N THR A 16 7.068 12.778 -0.268 1.00 0.00 N ATOM 247 CA THR A 16 7.408 12.728 1.152 1.00 0.00 C ATOM 248 C THR A 16 6.495 11.773 1.933 1.00 0.00 C ATOM 249 O THR A 16 6.982 11.177 2.891 1.00 0.00 O ATOM 250 CB THR A 16 7.489 14.148 1.727 1.00 0.00 C ATOM 251 OG1 THR A 16 8.620 14.777 1.150 1.00 0.00 O ATOM 252 CG2 THR A 16 7.633 14.237 3.247 1.00 0.00 C ATOM 0 H THR A 16 6.776 13.695 -0.607 1.00 0.00 H new ATOM 0 HA THR A 16 8.402 12.295 1.265 1.00 0.00 H new ATOM 0 HB THR A 16 6.540 14.627 1.487 1.00 0.00 H new ATOM 0 HG1 THR A 16 8.699 15.690 1.497 1.00 0.00 H new ATOM 0 HG21 THR A 16 7.681 15.284 3.547 1.00 0.00 H new ATOM 0 HG22 THR A 16 6.775 13.762 3.722 1.00 0.00 H new ATOM 0 HG23 THR A 16 8.546 13.728 3.556 1.00 0.00 H new ATOM 260 N MET A 17 5.252 11.513 1.504 1.00 0.00 N ATOM 261 CA MET A 17 4.464 10.436 2.094 1.00 0.00 C ATOM 262 C MET A 17 5.185 9.105 1.911 1.00 0.00 C ATOM 263 O MET A 17 5.353 8.387 2.892 1.00 0.00 O ATOM 264 CB MET A 17 3.027 10.372 1.539 1.00 0.00 C ATOM 265 CG MET A 17 2.043 10.528 2.694 1.00 0.00 C ATOM 266 SD MET A 17 0.255 10.350 2.401 1.00 0.00 S ATOM 267 CE MET A 17 -0.014 11.312 0.891 1.00 0.00 C ATOM 0 H MET A 17 4.781 12.029 0.761 1.00 0.00 H new ATOM 0 HA MET A 17 4.367 10.648 3.159 1.00 0.00 H new ATOM 0 HB2 MET A 17 2.872 11.161 0.803 1.00 0.00 H new ATOM 0 HB3 MET A 17 2.862 9.423 1.029 1.00 0.00 H new ATOM 0 HG2 MET A 17 2.320 9.799 3.456 1.00 0.00 H new ATOM 0 HG3 MET A 17 2.204 11.516 3.125 1.00 0.00 H new ATOM 0 HE1 MET A 17 -1.082 11.363 0.678 1.00 0.00 H new ATOM 0 HE2 MET A 17 0.378 12.320 1.027 1.00 0.00 H new ATOM 0 HE3 MET A 17 0.500 10.833 0.058 1.00 0.00 H new ATOM 277 N ARG A 18 5.730 8.814 0.724 1.00 0.00 N ATOM 278 CA ARG A 18 6.477 7.580 0.513 1.00 0.00 C ATOM 279 C ARG A 18 7.749 7.561 1.349 1.00 0.00 C ATOM 280 O ARG A 18 8.141 6.497 1.827 1.00 0.00 O ATOM 281 CB ARG A 18 6.778 7.386 -0.976 1.00 0.00 C ATOM 282 CG ARG A 18 7.610 6.121 -1.164 1.00 0.00 C ATOM 283 CD ARG A 18 7.484 5.601 -2.586 1.00 0.00 C ATOM 284 NE ARG A 18 8.199 4.326 -2.751 1.00 0.00 N ATOM 285 CZ ARG A 18 9.499 4.068 -2.578 1.00 0.00 C ATOM 286 NH1 ARG A 18 10.376 5.057 -2.496 1.00 0.00 N ATOM 287 NH2 ARG A 18 9.914 2.814 -2.502 1.00 0.00 N ATOM 0 H ARG A 18 5.666 9.416 -0.097 1.00 0.00 H new ATOM 0 HA ARG A 18 5.862 6.743 0.842 1.00 0.00 H new ATOM 0 HB2 ARG A 18 5.848 7.310 -1.539 1.00 0.00 H new ATOM 0 HB3 ARG A 18 7.317 8.250 -1.365 1.00 0.00 H new ATOM 0 HG2 ARG A 18 8.656 6.331 -0.940 1.00 0.00 H new ATOM 0 HG3 ARG A 18 7.281 5.356 -0.461 1.00 0.00 H new ATOM 0 HD2 ARG A 18 6.431 5.466 -2.835 1.00 0.00 H new ATOM 0 HD3 ARG A 18 7.884 6.338 -3.282 1.00 0.00 H new ATOM 0 HE ARG A 18 7.626 3.532 -3.036 1.00 0.00 H new ATOM 0 HH11 ARG A 18 10.061 6.025 -2.565 1.00 0.00 H new ATOM 0 HH12 ARG A 18 11.366 4.851 -2.364 1.00 0.00 H new ATOM 0 HH21 ARG A 18 9.243 2.049 -2.575 1.00 0.00 H new ATOM 0 HH22 ARG A 18 10.905 2.612 -2.370 1.00 0.00 H new ATOM 301 N ARG A 19 8.434 8.698 1.523 1.00 0.00 N ATOM 302 CA ARG A 19 9.604 8.734 2.406 1.00 0.00 C ATOM 303 C ARG A 19 9.174 8.375 3.821 1.00 0.00 C ATOM 304 O ARG A 19 9.878 7.578 4.444 1.00 0.00 O ATOM 305 CB ARG A 19 10.353 10.075 2.386 1.00 0.00 C ATOM 306 CG ARG A 19 11.288 10.250 1.181 1.00 0.00 C ATOM 307 CD ARG A 19 10.527 10.408 -0.135 1.00 0.00 C ATOM 308 NE ARG A 19 11.384 10.912 -1.208 1.00 0.00 N ATOM 309 CZ ARG A 19 12.199 10.197 -1.990 1.00 0.00 C ATOM 310 NH1 ARG A 19 12.367 8.892 -1.795 1.00 0.00 N ATOM 311 NH2 ARG A 19 12.853 10.808 -2.963 1.00 0.00 N ATOM 0 H ARG A 19 8.205 9.585 1.075 1.00 0.00 H new ATOM 0 HA ARG A 19 10.315 7.999 2.029 1.00 0.00 H new ATOM 0 HB2 ARG A 19 9.625 10.886 2.389 1.00 0.00 H new ATOM 0 HB3 ARG A 19 10.936 10.167 3.302 1.00 0.00 H new ATOM 0 HG2 ARG A 19 11.919 11.125 1.339 1.00 0.00 H new ATOM 0 HG3 ARG A 19 11.951 9.388 1.112 1.00 0.00 H new ATOM 0 HD2 ARG A 19 10.107 9.446 -0.428 1.00 0.00 H new ATOM 0 HD3 ARG A 19 9.689 11.090 0.010 1.00 0.00 H new ATOM 0 HE ARG A 19 11.357 11.917 -1.378 1.00 0.00 H new ATOM 0 HH11 ARG A 19 11.870 8.421 -1.039 1.00 0.00 H new ATOM 0 HH12 ARG A 19 12.993 8.362 -2.402 1.00 0.00 H new ATOM 0 HH21 ARG A 19 12.732 11.810 -3.108 1.00 0.00 H new ATOM 0 HH22 ARG A 19 13.479 10.277 -3.569 1.00 0.00 H new ATOM 325 N ILE A 20 8.041 8.901 4.299 1.00 0.00 N ATOM 326 CA ILE A 20 7.443 8.480 5.555 1.00 0.00 C ATOM 327 C ILE A 20 7.222 6.971 5.484 1.00 0.00 C ATOM 328 O ILE A 20 7.901 6.282 6.228 1.00 0.00 O ATOM 329 CB ILE A 20 6.203 9.333 5.947 1.00 0.00 C ATOM 330 CG1 ILE A 20 6.622 10.555 6.799 1.00 0.00 C ATOM 331 CG2 ILE A 20 5.190 8.539 6.795 1.00 0.00 C ATOM 332 CD1 ILE A 20 7.436 11.622 6.062 1.00 0.00 C ATOM 0 H ILE A 20 7.517 9.632 3.819 1.00 0.00 H new ATOM 0 HA ILE A 20 8.116 8.671 6.391 1.00 0.00 H new ATOM 0 HB ILE A 20 5.747 9.637 5.005 1.00 0.00 H new ATOM 0 HG12 ILE A 20 5.723 11.022 7.201 1.00 0.00 H new ATOM 0 HG13 ILE A 20 7.205 10.201 7.649 1.00 0.00 H new ATOM 0 HG21 ILE A 20 4.343 9.178 7.043 1.00 0.00 H new ATOM 0 HG22 ILE A 20 4.840 7.676 6.229 1.00 0.00 H new ATOM 0 HG23 ILE A 20 5.670 8.201 7.713 1.00 0.00 H new ATOM 0 HD11 ILE A 20 7.678 12.434 6.748 1.00 0.00 H new ATOM 0 HD12 ILE A 20 8.358 11.180 5.684 1.00 0.00 H new ATOM 0 HD13 ILE A 20 6.853 12.013 5.228 1.00 0.00 H new ATOM 344 N VAL A 21 6.346 6.436 4.625 1.00 0.00 N ATOM 345 CA VAL A 21 5.958 5.018 4.594 1.00 0.00 C ATOM 346 C VAL A 21 7.191 4.112 4.602 1.00 0.00 C ATOM 347 O VAL A 21 7.284 3.197 5.425 1.00 0.00 O ATOM 348 CB VAL A 21 5.044 4.735 3.375 1.00 0.00 C ATOM 349 CG1 VAL A 21 4.689 3.244 3.258 1.00 0.00 C ATOM 350 CG2 VAL A 21 3.723 5.506 3.496 1.00 0.00 C ATOM 0 H VAL A 21 5.874 6.992 3.912 1.00 0.00 H new ATOM 0 HA VAL A 21 5.389 4.793 5.496 1.00 0.00 H new ATOM 0 HB VAL A 21 5.604 5.053 2.495 1.00 0.00 H new ATOM 0 HG11 VAL A 21 4.047 3.090 2.391 1.00 0.00 H new ATOM 0 HG12 VAL A 21 5.602 2.661 3.142 1.00 0.00 H new ATOM 0 HG13 VAL A 21 4.165 2.923 4.158 1.00 0.00 H new ATOM 0 HG21 VAL A 21 3.097 5.293 2.630 1.00 0.00 H new ATOM 0 HG22 VAL A 21 3.204 5.198 4.404 1.00 0.00 H new ATOM 0 HG23 VAL A 21 3.929 6.575 3.541 1.00 0.00 H new ATOM 360 N ARG A 22 8.157 4.383 3.723 1.00 0.00 N ATOM 361 CA ARG A 22 9.415 3.651 3.652 1.00 0.00 C ATOM 362 C ARG A 22 10.151 3.718 4.986 1.00 0.00 C ATOM 363 O ARG A 22 10.668 2.694 5.427 1.00 0.00 O ATOM 364 CB ARG A 22 10.240 4.208 2.483 1.00 0.00 C ATOM 365 CG ARG A 22 11.527 3.423 2.196 1.00 0.00 C ATOM 366 CD ARG A 22 12.800 4.015 2.808 1.00 0.00 C ATOM 367 NE ARG A 22 13.169 5.256 2.113 1.00 0.00 N ATOM 368 CZ ARG A 22 14.216 6.045 2.364 1.00 0.00 C ATOM 369 NH1 ARG A 22 15.103 5.725 3.304 1.00 0.00 N ATOM 370 NH2 ARG A 22 14.338 7.154 1.647 1.00 0.00 N ATOM 0 H ARG A 22 8.083 5.129 3.032 1.00 0.00 H new ATOM 0 HA ARG A 22 9.233 2.593 3.463 1.00 0.00 H new ATOM 0 HB2 ARG A 22 9.622 4.212 1.585 1.00 0.00 H new ATOM 0 HB3 ARG A 22 10.499 5.245 2.697 1.00 0.00 H new ATOM 0 HG2 ARG A 22 11.404 2.405 2.567 1.00 0.00 H new ATOM 0 HG3 ARG A 22 11.659 3.355 1.116 1.00 0.00 H new ATOM 0 HD2 ARG A 22 12.643 4.216 3.868 1.00 0.00 H new ATOM 0 HD3 ARG A 22 13.615 3.294 2.738 1.00 0.00 H new ATOM 0 HE ARG A 22 12.555 5.548 1.352 1.00 0.00 H new ATOM 0 HH11 ARG A 22 14.987 4.867 3.843 1.00 0.00 H new ATOM 0 HH12 ARG A 22 15.898 6.338 3.485 1.00 0.00 H new ATOM 0 HH21 ARG A 22 13.645 7.379 0.933 1.00 0.00 H new ATOM 0 HH22 ARG A 22 15.125 7.782 1.810 1.00 0.00 H new ATOM 384 N ASN A 23 10.196 4.886 5.633 1.00 0.00 N ATOM 385 CA ASN A 23 10.779 5.012 6.962 1.00 0.00 C ATOM 386 C ASN A 23 10.015 4.190 7.981 1.00 0.00 C ATOM 387 O ASN A 23 10.643 3.508 8.774 1.00 0.00 O ATOM 388 CB ASN A 23 10.846 6.459 7.476 1.00 0.00 C ATOM 389 CG ASN A 23 11.904 6.525 8.561 1.00 0.00 C ATOM 390 OD1 ASN A 23 13.091 6.436 8.257 1.00 0.00 O ATOM 391 ND2 ASN A 23 11.537 6.649 9.818 1.00 0.00 N ATOM 0 H ASN A 23 9.832 5.759 5.251 1.00 0.00 H new ATOM 0 HA ASN A 23 11.798 4.642 6.850 1.00 0.00 H new ATOM 0 HB2 ASN A 23 11.092 7.141 6.662 1.00 0.00 H new ATOM 0 HB3 ASN A 23 9.878 6.769 7.869 1.00 0.00 H new ATOM 0 HD21 ASN A 23 12.242 6.672 10.555 1.00 0.00 H new ATOM 0 HD22 ASN A 23 10.548 6.722 10.056 1.00 0.00 H new ATOM 398 N LEU A 24 8.682 4.249 7.983 1.00 0.00 N ATOM 399 CA LEU A 24 7.849 3.564 8.968 1.00 0.00 C ATOM 400 C LEU A 24 8.116 2.064 8.898 1.00 0.00 C ATOM 401 O LEU A 24 8.277 1.404 9.920 1.00 0.00 O ATOM 402 CB LEU A 24 6.348 3.837 8.744 1.00 0.00 C ATOM 403 CG LEU A 24 5.922 5.312 8.636 1.00 0.00 C ATOM 404 CD1 LEU A 24 4.404 5.437 8.554 1.00 0.00 C ATOM 405 CD2 LEU A 24 6.548 6.219 9.704 1.00 0.00 C ATOM 0 H LEU A 24 8.148 4.779 7.294 1.00 0.00 H new ATOM 0 HA LEU A 24 8.109 3.949 9.954 1.00 0.00 H new ATOM 0 HB2 LEU A 24 6.042 3.327 7.831 1.00 0.00 H new ATOM 0 HB3 LEU A 24 5.793 3.382 9.565 1.00 0.00 H new ATOM 0 HG LEU A 24 6.331 5.688 7.698 1.00 0.00 H new ATOM 0 HD11 LEU A 24 4.129 6.489 8.478 1.00 0.00 H new ATOM 0 HD12 LEU A 24 4.042 4.903 7.675 1.00 0.00 H new ATOM 0 HD13 LEU A 24 3.955 5.008 9.450 1.00 0.00 H new ATOM 0 HD21 LEU A 24 6.200 7.242 9.562 1.00 0.00 H new ATOM 0 HD22 LEU A 24 6.255 5.870 10.694 1.00 0.00 H new ATOM 0 HD23 LEU A 24 7.634 6.190 9.615 1.00 0.00 H new ATOM 417 N LEU A 25 8.182 1.531 7.680 1.00 0.00 N ATOM 418 CA LEU A 25 8.500 0.136 7.428 1.00 0.00 C ATOM 419 C LEU A 25 9.916 -0.192 7.872 1.00 0.00 C ATOM 420 O LEU A 25 10.104 -1.192 8.562 1.00 0.00 O ATOM 421 CB LEU A 25 8.296 -0.164 5.940 1.00 0.00 C ATOM 422 CG LEU A 25 6.798 -0.289 5.627 1.00 0.00 C ATOM 423 CD1 LEU A 25 6.561 -0.090 4.136 1.00 0.00 C ATOM 424 CD2 LEU A 25 6.258 -1.651 6.076 1.00 0.00 C ATOM 0 H LEU A 25 8.013 2.069 6.830 1.00 0.00 H new ATOM 0 HA LEU A 25 7.831 -0.497 8.012 1.00 0.00 H new ATOM 0 HB2 LEU A 25 8.736 0.630 5.337 1.00 0.00 H new ATOM 0 HB3 LEU A 25 8.809 -1.088 5.674 1.00 0.00 H new ATOM 0 HG LEU A 25 6.263 0.485 6.178 1.00 0.00 H new ATOM 0 HD11 LEU A 25 5.496 -0.180 3.922 1.00 0.00 H new ATOM 0 HD12 LEU A 25 6.908 0.900 3.841 1.00 0.00 H new ATOM 0 HD13 LEU A 25 7.109 -0.848 3.576 1.00 0.00 H new ATOM 0 HD21 LEU A 25 5.195 -1.716 5.844 1.00 0.00 H new ATOM 0 HD22 LEU A 25 6.792 -2.444 5.554 1.00 0.00 H new ATOM 0 HD23 LEU A 25 6.402 -1.763 7.151 1.00 0.00 H new ATOM 436 N LYS A 26 10.901 0.634 7.507 1.00 0.00 N ATOM 437 CA LYS A 26 12.289 0.426 7.904 1.00 0.00 C ATOM 438 C LYS A 26 12.435 0.459 9.420 1.00 0.00 C ATOM 439 O LYS A 26 13.124 -0.398 9.965 1.00 0.00 O ATOM 440 CB LYS A 26 13.205 1.456 7.218 1.00 0.00 C ATOM 441 CG LYS A 26 13.495 1.093 5.745 1.00 0.00 C ATOM 442 CD LYS A 26 14.858 0.408 5.554 1.00 0.00 C ATOM 443 CE LYS A 26 14.995 -0.897 6.349 1.00 0.00 C ATOM 444 NZ LYS A 26 16.397 -1.244 6.625 1.00 0.00 N ATOM 0 H LYS A 26 10.755 1.462 6.930 1.00 0.00 H new ATOM 0 HA LYS A 26 12.599 -0.565 7.574 1.00 0.00 H new ATOM 0 HB2 LYS A 26 12.739 2.440 7.262 1.00 0.00 H new ATOM 0 HB3 LYS A 26 14.145 1.524 7.765 1.00 0.00 H new ATOM 0 HG2 LYS A 26 12.708 0.434 5.377 1.00 0.00 H new ATOM 0 HG3 LYS A 26 13.461 1.999 5.140 1.00 0.00 H new ATOM 0 HD2 LYS A 26 15.007 0.198 4.495 1.00 0.00 H new ATOM 0 HD3 LYS A 26 15.648 1.095 5.857 1.00 0.00 H new ATOM 0 HE2 LYS A 26 14.455 -0.803 7.291 1.00 0.00 H new ATOM 0 HE3 LYS A 26 14.526 -1.709 5.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 16.660 -2.088 6.077 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 17.011 -0.450 6.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 16.513 -1.440 7.640 1.00 0.00 H new ATOM 458 N GLU A 27 11.779 1.384 10.112 1.00 0.00 N ATOM 459 CA GLU A 27 11.743 1.464 11.565 1.00 0.00 C ATOM 460 C GLU A 27 11.198 0.164 12.146 1.00 0.00 C ATOM 461 O GLU A 27 11.756 -0.367 13.109 1.00 0.00 O ATOM 462 CB GLU A 27 10.860 2.647 12.005 1.00 0.00 C ATOM 463 CG GLU A 27 11.574 4.000 11.936 1.00 0.00 C ATOM 464 CD GLU A 27 12.732 4.065 12.926 1.00 0.00 C ATOM 465 OE1 GLU A 27 12.466 4.207 14.146 1.00 0.00 O ATOM 466 OE2 GLU A 27 13.898 3.917 12.493 1.00 0.00 O ATOM 0 H GLU A 27 11.240 2.123 9.660 1.00 0.00 H new ATOM 0 HA GLU A 27 12.756 1.620 11.936 1.00 0.00 H new ATOM 0 HB2 GLU A 27 9.971 2.681 11.375 1.00 0.00 H new ATOM 0 HB3 GLU A 27 10.520 2.476 13.026 1.00 0.00 H new ATOM 0 HG2 GLU A 27 11.947 4.166 10.925 1.00 0.00 H new ATOM 0 HG3 GLU A 27 10.865 4.800 12.149 1.00 0.00 H new ATOM 473 N LEU A 28 10.121 -0.365 11.565 1.00 0.00 N ATOM 474 CA LEU A 28 9.497 -1.620 11.977 1.00 0.00 C ATOM 475 C LEU A 28 10.243 -2.846 11.432 1.00 0.00 C ATOM 476 O LEU A 28 9.793 -3.969 11.654 1.00 0.00 O ATOM 477 CB LEU A 28 8.014 -1.608 11.569 1.00 0.00 C ATOM 478 CG LEU A 28 7.199 -0.542 12.335 1.00 0.00 C ATOM 479 CD1 LEU A 28 5.831 -0.369 11.675 1.00 0.00 C ATOM 480 CD2 LEU A 28 7.017 -0.900 13.817 1.00 0.00 C ATOM 0 H LEU A 28 9.648 0.078 10.777 1.00 0.00 H new ATOM 0 HA LEU A 28 9.558 -1.702 13.062 1.00 0.00 H new ATOM 0 HB2 LEU A 28 7.936 -1.420 10.498 1.00 0.00 H new ATOM 0 HB3 LEU A 28 7.582 -2.592 11.752 1.00 0.00 H new ATOM 0 HG LEU A 28 7.759 0.392 12.292 1.00 0.00 H new ATOM 0 HD11 LEU A 28 5.258 0.383 12.217 1.00 0.00 H new ATOM 0 HD12 LEU A 28 5.964 -0.049 10.641 1.00 0.00 H new ATOM 0 HD13 LEU A 28 5.295 -1.318 11.695 1.00 0.00 H new ATOM 0 HD21 LEU A 28 6.438 -0.120 14.311 1.00 0.00 H new ATOM 0 HD22 LEU A 28 6.490 -1.851 13.900 1.00 0.00 H new ATOM 0 HD23 LEU A 28 7.994 -0.984 14.294 1.00 0.00 H new ATOM 492 N GLY A 29 11.380 -2.665 10.756 1.00 0.00 N ATOM 493 CA GLY A 29 12.341 -3.705 10.420 1.00 0.00 C ATOM 494 C GLY A 29 12.301 -4.158 8.963 1.00 0.00 C ATOM 495 O GLY A 29 13.282 -4.752 8.510 1.00 0.00 O ATOM 0 H GLY A 29 11.664 -1.746 10.415 1.00 0.00 H new ATOM 0 HA2 GLY A 29 13.344 -3.343 10.647 1.00 0.00 H new ATOM 0 HA3 GLY A 29 12.162 -4.568 11.061 1.00 0.00 H new ATOM 499 N PHE A 30 11.220 -3.882 8.228 1.00 0.00 N ATOM 500 CA PHE A 30 11.051 -4.345 6.855 1.00 0.00 C ATOM 501 C PHE A 30 12.053 -3.664 5.911 1.00 0.00 C ATOM 502 O PHE A 30 12.556 -2.579 6.198 1.00 0.00 O ATOM 503 CB PHE A 30 9.602 -4.120 6.393 1.00 0.00 C ATOM 504 CG PHE A 30 8.604 -5.174 6.848 1.00 0.00 C ATOM 505 CD1 PHE A 30 8.726 -6.499 6.385 1.00 0.00 C ATOM 506 CD2 PHE A 30 7.489 -4.824 7.634 1.00 0.00 C ATOM 507 CE1 PHE A 30 7.728 -7.450 6.650 1.00 0.00 C ATOM 508 CE2 PHE A 30 6.491 -5.781 7.902 1.00 0.00 C ATOM 509 CZ PHE A 30 6.597 -7.087 7.396 1.00 0.00 C ATOM 0 H PHE A 30 10.436 -3.328 8.574 1.00 0.00 H new ATOM 0 HA PHE A 30 11.257 -5.415 6.824 1.00 0.00 H new ATOM 0 HB2 PHE A 30 9.269 -3.147 6.756 1.00 0.00 H new ATOM 0 HB3 PHE A 30 9.588 -4.076 5.304 1.00 0.00 H new ATOM 0 HD1 PHE A 30 9.599 -6.787 5.818 1.00 0.00 H new ATOM 0 HD2 PHE A 30 7.399 -3.823 8.031 1.00 0.00 H new ATOM 0 HE1 PHE A 30 7.831 -8.459 6.280 1.00 0.00 H new ATOM 0 HE2 PHE A 30 5.636 -5.508 8.502 1.00 0.00 H new ATOM 0 HZ PHE A 30 5.813 -7.807 7.580 1.00 0.00 H new ATOM 519 N ASN A 31 12.338 -4.303 4.773 1.00 0.00 N ATOM 520 CA ASN A 31 13.376 -3.935 3.807 1.00 0.00 C ATOM 521 C ASN A 31 12.822 -4.038 2.381 1.00 0.00 C ATOM 522 O ASN A 31 11.631 -4.272 2.185 1.00 0.00 O ATOM 523 CB ASN A 31 14.608 -4.854 3.996 1.00 0.00 C ATOM 524 CG ASN A 31 15.529 -4.351 5.088 1.00 0.00 C ATOM 525 OD1 ASN A 31 16.430 -3.556 4.835 1.00 0.00 O ATOM 526 ND2 ASN A 31 15.338 -4.791 6.313 1.00 0.00 N ATOM 0 H ASN A 31 11.823 -5.135 4.486 1.00 0.00 H new ATOM 0 HA ASN A 31 13.686 -2.904 3.975 1.00 0.00 H new ATOM 0 HB2 ASN A 31 14.274 -5.863 4.240 1.00 0.00 H new ATOM 0 HB3 ASN A 31 15.159 -4.919 3.058 1.00 0.00 H new ATOM 0 HD21 ASN A 31 15.943 -4.472 7.070 1.00 0.00 H new ATOM 0 HD22 ASN A 31 14.585 -5.451 6.506 1.00 0.00 H new ATOM 533 N ASN A 32 13.711 -3.875 1.395 1.00 0.00 N ATOM 534 CA ASN A 32 13.531 -4.198 -0.018 1.00 0.00 C ATOM 535 C ASN A 32 12.304 -3.520 -0.622 1.00 0.00 C ATOM 536 O ASN A 32 11.382 -4.158 -1.129 1.00 0.00 O ATOM 537 CB ASN A 32 13.561 -5.722 -0.235 1.00 0.00 C ATOM 538 CG ASN A 32 13.862 -6.106 -1.679 1.00 0.00 C ATOM 539 OD1 ASN A 32 14.345 -5.307 -2.477 1.00 0.00 O ATOM 540 ND2 ASN A 32 13.635 -7.343 -2.064 1.00 0.00 N ATOM 0 H ASN A 32 14.636 -3.488 1.579 1.00 0.00 H new ATOM 0 HA ASN A 32 14.376 -3.783 -0.568 1.00 0.00 H new ATOM 0 HB2 ASN A 32 14.314 -6.163 0.418 1.00 0.00 H new ATOM 0 HB3 ASN A 32 12.600 -6.145 0.056 1.00 0.00 H new ATOM 0 HD21 ASN A 32 13.860 -7.630 -3.017 1.00 0.00 H new ATOM 0 HD22 ASN A 32 13.234 -8.015 -1.410 1.00 0.00 H new ATOM 547 N VAL A 33 12.287 -2.195 -0.559 1.00 0.00 N ATOM 548 CA VAL A 33 11.190 -1.400 -1.084 1.00 0.00 C ATOM 549 C VAL A 33 11.418 -1.115 -2.571 1.00 0.00 C ATOM 550 O VAL A 33 12.552 -0.907 -3.011 1.00 0.00 O ATOM 551 CB VAL A 33 11.043 -0.106 -0.265 1.00 0.00 C ATOM 552 CG1 VAL A 33 10.360 -0.380 1.082 1.00 0.00 C ATOM 553 CG2 VAL A 33 12.400 0.570 -0.020 1.00 0.00 C ATOM 0 H VAL A 33 13.036 -1.642 -0.141 1.00 0.00 H new ATOM 0 HA VAL A 33 10.256 -1.955 -0.994 1.00 0.00 H new ATOM 0 HB VAL A 33 10.421 0.569 -0.853 1.00 0.00 H new ATOM 0 HG11 VAL A 33 10.269 0.552 1.640 1.00 0.00 H new ATOM 0 HG12 VAL A 33 9.368 -0.797 0.909 1.00 0.00 H new ATOM 0 HG13 VAL A 33 10.957 -1.089 1.655 1.00 0.00 H new ATOM 0 HG21 VAL A 33 12.253 1.480 0.562 1.00 0.00 H new ATOM 0 HG22 VAL A 33 13.052 -0.110 0.529 1.00 0.00 H new ATOM 0 HG23 VAL A 33 12.860 0.820 -0.976 1.00 0.00 H new ATOM 563 N GLU A 34 10.337 -1.009 -3.334 1.00 0.00 N ATOM 564 CA GLU A 34 10.296 -0.509 -4.698 1.00 0.00 C ATOM 565 C GLU A 34 9.355 0.683 -4.738 1.00 0.00 C ATOM 566 O GLU A 34 8.488 0.862 -3.869 1.00 0.00 O ATOM 567 CB GLU A 34 9.790 -1.594 -5.656 1.00 0.00 C ATOM 568 CG GLU A 34 10.883 -2.575 -6.085 1.00 0.00 C ATOM 569 CD GLU A 34 11.755 -2.056 -7.228 1.00 0.00 C ATOM 570 OE1 GLU A 34 12.177 -0.879 -7.220 1.00 0.00 O ATOM 571 OE2 GLU A 34 12.013 -2.850 -8.166 1.00 0.00 O ATOM 0 H GLU A 34 9.415 -1.286 -2.996 1.00 0.00 H new ATOM 0 HA GLU A 34 11.299 -0.218 -5.011 1.00 0.00 H new ATOM 0 HB2 GLU A 34 8.983 -2.147 -5.175 1.00 0.00 H new ATOM 0 HB3 GLU A 34 9.368 -1.120 -6.542 1.00 0.00 H new ATOM 0 HG2 GLU A 34 11.517 -2.797 -5.227 1.00 0.00 H new ATOM 0 HG3 GLU A 34 10.419 -3.513 -6.390 1.00 0.00 H new ATOM 578 N GLU A 35 9.520 1.488 -5.776 1.00 0.00 N ATOM 579 CA GLU A 35 8.698 2.635 -6.084 1.00 0.00 C ATOM 580 C GLU A 35 8.124 2.401 -7.473 1.00 0.00 C ATOM 581 O GLU A 35 8.762 1.734 -8.290 1.00 0.00 O ATOM 582 CB GLU A 35 9.578 3.891 -6.031 1.00 0.00 C ATOM 583 CG GLU A 35 8.731 5.156 -5.912 1.00 0.00 C ATOM 584 CD GLU A 35 9.604 6.389 -5.654 1.00 0.00 C ATOM 585 OE1 GLU A 35 10.169 6.978 -6.603 1.00 0.00 O ATOM 586 OE2 GLU A 35 9.767 6.786 -4.477 1.00 0.00 O ATOM 0 H GLU A 35 10.268 1.348 -6.455 1.00 0.00 H new ATOM 0 HA GLU A 35 7.882 2.773 -5.375 1.00 0.00 H new ATOM 0 HB2 GLU A 35 10.259 3.825 -5.182 1.00 0.00 H new ATOM 0 HB3 GLU A 35 10.193 3.945 -6.929 1.00 0.00 H new ATOM 0 HG2 GLU A 35 8.157 5.299 -6.828 1.00 0.00 H new ATOM 0 HG3 GLU A 35 8.013 5.040 -5.100 1.00 0.00 H new ATOM 593 N ALA A 36 6.953 2.968 -7.741 1.00 0.00 N ATOM 594 CA ALA A 36 6.406 3.130 -9.073 1.00 0.00 C ATOM 595 C ALA A 36 6.037 4.601 -9.225 1.00 0.00 C ATOM 596 O ALA A 36 5.953 5.331 -8.234 1.00 0.00 O ATOM 597 CB ALA A 36 5.184 2.226 -9.260 1.00 0.00 C ATOM 0 H ALA A 36 6.343 3.337 -7.011 1.00 0.00 H new ATOM 0 HA ALA A 36 7.130 2.842 -9.835 1.00 0.00 H new ATOM 0 HB1 ALA A 36 4.784 2.358 -10.265 1.00 0.00 H new ATOM 0 HB2 ALA A 36 5.476 1.185 -9.120 1.00 0.00 H new ATOM 0 HB3 ALA A 36 4.421 2.490 -8.528 1.00 0.00 H new ATOM 603 N GLU A 37 5.811 5.031 -10.456 1.00 0.00 N ATOM 604 CA GLU A 37 5.388 6.387 -10.742 1.00 0.00 C ATOM 605 C GLU A 37 3.933 6.612 -10.329 1.00 0.00 C ATOM 606 O GLU A 37 3.587 7.707 -9.879 1.00 0.00 O ATOM 607 CB GLU A 37 5.581 6.671 -12.236 1.00 0.00 C ATOM 608 CG GLU A 37 7.038 6.434 -12.657 1.00 0.00 C ATOM 609 CD GLU A 37 7.390 7.192 -13.931 1.00 0.00 C ATOM 610 OE1 GLU A 37 7.524 8.436 -13.895 1.00 0.00 O ATOM 611 OE2 GLU A 37 7.574 6.570 -15.001 1.00 0.00 O ATOM 0 H GLU A 37 5.917 4.446 -11.285 1.00 0.00 H new ATOM 0 HA GLU A 37 5.999 7.078 -10.161 1.00 0.00 H new ATOM 0 HB2 GLU A 37 4.921 6.030 -12.820 1.00 0.00 H new ATOM 0 HB3 GLU A 37 5.299 7.701 -12.453 1.00 0.00 H new ATOM 0 HG2 GLU A 37 7.704 6.746 -11.853 1.00 0.00 H new ATOM 0 HG3 GLU A 37 7.203 5.368 -12.811 1.00 0.00 H new ATOM 618 N ASP A 38 3.080 5.595 -10.488 1.00 0.00 N ATOM 619 CA ASP A 38 1.633 5.692 -10.331 1.00 0.00 C ATOM 620 C ASP A 38 1.015 4.290 -10.339 1.00 0.00 C ATOM 621 O ASP A 38 1.728 3.309 -10.518 1.00 0.00 O ATOM 622 CB ASP A 38 1.016 6.544 -11.456 1.00 0.00 C ATOM 623 CG ASP A 38 0.481 5.715 -12.629 1.00 0.00 C ATOM 624 OD1 ASP A 38 1.284 5.040 -13.309 1.00 0.00 O ATOM 625 OD2 ASP A 38 -0.755 5.695 -12.818 1.00 0.00 O ATOM 0 H ASP A 38 3.391 4.656 -10.737 1.00 0.00 H new ATOM 0 HA ASP A 38 1.420 6.176 -9.378 1.00 0.00 H new ATOM 0 HB2 ASP A 38 0.203 7.142 -11.044 1.00 0.00 H new ATOM 0 HB3 ASP A 38 1.768 7.241 -11.827 1.00 0.00 H new ATOM 630 N GLY A 39 -0.299 4.188 -10.142 1.00 0.00 N ATOM 631 CA GLY A 39 -1.094 2.973 -10.249 1.00 0.00 C ATOM 632 C GLY A 39 -0.908 2.165 -11.534 1.00 0.00 C ATOM 633 O GLY A 39 -0.837 0.940 -11.438 1.00 0.00 O ATOM 0 H GLY A 39 -0.865 4.998 -9.890 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -0.857 2.331 -9.401 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -2.147 3.242 -10.161 1.00 0.00 H new ATOM 637 N VAL A 40 -0.835 2.778 -12.721 1.00 0.00 N ATOM 638 CA VAL A 40 -0.579 2.014 -13.947 1.00 0.00 C ATOM 639 C VAL A 40 0.777 1.325 -13.799 1.00 0.00 C ATOM 640 O VAL A 40 0.892 0.109 -13.977 1.00 0.00 O ATOM 641 CB VAL A 40 -0.602 2.901 -15.211 1.00 0.00 C ATOM 642 CG1 VAL A 40 -0.454 2.021 -16.462 1.00 0.00 C ATOM 643 CG2 VAL A 40 -1.891 3.717 -15.365 1.00 0.00 C ATOM 0 H VAL A 40 -0.947 3.782 -12.858 1.00 0.00 H new ATOM 0 HA VAL A 40 -1.374 1.280 -14.077 1.00 0.00 H new ATOM 0 HB VAL A 40 0.227 3.600 -15.102 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -0.471 2.649 -17.353 1.00 0.00 H new ATOM 0 HG12 VAL A 40 0.491 1.480 -16.417 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -1.278 1.308 -16.505 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -1.836 4.316 -16.274 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -2.744 3.041 -15.426 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -2.010 4.375 -14.504 1.00 0.00 H new ATOM 653 N ASP A 41 1.800 2.100 -13.441 1.00 0.00 N ATOM 654 CA ASP A 41 3.141 1.577 -13.254 1.00 0.00 C ATOM 655 C ASP A 41 3.166 0.547 -12.119 1.00 0.00 C ATOM 656 O ASP A 41 3.860 -0.459 -12.218 1.00 0.00 O ATOM 657 CB ASP A 41 4.121 2.731 -13.014 1.00 0.00 C ATOM 658 CG ASP A 41 5.568 2.244 -12.941 1.00 0.00 C ATOM 659 OD1 ASP A 41 5.935 1.269 -13.637 1.00 0.00 O ATOM 660 OD2 ASP A 41 6.384 2.876 -12.232 1.00 0.00 O ATOM 0 H ASP A 41 1.717 3.103 -13.274 1.00 0.00 H new ATOM 0 HA ASP A 41 3.457 1.057 -14.159 1.00 0.00 H new ATOM 0 HB2 ASP A 41 4.024 3.462 -13.816 1.00 0.00 H new ATOM 0 HB3 ASP A 41 3.862 3.240 -12.086 1.00 0.00 H new ATOM 665 N ALA A 42 2.358 0.717 -11.068 1.00 0.00 N ATOM 666 CA ALA A 42 2.275 -0.197 -9.947 1.00 0.00 C ATOM 667 C ALA A 42 1.810 -1.566 -10.419 1.00 0.00 C ATOM 668 O ALA A 42 2.416 -2.580 -10.077 1.00 0.00 O ATOM 669 CB ALA A 42 1.312 0.351 -8.888 1.00 0.00 C ATOM 0 H ALA A 42 1.732 1.517 -10.980 1.00 0.00 H new ATOM 0 HA ALA A 42 3.265 -0.297 -9.503 1.00 0.00 H new ATOM 0 HB1 ALA A 42 1.258 -0.345 -8.051 1.00 0.00 H new ATOM 0 HB2 ALA A 42 1.672 1.317 -8.534 1.00 0.00 H new ATOM 0 HB3 ALA A 42 0.321 0.471 -9.325 1.00 0.00 H new ATOM 675 N LEU A 43 0.744 -1.597 -11.221 1.00 0.00 N ATOM 676 CA LEU A 43 0.235 -2.823 -11.811 1.00 0.00 C ATOM 677 C LEU A 43 1.326 -3.471 -12.672 1.00 0.00 C ATOM 678 O LEU A 43 1.531 -4.682 -12.595 1.00 0.00 O ATOM 679 CB LEU A 43 -1.031 -2.498 -12.620 1.00 0.00 C ATOM 680 CG LEU A 43 -1.833 -3.751 -13.004 1.00 0.00 C ATOM 681 CD1 LEU A 43 -2.640 -4.315 -11.828 1.00 0.00 C ATOM 682 CD2 LEU A 43 -2.793 -3.404 -14.145 1.00 0.00 C ATOM 0 H LEU A 43 0.212 -0.765 -11.477 1.00 0.00 H new ATOM 0 HA LEU A 43 -0.035 -3.541 -11.037 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -1.666 -1.830 -12.038 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -0.749 -1.961 -13.526 1.00 0.00 H new ATOM 0 HG LEU A 43 -1.118 -4.515 -13.311 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -3.188 -5.199 -12.154 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -1.962 -4.586 -11.018 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -3.344 -3.561 -11.475 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -3.365 -4.290 -14.422 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -3.475 -2.618 -13.820 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -2.223 -3.056 -15.007 1.00 0.00 H new ATOM 694 N ASN A 44 2.070 -2.668 -13.439 1.00 0.00 N ATOM 695 CA ASN A 44 3.170 -3.147 -14.274 1.00 0.00 C ATOM 696 C ASN A 44 4.357 -3.665 -13.449 1.00 0.00 C ATOM 697 O ASN A 44 5.050 -4.584 -13.889 1.00 0.00 O ATOM 698 CB ASN A 44 3.612 -2.042 -15.248 1.00 0.00 C ATOM 699 CG ASN A 44 4.321 -2.608 -16.476 1.00 0.00 C ATOM 700 OD1 ASN A 44 3.852 -3.571 -17.085 1.00 0.00 O ATOM 701 ND2 ASN A 44 5.417 -2.009 -16.901 1.00 0.00 N ATOM 0 H ASN A 44 1.923 -1.660 -13.497 1.00 0.00 H new ATOM 0 HA ASN A 44 2.800 -3.999 -14.845 1.00 0.00 H new ATOM 0 HB2 ASN A 44 2.741 -1.469 -15.565 1.00 0.00 H new ATOM 0 HB3 ASN A 44 4.278 -1.350 -14.732 1.00 0.00 H new ATOM 0 HD21 ASN A 44 5.886 -2.342 -17.743 1.00 0.00 H new ATOM 0 HD22 ASN A 44 5.795 -1.213 -16.388 1.00 0.00 H new ATOM 708 N LYS A 45 4.593 -3.129 -12.243 1.00 0.00 N ATOM 709 CA LYS A 45 5.531 -3.696 -11.273 1.00 0.00 C ATOM 710 C LYS A 45 5.009 -5.032 -10.756 1.00 0.00 C ATOM 711 O LYS A 45 5.803 -5.956 -10.610 1.00 0.00 O ATOM 712 CB LYS A 45 5.788 -2.759 -10.077 1.00 0.00 C ATOM 713 CG LYS A 45 7.072 -1.931 -10.195 1.00 0.00 C ATOM 714 CD LYS A 45 6.964 -0.780 -11.200 1.00 0.00 C ATOM 715 CE LYS A 45 7.967 0.326 -10.879 1.00 0.00 C ATOM 716 NZ LYS A 45 9.375 -0.024 -11.153 1.00 0.00 N ATOM 0 H LYS A 45 4.132 -2.281 -11.914 1.00 0.00 H new ATOM 0 HA LYS A 45 6.477 -3.834 -11.797 1.00 0.00 H new ATOM 0 HB2 LYS A 45 4.940 -2.082 -9.971 1.00 0.00 H new ATOM 0 HB3 LYS A 45 5.835 -3.355 -9.166 1.00 0.00 H new ATOM 0 HG2 LYS A 45 7.325 -1.526 -9.215 1.00 0.00 H new ATOM 0 HG3 LYS A 45 7.892 -2.586 -10.491 1.00 0.00 H new ATOM 0 HD2 LYS A 45 7.142 -1.155 -12.208 1.00 0.00 H new ATOM 0 HD3 LYS A 45 5.953 -0.374 -11.185 1.00 0.00 H new ATOM 0 HE2 LYS A 45 7.708 1.213 -11.457 1.00 0.00 H new ATOM 0 HE3 LYS A 45 7.870 0.592 -9.826 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 9.987 0.780 -10.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 9.645 -0.851 -10.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 9.487 -0.249 -12.162 1.00 0.00 H new ATOM 730 N LEU A 46 3.714 -5.165 -10.452 1.00 0.00 N ATOM 731 CA LEU A 46 3.181 -6.431 -9.941 1.00 0.00 C ATOM 732 C LEU A 46 3.343 -7.531 -10.985 1.00 0.00 C ATOM 733 O LEU A 46 3.732 -8.648 -10.652 1.00 0.00 O ATOM 734 CB LEU A 46 1.709 -6.325 -9.490 1.00 0.00 C ATOM 735 CG LEU A 46 1.515 -6.000 -7.998 1.00 0.00 C ATOM 736 CD1 LEU A 46 2.194 -7.024 -7.080 1.00 0.00 C ATOM 737 CD2 LEU A 46 1.995 -4.589 -7.657 1.00 0.00 C ATOM 0 H LEU A 46 3.023 -4.421 -10.549 1.00 0.00 H new ATOM 0 HA LEU A 46 3.761 -6.684 -9.053 1.00 0.00 H new ATOM 0 HB2 LEU A 46 1.216 -5.554 -10.083 1.00 0.00 H new ATOM 0 HB3 LEU A 46 1.207 -7.267 -9.711 1.00 0.00 H new ATOM 0 HG LEU A 46 0.441 -6.054 -7.818 1.00 0.00 H new ATOM 0 HD11 LEU A 46 2.026 -6.747 -6.039 1.00 0.00 H new ATOM 0 HD12 LEU A 46 1.774 -8.013 -7.265 1.00 0.00 H new ATOM 0 HD13 LEU A 46 3.265 -7.041 -7.283 1.00 0.00 H new ATOM 0 HD21 LEU A 46 1.841 -4.399 -6.595 1.00 0.00 H new ATOM 0 HD22 LEU A 46 3.056 -4.499 -7.891 1.00 0.00 H new ATOM 0 HD23 LEU A 46 1.431 -3.862 -8.241 1.00 0.00 H new ATOM 749 N GLN A 47 3.131 -7.201 -12.257 1.00 0.00 N ATOM 750 CA GLN A 47 3.401 -8.091 -13.383 1.00 0.00 C ATOM 751 C GLN A 47 4.908 -8.310 -13.619 1.00 0.00 C ATOM 752 O GLN A 47 5.292 -8.859 -14.650 1.00 0.00 O ATOM 753 CB GLN A 47 2.664 -7.562 -14.623 1.00 0.00 C ATOM 754 CG GLN A 47 1.142 -7.635 -14.409 1.00 0.00 C ATOM 755 CD GLN A 47 0.359 -7.195 -15.638 1.00 0.00 C ATOM 756 OE1 GLN A 47 0.705 -6.225 -16.307 1.00 0.00 O ATOM 757 NE2 GLN A 47 -0.724 -7.886 -15.956 1.00 0.00 N ATOM 0 H GLN A 47 2.761 -6.293 -12.538 1.00 0.00 H new ATOM 0 HA GLN A 47 3.017 -9.085 -13.151 1.00 0.00 H new ATOM 0 HB2 GLN A 47 2.962 -6.532 -14.820 1.00 0.00 H new ATOM 0 HB3 GLN A 47 2.944 -8.148 -15.499 1.00 0.00 H new ATOM 0 HG2 GLN A 47 0.863 -8.657 -14.151 1.00 0.00 H new ATOM 0 HG3 GLN A 47 0.867 -7.006 -13.562 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -1.000 -8.690 -15.392 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -1.283 -7.615 -16.765 1.00 0.00 H new ATOM 766 N ALA A 48 5.775 -7.912 -12.683 1.00 0.00 N ATOM 767 CA ALA A 48 7.200 -8.163 -12.649 1.00 0.00 C ATOM 768 C ALA A 48 7.639 -8.793 -11.314 1.00 0.00 C ATOM 769 O ALA A 48 8.836 -8.777 -11.015 1.00 0.00 O ATOM 770 CB ALA A 48 7.917 -6.843 -12.932 1.00 0.00 C ATOM 0 H ALA A 48 5.467 -7.368 -11.877 1.00 0.00 H new ATOM 0 HA ALA A 48 7.468 -8.892 -13.414 1.00 0.00 H new ATOM 0 HB1 ALA A 48 8.995 -7.003 -12.912 1.00 0.00 H new ATOM 0 HB2 ALA A 48 7.623 -6.472 -13.914 1.00 0.00 H new ATOM 0 HB3 ALA A 48 7.645 -6.111 -12.172 1.00 0.00 H new ATOM 776 N GLY A 49 6.734 -9.347 -10.491 1.00 0.00 N ATOM 777 CA GLY A 49 7.150 -10.274 -9.438 1.00 0.00 C ATOM 778 C GLY A 49 6.136 -10.508 -8.333 1.00 0.00 C ATOM 779 O GLY A 49 5.017 -9.999 -8.351 1.00 0.00 O ATOM 0 H GLY A 49 5.730 -9.171 -10.535 1.00 0.00 H new ATOM 0 HA2 GLY A 49 7.389 -11.233 -9.897 1.00 0.00 H new ATOM 0 HA3 GLY A 49 8.069 -9.898 -8.989 1.00 0.00 H new ATOM 783 N GLY A 50 6.527 -11.329 -7.364 1.00 0.00 N ATOM 784 CA GLY A 50 5.712 -11.748 -6.241 1.00 0.00 C ATOM 785 C GLY A 50 6.010 -10.834 -5.068 1.00 0.00 C ATOM 786 O GLY A 50 6.734 -11.227 -4.147 1.00 0.00 O ATOM 0 H GLY A 50 7.462 -11.735 -7.344 1.00 0.00 H new ATOM 0 HA2 GLY A 50 4.654 -11.700 -6.501 1.00 0.00 H new ATOM 0 HA3 GLY A 50 5.929 -12.784 -5.980 1.00 0.00 H new ATOM 790 N TYR A 51 5.515 -9.600 -5.144 1.00 0.00 N ATOM 791 CA TYR A 51 5.648 -8.612 -4.084 1.00 0.00 C ATOM 792 C TYR A 51 4.798 -9.026 -2.887 1.00 0.00 C ATOM 793 O TYR A 51 3.772 -9.692 -3.047 1.00 0.00 O ATOM 794 CB TYR A 51 5.190 -7.242 -4.593 1.00 0.00 C ATOM 795 CG TYR A 51 6.155 -6.600 -5.567 1.00 0.00 C ATOM 796 CD1 TYR A 51 6.224 -7.021 -6.910 1.00 0.00 C ATOM 797 CD2 TYR A 51 7.017 -5.589 -5.113 1.00 0.00 C ATOM 798 CE1 TYR A 51 7.165 -6.452 -7.783 1.00 0.00 C ATOM 799 CE2 TYR A 51 7.922 -4.981 -5.994 1.00 0.00 C ATOM 800 CZ TYR A 51 8.003 -5.408 -7.340 1.00 0.00 C ATOM 801 OH TYR A 51 8.890 -4.847 -8.205 1.00 0.00 O ATOM 0 H TYR A 51 5.003 -9.257 -5.957 1.00 0.00 H new ATOM 0 HA TYR A 51 6.693 -8.550 -3.780 1.00 0.00 H new ATOM 0 HB2 TYR A 51 4.219 -7.350 -5.076 1.00 0.00 H new ATOM 0 HB3 TYR A 51 5.051 -6.576 -3.741 1.00 0.00 H new ATOM 0 HD1 TYR A 51 5.550 -7.785 -7.269 1.00 0.00 H new ATOM 0 HD2 TYR A 51 6.983 -5.278 -4.079 1.00 0.00 H new ATOM 0 HE1 TYR A 51 7.247 -6.815 -8.797 1.00 0.00 H new ATOM 0 HE2 TYR A 51 8.560 -4.183 -5.644 1.00 0.00 H new ATOM 0 HH TYR A 51 8.800 -3.871 -8.179 1.00 0.00 H new ATOM 811 N GLY A 52 5.183 -8.564 -1.699 1.00 0.00 N ATOM 812 CA GLY A 52 4.433 -8.824 -0.484 1.00 0.00 C ATOM 813 C GLY A 52 3.364 -7.775 -0.221 1.00 0.00 C ATOM 814 O GLY A 52 2.333 -8.105 0.363 1.00 0.00 O ATOM 0 H GLY A 52 6.022 -8.001 -1.558 1.00 0.00 H new ATOM 0 HA2 GLY A 52 3.964 -9.806 -0.554 1.00 0.00 H new ATOM 0 HA3 GLY A 52 5.119 -8.858 0.362 1.00 0.00 H new ATOM 818 N PHE A 53 3.606 -6.524 -0.616 1.00 0.00 N ATOM 819 CA PHE A 53 2.775 -5.375 -0.280 1.00 0.00 C ATOM 820 C PHE A 53 2.713 -4.430 -1.463 1.00 0.00 C ATOM 821 O PHE A 53 3.679 -4.330 -2.225 1.00 0.00 O ATOM 822 CB PHE A 53 3.381 -4.627 0.909 1.00 0.00 C ATOM 823 CG PHE A 53 2.940 -5.130 2.264 1.00 0.00 C ATOM 824 CD1 PHE A 53 3.525 -6.283 2.812 1.00 0.00 C ATOM 825 CD2 PHE A 53 1.985 -4.407 3.002 1.00 0.00 C ATOM 826 CE1 PHE A 53 3.148 -6.727 4.088 1.00 0.00 C ATOM 827 CE2 PHE A 53 1.631 -4.833 4.291 1.00 0.00 C ATOM 828 CZ PHE A 53 2.204 -6.001 4.830 1.00 0.00 C ATOM 0 H PHE A 53 4.409 -6.279 -1.195 1.00 0.00 H new ATOM 0 HA PHE A 53 1.774 -5.725 -0.027 1.00 0.00 H new ATOM 0 HB2 PHE A 53 4.467 -4.694 0.848 1.00 0.00 H new ATOM 0 HB3 PHE A 53 3.122 -3.571 0.827 1.00 0.00 H new ATOM 0 HD1 PHE A 53 4.267 -6.830 2.249 1.00 0.00 H new ATOM 0 HD2 PHE A 53 1.526 -3.527 2.577 1.00 0.00 H new ATOM 0 HE1 PHE A 53 3.584 -7.626 4.499 1.00 0.00 H new ATOM 0 HE2 PHE A 53 0.918 -4.265 4.870 1.00 0.00 H new ATOM 0 HZ PHE A 53 1.917 -6.338 5.815 1.00 0.00 H new ATOM 838 N VAL A 54 1.587 -3.724 -1.574 1.00 0.00 N ATOM 839 CA VAL A 54 1.260 -2.835 -2.683 1.00 0.00 C ATOM 840 C VAL A 54 0.597 -1.595 -2.074 1.00 0.00 C ATOM 841 O VAL A 54 -0.602 -1.334 -2.208 1.00 0.00 O ATOM 842 CB VAL A 54 0.419 -3.613 -3.718 1.00 0.00 C ATOM 843 CG1 VAL A 54 0.195 -2.834 -5.017 1.00 0.00 C ATOM 844 CG2 VAL A 54 1.105 -4.930 -4.108 1.00 0.00 C ATOM 0 H VAL A 54 0.853 -3.759 -0.867 1.00 0.00 H new ATOM 0 HA VAL A 54 2.127 -2.485 -3.244 1.00 0.00 H new ATOM 0 HB VAL A 54 -0.539 -3.789 -3.228 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -0.403 -3.434 -5.703 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -0.329 -1.904 -4.798 1.00 0.00 H new ATOM 0 HG13 VAL A 54 1.157 -2.608 -5.476 1.00 0.00 H new ATOM 0 HG21 VAL A 54 0.491 -5.458 -4.838 1.00 0.00 H new ATOM 0 HG22 VAL A 54 2.082 -4.717 -4.542 1.00 0.00 H new ATOM 0 HG23 VAL A 54 1.230 -5.552 -3.221 1.00 0.00 H new ATOM 854 N ILE A 55 1.388 -0.874 -1.286 1.00 0.00 N ATOM 855 CA ILE A 55 0.966 0.327 -0.579 1.00 0.00 C ATOM 856 C ILE A 55 0.861 1.435 -1.623 1.00 0.00 C ATOM 857 O ILE A 55 1.731 1.541 -2.488 1.00 0.00 O ATOM 858 CB ILE A 55 1.921 0.620 0.606 1.00 0.00 C ATOM 859 CG1 ILE A 55 2.279 -0.704 1.337 1.00 0.00 C ATOM 860 CG2 ILE A 55 1.295 1.663 1.544 1.00 0.00 C ATOM 861 CD1 ILE A 55 3.097 -0.581 2.619 1.00 0.00 C ATOM 0 H ILE A 55 2.365 -1.116 -1.118 1.00 0.00 H new ATOM 0 HA ILE A 55 -0.011 0.222 -0.106 1.00 0.00 H new ATOM 0 HB ILE A 55 2.853 1.045 0.234 1.00 0.00 H new ATOM 0 HG12 ILE A 55 1.350 -1.223 1.575 1.00 0.00 H new ATOM 0 HG13 ILE A 55 2.830 -1.338 0.642 1.00 0.00 H new ATOM 0 HG21 ILE A 55 1.974 1.861 2.373 1.00 0.00 H new ATOM 0 HG22 ILE A 55 1.115 2.586 0.993 1.00 0.00 H new ATOM 0 HG23 ILE A 55 0.350 1.283 1.932 1.00 0.00 H new ATOM 0 HD11 ILE A 55 3.279 -1.574 3.031 1.00 0.00 H new ATOM 0 HD12 ILE A 55 4.049 -0.099 2.398 1.00 0.00 H new ATOM 0 HD13 ILE A 55 2.547 0.018 3.345 1.00 0.00 H new ATOM 873 N SER A 56 -0.232 2.192 -1.621 1.00 0.00 N ATOM 874 CA SER A 56 -0.551 3.120 -2.698 1.00 0.00 C ATOM 875 C SER A 56 -1.348 4.308 -2.159 1.00 0.00 C ATOM 876 O SER A 56 -2.059 4.170 -1.163 1.00 0.00 O ATOM 877 CB SER A 56 -1.304 2.365 -3.816 1.00 0.00 C ATOM 878 OG SER A 56 -2.032 1.217 -3.378 1.00 0.00 O ATOM 0 H SER A 56 -0.922 2.178 -0.870 1.00 0.00 H new ATOM 0 HA SER A 56 0.366 3.525 -3.126 1.00 0.00 H new ATOM 0 HB2 SER A 56 -1.997 3.055 -4.298 1.00 0.00 H new ATOM 0 HB3 SER A 56 -0.585 2.054 -4.574 1.00 0.00 H new ATOM 0 HG SER A 56 -1.404 0.508 -3.127 1.00 0.00 H new ATOM 884 N ASP A 57 -1.269 5.458 -2.830 1.00 0.00 N ATOM 885 CA ASP A 57 -2.255 6.531 -2.666 1.00 0.00 C ATOM 886 C ASP A 57 -3.440 6.248 -3.589 1.00 0.00 C ATOM 887 O ASP A 57 -3.369 5.394 -4.474 1.00 0.00 O ATOM 888 CB ASP A 57 -1.602 7.898 -2.943 1.00 0.00 C ATOM 889 CG ASP A 57 -2.323 9.119 -2.349 1.00 0.00 C ATOM 890 OD1 ASP A 57 -3.550 9.294 -2.531 1.00 0.00 O ATOM 891 OD2 ASP A 57 -1.649 9.974 -1.738 1.00 0.00 O ATOM 0 H ASP A 57 -0.528 5.672 -3.497 1.00 0.00 H new ATOM 0 HA ASP A 57 -2.623 6.564 -1.640 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -0.583 7.878 -2.555 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -1.530 8.032 -4.022 1.00 0.00 H new ATOM 896 N TRP A 58 -4.541 6.966 -3.396 1.00 0.00 N ATOM 897 CA TRP A 58 -5.619 7.066 -4.359 1.00 0.00 C ATOM 898 C TRP A 58 -5.196 7.939 -5.541 1.00 0.00 C ATOM 899 O TRP A 58 -5.495 7.581 -6.681 1.00 0.00 O ATOM 900 CB TRP A 58 -6.839 7.690 -3.671 1.00 0.00 C ATOM 901 CG TRP A 58 -8.139 7.500 -4.391 1.00 0.00 C ATOM 902 CD1 TRP A 58 -8.473 7.965 -5.620 1.00 0.00 C ATOM 903 CD2 TRP A 58 -9.279 6.719 -3.936 1.00 0.00 C ATOM 904 NE1 TRP A 58 -9.736 7.520 -5.954 1.00 0.00 N ATOM 905 CE2 TRP A 58 -10.282 6.758 -4.946 1.00 0.00 C ATOM 906 CE3 TRP A 58 -9.549 5.963 -2.776 1.00 0.00 C ATOM 907 CZ2 TRP A 58 -11.514 6.116 -4.794 1.00 0.00 C ATOM 908 CZ3 TRP A 58 -10.774 5.292 -2.615 1.00 0.00 C ATOM 909 CH2 TRP A 58 -11.752 5.384 -3.622 1.00 0.00 C ATOM 0 H TRP A 58 -4.707 7.504 -2.546 1.00 0.00 H new ATOM 0 HA TRP A 58 -5.865 6.072 -4.731 1.00 0.00 H new ATOM 0 HB2 TRP A 58 -6.930 7.266 -2.671 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -6.661 8.759 -3.549 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -7.847 8.588 -6.242 1.00 0.00 H new ATOM 0 HE1 TRP A 58 -10.205 7.729 -6.835 1.00 0.00 H new ATOM 0 HE3 TRP A 58 -8.802 5.899 -1.999 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 -12.268 6.182 -5.564 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 -10.963 4.710 -1.725 1.00 0.00 H new ATOM 0 HH2 TRP A 58 -12.700 4.884 -3.490 1.00 0.00 H new ATOM 920 N ASN A 59 -4.554 9.079 -5.229 1.00 0.00 N ATOM 921 CA ASN A 59 -4.358 10.329 -5.990 1.00 0.00 C ATOM 922 C ASN A 59 -3.443 10.229 -7.223 1.00 0.00 C ATOM 923 O ASN A 59 -2.749 11.178 -7.599 1.00 0.00 O ATOM 924 CB ASN A 59 -3.843 11.400 -5.006 1.00 0.00 C ATOM 925 CG ASN A 59 -3.998 12.818 -5.544 1.00 0.00 C ATOM 926 OD1 ASN A 59 -5.086 13.205 -5.966 1.00 0.00 O ATOM 927 ND2 ASN A 59 -2.997 13.669 -5.432 1.00 0.00 N ATOM 0 H ASN A 59 -4.101 9.156 -4.318 1.00 0.00 H new ATOM 0 HA ASN A 59 -5.325 10.593 -6.418 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -4.384 11.312 -4.064 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -2.792 11.212 -4.788 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -3.126 14.646 -5.695 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -2.093 13.350 -5.082 1.00 0.00 H new ATOM 934 N MET A 60 -3.412 9.052 -7.832 1.00 0.00 N ATOM 935 CA MET A 60 -2.751 8.710 -9.081 1.00 0.00 C ATOM 936 C MET A 60 -3.424 9.465 -10.256 1.00 0.00 C ATOM 937 O MET A 60 -4.436 10.148 -10.044 1.00 0.00 O ATOM 938 CB MET A 60 -2.836 7.179 -9.178 1.00 0.00 C ATOM 939 CG MET A 60 -1.992 6.505 -8.084 1.00 0.00 C ATOM 940 SD MET A 60 -2.419 4.775 -7.774 1.00 0.00 S ATOM 941 CE MET A 60 -1.040 4.343 -6.689 1.00 0.00 C ATOM 0 H MET A 60 -3.889 8.245 -7.430 1.00 0.00 H new ATOM 0 HA MET A 60 -1.705 9.014 -9.123 1.00 0.00 H new ATOM 0 HB2 MET A 60 -3.875 6.863 -9.086 1.00 0.00 H new ATOM 0 HB3 MET A 60 -2.490 6.854 -10.159 1.00 0.00 H new ATOM 0 HG2 MET A 60 -0.941 6.563 -8.366 1.00 0.00 H new ATOM 0 HG3 MET A 60 -2.105 7.067 -7.157 1.00 0.00 H new ATOM 0 HE1 MET A 60 -0.994 3.260 -6.573 1.00 0.00 H new ATOM 0 HE2 MET A 60 -0.108 4.701 -7.125 1.00 0.00 H new ATOM 0 HE3 MET A 60 -1.186 4.807 -5.713 1.00 0.00 H new ATOM 951 N PRO A 61 -2.852 9.445 -11.477 1.00 0.00 N ATOM 952 CA PRO A 61 -3.350 10.234 -12.595 1.00 0.00 C ATOM 953 C PRO A 61 -4.429 9.509 -13.402 1.00 0.00 C ATOM 954 O PRO A 61 -5.366 10.155 -13.881 1.00 0.00 O ATOM 955 CB PRO A 61 -2.116 10.479 -13.464 1.00 0.00 C ATOM 956 CG PRO A 61 -1.264 9.229 -13.273 1.00 0.00 C ATOM 957 CD PRO A 61 -1.585 8.825 -11.835 1.00 0.00 C ATOM 0 HA PRO A 61 -3.825 11.150 -12.244 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -2.388 10.618 -14.510 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -1.581 11.376 -13.151 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -1.529 8.445 -13.983 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -0.203 9.437 -13.409 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -1.651 7.741 -11.747 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -0.794 9.152 -11.160 1.00 0.00 H new ATOM 965 N ASN A 62 -4.275 8.196 -13.617 1.00 0.00 N ATOM 966 CA ASN A 62 -5.058 7.434 -14.574 1.00 0.00 C ATOM 967 C ASN A 62 -5.720 6.268 -13.869 1.00 0.00 C ATOM 968 O ASN A 62 -6.904 6.350 -13.542 1.00 0.00 O ATOM 969 CB ASN A 62 -4.201 7.000 -15.771 1.00 0.00 C ATOM 970 CG ASN A 62 -5.089 6.793 -16.988 1.00 0.00 C ATOM 971 OD1 ASN A 62 -5.343 7.733 -17.735 1.00 0.00 O ATOM 972 ND2 ASN A 62 -5.611 5.605 -17.217 1.00 0.00 N ATOM 0 H ASN A 62 -3.588 7.632 -13.117 1.00 0.00 H new ATOM 0 HA ASN A 62 -5.847 8.064 -14.985 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -3.446 7.757 -15.984 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -3.670 6.078 -15.535 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -6.228 5.465 -18.017 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -5.398 4.826 -16.594 1.00 0.00 H new ATOM 979 N MET A 63 -4.960 5.213 -13.579 1.00 0.00 N ATOM 980 CA MET A 63 -5.420 4.155 -12.695 1.00 0.00 C ATOM 981 C MET A 63 -5.401 4.734 -11.287 1.00 0.00 C ATOM 982 O MET A 63 -4.319 4.926 -10.734 1.00 0.00 O ATOM 983 CB MET A 63 -4.526 2.908 -12.798 1.00 0.00 C ATOM 984 CG MET A 63 -5.341 1.646 -12.531 1.00 0.00 C ATOM 985 SD MET A 63 -6.227 1.091 -14.010 1.00 0.00 S ATOM 986 CE MET A 63 -6.496 -0.628 -13.551 1.00 0.00 C ATOM 0 H MET A 63 -4.019 5.072 -13.948 1.00 0.00 H new ATOM 0 HA MET A 63 -6.423 3.828 -12.970 1.00 0.00 H new ATOM 0 HB2 MET A 63 -4.077 2.856 -13.790 1.00 0.00 H new ATOM 0 HB3 MET A 63 -3.708 2.979 -12.081 1.00 0.00 H new ATOM 0 HG2 MET A 63 -4.679 0.852 -12.185 1.00 0.00 H new ATOM 0 HG3 MET A 63 -6.055 1.837 -11.730 1.00 0.00 H new ATOM 0 HE1 MET A 63 -5.838 -1.269 -14.138 1.00 0.00 H new ATOM 0 HE2 MET A 63 -6.279 -0.760 -12.491 1.00 0.00 H new ATOM 0 HE3 MET A 63 -7.534 -0.898 -13.746 1.00 0.00 H new ATOM 996 N ASP A 64 -6.565 5.085 -10.741 1.00 0.00 N ATOM 997 CA ASP A 64 -6.629 5.503 -9.345 1.00 0.00 C ATOM 998 C ASP A 64 -6.312 4.314 -8.434 1.00 0.00 C ATOM 999 O ASP A 64 -6.335 3.151 -8.861 1.00 0.00 O ATOM 1000 CB ASP A 64 -7.954 6.198 -8.994 1.00 0.00 C ATOM 1001 CG ASP A 64 -9.181 5.295 -8.934 1.00 0.00 C ATOM 1002 OD1 ASP A 64 -9.171 4.312 -8.174 1.00 0.00 O ATOM 1003 OD2 ASP A 64 -10.186 5.635 -9.604 1.00 0.00 O ATOM 0 H ASP A 64 -7.458 5.088 -11.234 1.00 0.00 H new ATOM 0 HA ASP A 64 -5.867 6.264 -9.178 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -7.840 6.689 -8.028 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -8.138 6.981 -9.730 1.00 0.00 H new ATOM 1008 N GLY A 65 -6.010 4.591 -7.165 1.00 0.00 N ATOM 1009 CA GLY A 65 -5.602 3.537 -6.240 1.00 0.00 C ATOM 1010 C GLY A 65 -6.680 2.467 -5.991 1.00 0.00 C ATOM 1011 O GLY A 65 -6.351 1.326 -5.626 1.00 0.00 O ATOM 0 H GLY A 65 -6.040 5.526 -6.759 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -4.707 3.052 -6.631 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -5.329 3.990 -5.287 1.00 0.00 H new ATOM 1015 N LEU A 66 -7.958 2.817 -6.162 1.00 0.00 N ATOM 1016 CA LEU A 66 -9.098 1.920 -6.019 1.00 0.00 C ATOM 1017 C LEU A 66 -9.143 0.981 -7.222 1.00 0.00 C ATOM 1018 O LEU A 66 -9.319 -0.223 -7.053 1.00 0.00 O ATOM 1019 CB LEU A 66 -10.403 2.743 -5.874 1.00 0.00 C ATOM 1020 CG LEU A 66 -11.378 2.218 -4.826 1.00 0.00 C ATOM 1021 CD1 LEU A 66 -11.939 0.845 -5.170 1.00 0.00 C ATOM 1022 CD2 LEU A 66 -10.743 2.220 -3.438 1.00 0.00 C ATOM 0 H LEU A 66 -8.232 3.767 -6.413 1.00 0.00 H new ATOM 0 HA LEU A 66 -8.996 1.316 -5.118 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -10.141 3.771 -5.624 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -10.909 2.769 -6.839 1.00 0.00 H new ATOM 0 HG LEU A 66 -12.225 2.904 -4.821 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -12.626 0.526 -4.386 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -12.471 0.897 -6.120 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -11.122 0.128 -5.250 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -11.460 1.841 -2.709 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -9.858 1.583 -3.442 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -10.457 3.237 -3.170 1.00 0.00 H new ATOM 1034 N GLU A 67 -8.923 1.499 -8.429 1.00 0.00 N ATOM 1035 CA GLU A 67 -8.807 0.699 -9.639 1.00 0.00 C ATOM 1036 C GLU A 67 -7.598 -0.231 -9.571 1.00 0.00 C ATOM 1037 O GLU A 67 -7.728 -1.402 -9.936 1.00 0.00 O ATOM 1038 CB GLU A 67 -8.721 1.596 -10.882 1.00 0.00 C ATOM 1039 CG GLU A 67 -10.053 2.253 -11.233 1.00 0.00 C ATOM 1040 CD GLU A 67 -11.110 1.212 -11.610 1.00 0.00 C ATOM 1041 OE1 GLU A 67 -11.139 0.785 -12.789 1.00 0.00 O ATOM 1042 OE2 GLU A 67 -11.918 0.813 -10.741 1.00 0.00 O ATOM 0 H GLU A 67 -8.819 2.500 -8.592 1.00 0.00 H new ATOM 0 HA GLU A 67 -9.705 0.086 -9.717 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -7.973 2.370 -10.714 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -8.380 1.002 -11.730 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -10.405 2.840 -10.385 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -9.911 2.946 -12.063 1.00 0.00 H new ATOM 1049 N LEU A 68 -6.442 0.245 -9.087 1.00 0.00 N ATOM 1050 CA LEU A 68 -5.262 -0.598 -8.869 1.00 0.00 C ATOM 1051 C LEU A 68 -5.644 -1.779 -7.978 1.00 0.00 C ATOM 1052 O LEU A 68 -5.425 -2.931 -8.366 1.00 0.00 O ATOM 1053 CB LEU A 68 -4.105 0.215 -8.262 1.00 0.00 C ATOM 1054 CG LEU A 68 -2.870 -0.640 -7.891 1.00 0.00 C ATOM 1055 CD1 LEU A 68 -2.196 -1.268 -9.122 1.00 0.00 C ATOM 1056 CD2 LEU A 68 -1.858 0.229 -7.137 1.00 0.00 C ATOM 0 H LEU A 68 -6.301 1.224 -8.837 1.00 0.00 H new ATOM 0 HA LEU A 68 -4.912 -0.980 -9.828 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -3.803 0.985 -8.972 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -4.462 0.727 -7.369 1.00 0.00 H new ATOM 0 HG LEU A 68 -3.216 -1.459 -7.260 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -1.336 -1.857 -8.805 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -2.908 -1.913 -9.637 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -1.866 -0.479 -9.798 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -0.987 -0.371 -6.875 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -1.548 1.060 -7.771 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -2.318 0.618 -6.228 1.00 0.00 H new ATOM 1068 N LEU A 69 -6.260 -1.495 -6.822 1.00 0.00 N ATOM 1069 CA LEU A 69 -6.783 -2.516 -5.917 1.00 0.00 C ATOM 1070 C LEU A 69 -7.677 -3.482 -6.677 1.00 0.00 C ATOM 1071 O LEU A 69 -7.400 -4.674 -6.678 1.00 0.00 O ATOM 1072 CB LEU A 69 -7.502 -1.853 -4.732 1.00 0.00 C ATOM 1073 CG LEU A 69 -8.672 -2.606 -4.057 1.00 0.00 C ATOM 1074 CD1 LEU A 69 -8.397 -4.011 -3.508 1.00 0.00 C ATOM 1075 CD2 LEU A 69 -9.132 -1.774 -2.866 1.00 0.00 C ATOM 0 H LEU A 69 -6.408 -0.542 -6.490 1.00 0.00 H new ATOM 0 HA LEU A 69 -5.959 -3.100 -5.506 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -6.755 -1.648 -3.965 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -7.882 -0.890 -5.073 1.00 0.00 H new ATOM 0 HG LEU A 69 -9.397 -2.739 -4.860 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -9.308 -4.413 -3.065 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -8.071 -4.661 -4.320 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -7.617 -3.959 -2.749 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -9.959 -2.279 -2.367 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -8.305 -1.653 -2.166 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -9.461 -0.794 -3.212 1.00 0.00 H new ATOM 1087 N LYS A 70 -8.747 -3.008 -7.311 1.00 0.00 N ATOM 1088 CA LYS A 70 -9.763 -3.880 -7.906 1.00 0.00 C ATOM 1089 C LYS A 70 -9.202 -4.741 -9.032 1.00 0.00 C ATOM 1090 O LYS A 70 -9.703 -5.845 -9.264 1.00 0.00 O ATOM 1091 CB LYS A 70 -10.902 -3.024 -8.454 1.00 0.00 C ATOM 1092 CG LYS A 70 -11.769 -2.407 -7.350 1.00 0.00 C ATOM 1093 CD LYS A 70 -12.754 -1.431 -8.004 1.00 0.00 C ATOM 1094 CE LYS A 70 -13.943 -1.102 -7.099 1.00 0.00 C ATOM 1095 NZ LYS A 70 -14.773 -0.018 -7.665 1.00 0.00 N ATOM 0 H LYS A 70 -8.936 -2.012 -7.428 1.00 0.00 H new ATOM 0 HA LYS A 70 -10.120 -4.549 -7.123 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -10.487 -2.227 -9.071 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -11.529 -3.635 -9.103 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -12.308 -3.186 -6.810 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -11.145 -1.887 -6.623 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -12.231 -0.510 -8.260 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -13.120 -1.860 -8.937 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -14.554 -1.994 -6.961 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -13.581 -0.808 -6.114 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -15.570 0.179 -7.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -14.196 0.840 -7.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -15.138 -0.310 -8.594 1.00 0.00 H new ATOM 1109 N THR A 71 -8.199 -4.248 -9.747 1.00 0.00 N ATOM 1110 CA THR A 71 -7.520 -4.974 -10.808 1.00 0.00 C ATOM 1111 C THR A 71 -6.721 -6.112 -10.179 1.00 0.00 C ATOM 1112 O THR A 71 -6.899 -7.273 -10.549 1.00 0.00 O ATOM 1113 CB THR A 71 -6.670 -3.973 -11.597 1.00 0.00 C ATOM 1114 OG1 THR A 71 -7.548 -2.968 -12.050 1.00 0.00 O ATOM 1115 CG2 THR A 71 -5.982 -4.555 -12.826 1.00 0.00 C ATOM 0 H THR A 71 -7.827 -3.309 -9.600 1.00 0.00 H new ATOM 0 HA THR A 71 -8.210 -5.433 -11.516 1.00 0.00 H new ATOM 0 HB THR A 71 -5.881 -3.623 -10.931 1.00 0.00 H new ATOM 0 HG1 THR A 71 -7.535 -2.215 -11.423 1.00 0.00 H new ATOM 0 HG21 THR A 71 -5.403 -3.776 -13.322 1.00 0.00 H new ATOM 0 HG22 THR A 71 -5.317 -5.363 -12.522 1.00 0.00 H new ATOM 0 HG23 THR A 71 -6.733 -4.943 -13.514 1.00 0.00 H new ATOM 1123 N ILE A 72 -5.905 -5.806 -9.169 1.00 0.00 N ATOM 1124 CA ILE A 72 -5.170 -6.800 -8.399 1.00 0.00 C ATOM 1125 C ILE A 72 -6.143 -7.827 -7.804 1.00 0.00 C ATOM 1126 O ILE A 72 -5.919 -9.028 -7.964 1.00 0.00 O ATOM 1127 CB ILE A 72 -4.287 -6.064 -7.364 1.00 0.00 C ATOM 1128 CG1 ILE A 72 -3.038 -5.547 -8.115 1.00 0.00 C ATOM 1129 CG2 ILE A 72 -3.911 -6.965 -6.181 1.00 0.00 C ATOM 1130 CD1 ILE A 72 -2.097 -4.690 -7.268 1.00 0.00 C ATOM 0 H ILE A 72 -5.737 -4.848 -8.862 1.00 0.00 H new ATOM 0 HA ILE A 72 -4.495 -7.382 -9.027 1.00 0.00 H new ATOM 0 HB ILE A 72 -4.838 -5.231 -6.926 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -2.482 -6.402 -8.500 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -3.363 -4.964 -8.976 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -3.291 -6.406 -5.480 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -4.817 -7.300 -5.676 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -3.357 -7.831 -6.545 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -1.250 -4.371 -7.875 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -2.632 -3.813 -6.904 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -1.737 -5.273 -6.421 1.00 0.00 H new ATOM 1142 N ARG A 73 -7.236 -7.371 -7.183 1.00 0.00 N ATOM 1143 CA ARG A 73 -8.212 -8.194 -6.473 1.00 0.00 C ATOM 1144 C ARG A 73 -8.857 -9.254 -7.367 1.00 0.00 C ATOM 1145 O ARG A 73 -9.355 -10.243 -6.840 1.00 0.00 O ATOM 1146 CB ARG A 73 -9.305 -7.312 -5.827 1.00 0.00 C ATOM 1147 CG ARG A 73 -9.784 -7.919 -4.497 1.00 0.00 C ATOM 1148 CD ARG A 73 -8.821 -7.594 -3.346 1.00 0.00 C ATOM 1149 NE ARG A 73 -8.992 -8.517 -2.219 1.00 0.00 N ATOM 1150 CZ ARG A 73 -8.129 -8.700 -1.217 1.00 0.00 C ATOM 1151 NH1 ARG A 73 -7.082 -7.894 -1.046 1.00 0.00 N ATOM 1152 NH2 ARG A 73 -8.341 -9.695 -0.369 1.00 0.00 N ATOM 0 H ARG A 73 -7.471 -6.379 -7.162 1.00 0.00 H new ATOM 0 HA ARG A 73 -7.662 -8.721 -5.693 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -8.914 -6.309 -5.654 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -10.148 -7.212 -6.510 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -10.777 -7.538 -4.259 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -9.874 -9.000 -4.602 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -7.793 -7.645 -3.706 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -8.990 -6.572 -3.008 1.00 0.00 H new ATOM 0 HE ARG A 73 -9.849 -9.070 -2.199 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -6.926 -7.117 -1.688 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -6.436 -8.054 -0.273 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -9.151 -10.303 -0.489 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -7.694 -9.853 0.404 1.00 0.00 H new ATOM 1166 N ALA A 74 -8.872 -9.039 -8.685 1.00 0.00 N ATOM 1167 CA ALA A 74 -9.638 -9.832 -9.625 1.00 0.00 C ATOM 1168 C ALA A 74 -9.254 -11.314 -9.556 1.00 0.00 C ATOM 1169 O ALA A 74 -10.116 -12.133 -9.238 1.00 0.00 O ATOM 1170 CB ALA A 74 -9.480 -9.241 -11.024 1.00 0.00 C ATOM 0 H ALA A 74 -8.338 -8.291 -9.128 1.00 0.00 H new ATOM 0 HA ALA A 74 -10.694 -9.793 -9.359 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -10.054 -9.833 -11.736 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -9.845 -8.214 -11.029 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -8.428 -9.253 -11.307 1.00 0.00 H new ATOM 1176 N ASP A 75 -7.999 -11.668 -9.856 1.00 0.00 N ATOM 1177 CA ASP A 75 -7.400 -12.974 -9.568 1.00 0.00 C ATOM 1178 C ASP A 75 -5.868 -12.837 -9.634 1.00 0.00 C ATOM 1179 O ASP A 75 -5.278 -12.281 -8.706 1.00 0.00 O ATOM 1180 CB ASP A 75 -8.009 -14.143 -10.386 1.00 0.00 C ATOM 1181 CG ASP A 75 -7.823 -14.101 -11.898 1.00 0.00 C ATOM 1182 OD1 ASP A 75 -8.665 -13.517 -12.620 1.00 0.00 O ATOM 1183 OD2 ASP A 75 -6.861 -14.717 -12.401 1.00 0.00 O ATOM 0 H ASP A 75 -7.352 -11.031 -10.321 1.00 0.00 H new ATOM 0 HA ASP A 75 -7.657 -13.274 -8.552 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -7.579 -15.074 -10.018 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -9.078 -14.181 -10.177 1.00 0.00 H new ATOM 1188 N GLY A 76 -5.190 -13.290 -10.694 1.00 0.00 N ATOM 1189 CA GLY A 76 -3.750 -13.166 -10.928 1.00 0.00 C ATOM 1190 C GLY A 76 -2.861 -13.894 -9.911 1.00 0.00 C ATOM 1191 O GLY A 76 -1.640 -13.781 -9.988 1.00 0.00 O ATOM 0 H GLY A 76 -5.660 -13.781 -11.454 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -3.525 -13.549 -11.924 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -3.487 -12.108 -10.926 1.00 0.00 H new ATOM 1195 N ALA A 77 -3.448 -14.599 -8.940 1.00 0.00 N ATOM 1196 CA ALA A 77 -2.870 -15.019 -7.660 1.00 0.00 C ATOM 1197 C ALA A 77 -2.446 -13.827 -6.793 1.00 0.00 C ATOM 1198 O ALA A 77 -1.820 -14.007 -5.745 1.00 0.00 O ATOM 1199 CB ALA A 77 -1.759 -16.058 -7.841 1.00 0.00 C ATOM 0 H ALA A 77 -4.413 -14.915 -9.035 1.00 0.00 H new ATOM 0 HA ALA A 77 -3.662 -15.522 -7.105 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -1.361 -16.339 -6.866 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -2.164 -16.941 -8.336 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -0.961 -15.635 -8.450 1.00 0.00 H new ATOM 1205 N MET A 78 -2.815 -12.615 -7.203 1.00 0.00 N ATOM 1206 CA MET A 78 -2.514 -11.359 -6.537 1.00 0.00 C ATOM 1207 C MET A 78 -3.673 -10.913 -5.661 1.00 0.00 C ATOM 1208 O MET A 78 -3.514 -9.981 -4.878 1.00 0.00 O ATOM 1209 CB MET A 78 -2.216 -10.290 -7.600 1.00 0.00 C ATOM 1210 CG MET A 78 -1.022 -10.671 -8.471 1.00 0.00 C ATOM 1211 SD MET A 78 0.542 -10.798 -7.561 1.00 0.00 S ATOM 1212 CE MET A 78 1.155 -12.363 -8.236 1.00 0.00 C ATOM 0 H MET A 78 -3.361 -12.481 -8.054 1.00 0.00 H new ATOM 0 HA MET A 78 -1.645 -11.499 -5.894 1.00 0.00 H new ATOM 0 HB2 MET A 78 -3.095 -10.149 -8.230 1.00 0.00 H new ATOM 0 HB3 MET A 78 -2.019 -9.336 -7.110 1.00 0.00 H new ATOM 0 HG2 MET A 78 -1.228 -11.626 -8.955 1.00 0.00 H new ATOM 0 HG3 MET A 78 -0.911 -9.930 -9.263 1.00 0.00 H new ATOM 0 HE1 MET A 78 2.118 -12.601 -7.785 1.00 0.00 H new ATOM 0 HE2 MET A 78 0.443 -13.158 -8.014 1.00 0.00 H new ATOM 0 HE3 MET A 78 1.273 -12.272 -9.316 1.00 0.00 H new ATOM 1222 N SER A 79 -4.826 -11.569 -5.782 1.00 0.00 N ATOM 1223 CA SER A 79 -6.078 -11.087 -5.239 1.00 0.00 C ATOM 1224 C SER A 79 -5.977 -10.776 -3.749 1.00 0.00 C ATOM 1225 O SER A 79 -6.385 -9.699 -3.327 1.00 0.00 O ATOM 1226 CB SER A 79 -7.209 -12.070 -5.558 1.00 0.00 C ATOM 1227 OG SER A 79 -6.917 -13.382 -5.111 1.00 0.00 O ATOM 0 H SER A 79 -4.909 -12.462 -6.268 1.00 0.00 H new ATOM 0 HA SER A 79 -6.315 -10.139 -5.723 1.00 0.00 H new ATOM 0 HB2 SER A 79 -8.131 -11.725 -5.090 1.00 0.00 H new ATOM 0 HB3 SER A 79 -7.383 -12.084 -6.634 1.00 0.00 H new ATOM 0 HG SER A 79 -7.664 -13.977 -5.332 1.00 0.00 H new ATOM 1233 N ALA A 80 -5.399 -11.690 -2.967 1.00 0.00 N ATOM 1234 CA ALA A 80 -5.303 -11.590 -1.518 1.00 0.00 C ATOM 1235 C ALA A 80 -4.250 -10.584 -1.027 1.00 0.00 C ATOM 1236 O ALA A 80 -4.044 -10.490 0.185 1.00 0.00 O ATOM 1237 CB ALA A 80 -5.033 -12.983 -0.943 1.00 0.00 C ATOM 0 H ALA A 80 -4.975 -12.540 -3.338 1.00 0.00 H new ATOM 0 HA ALA A 80 -6.256 -11.202 -1.158 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -4.959 -12.920 0.143 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -5.850 -13.653 -1.213 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -4.098 -13.369 -1.349 1.00 0.00 H new ATOM 1243 N LEU A 81 -3.579 -9.837 -1.912 1.00 0.00 N ATOM 1244 CA LEU A 81 -2.534 -8.893 -1.524 1.00 0.00 C ATOM 1245 C LEU A 81 -3.041 -7.899 -0.473 1.00 0.00 C ATOM 1246 O LEU A 81 -4.162 -7.387 -0.601 1.00 0.00 O ATOM 1247 CB LEU A 81 -2.055 -8.077 -2.738 1.00 0.00 C ATOM 1248 CG LEU A 81 -0.868 -8.684 -3.505 1.00 0.00 C ATOM 1249 CD1 LEU A 81 -0.692 -7.871 -4.788 1.00 0.00 C ATOM 1250 CD2 LEU A 81 0.427 -8.649 -2.684 1.00 0.00 C ATOM 0 H LEU A 81 -3.748 -9.873 -2.917 1.00 0.00 H new ATOM 0 HA LEU A 81 -1.716 -9.485 -1.114 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -2.890 -7.957 -3.428 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -1.776 -7.079 -2.399 1.00 0.00 H new ATOM 0 HG LEU A 81 -1.075 -9.732 -3.720 1.00 0.00 H new ATOM 0 HD11 LEU A 81 0.144 -8.272 -5.361 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -1.603 -7.930 -5.384 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -0.491 -6.830 -4.534 1.00 0.00 H new ATOM 0 HD21 LEU A 81 1.238 -9.088 -3.265 1.00 0.00 H new ATOM 0 HD22 LEU A 81 0.674 -7.616 -2.438 1.00 0.00 H new ATOM 0 HD23 LEU A 81 0.290 -9.218 -1.764 1.00 0.00 H new ATOM 1262 N PRO A 82 -2.199 -7.514 0.502 1.00 0.00 N ATOM 1263 CA PRO A 82 -2.409 -6.318 1.289 1.00 0.00 C ATOM 1264 C PRO A 82 -2.089 -5.075 0.443 1.00 0.00 C ATOM 1265 O PRO A 82 -1.071 -4.403 0.644 1.00 0.00 O ATOM 1266 CB PRO A 82 -1.521 -6.491 2.524 1.00 0.00 C ATOM 1267 CG PRO A 82 -0.334 -7.285 1.988 1.00 0.00 C ATOM 1268 CD PRO A 82 -0.963 -8.173 0.912 1.00 0.00 C ATOM 0 HA PRO A 82 -3.441 -6.173 1.607 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -1.211 -5.530 2.935 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -2.038 -7.027 3.320 1.00 0.00 H new ATOM 0 HG2 PRO A 82 0.433 -6.631 1.573 1.00 0.00 H new ATOM 0 HG3 PRO A 82 0.141 -7.876 2.771 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -0.288 -8.293 0.065 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -1.166 -9.170 1.302 1.00 0.00 H new ATOM 1276 N VAL A 83 -2.954 -4.755 -0.523 1.00 0.00 N ATOM 1277 CA VAL A 83 -3.005 -3.399 -1.056 1.00 0.00 C ATOM 1278 C VAL A 83 -3.459 -2.506 0.104 1.00 0.00 C ATOM 1279 O VAL A 83 -4.340 -2.910 0.879 1.00 0.00 O ATOM 1280 CB VAL A 83 -3.879 -3.268 -2.324 1.00 0.00 C ATOM 1281 CG1 VAL A 83 -3.725 -4.414 -3.338 1.00 0.00 C ATOM 1282 CG2 VAL A 83 -5.371 -3.231 -1.980 1.00 0.00 C ATOM 0 H VAL A 83 -3.616 -5.407 -0.944 1.00 0.00 H new ATOM 0 HA VAL A 83 -2.024 -3.087 -1.414 1.00 0.00 H new ATOM 0 HB VAL A 83 -3.523 -2.339 -2.769 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -4.377 -4.234 -4.193 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -2.690 -4.465 -3.676 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -3.999 -5.357 -2.865 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -5.954 -3.138 -2.897 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -5.649 -4.151 -1.465 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -5.574 -2.378 -1.333 1.00 0.00 H new ATOM 1292 N LEU A 84 -2.853 -1.337 0.281 1.00 0.00 N ATOM 1293 CA LEU A 84 -3.048 -0.525 1.477 1.00 0.00 C ATOM 1294 C LEU A 84 -3.088 0.932 1.052 1.00 0.00 C ATOM 1295 O LEU A 84 -2.087 1.434 0.544 1.00 0.00 O ATOM 1296 CB LEU A 84 -1.925 -0.842 2.481 1.00 0.00 C ATOM 1297 CG LEU A 84 -1.920 0.017 3.761 1.00 0.00 C ATOM 1298 CD1 LEU A 84 -3.288 0.056 4.455 1.00 0.00 C ATOM 1299 CD2 LEU A 84 -0.888 -0.562 4.740 1.00 0.00 C ATOM 0 H LEU A 84 -2.214 -0.926 -0.399 1.00 0.00 H new ATOM 0 HA LEU A 84 -3.989 -0.747 1.980 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -2.003 -1.891 2.768 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -0.966 -0.719 1.978 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.670 1.037 3.470 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -3.225 0.675 5.350 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -4.029 0.476 3.775 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -3.583 -0.955 4.734 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.874 0.037 5.651 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -1.156 -1.590 4.986 1.00 0.00 H new ATOM 0 HD23 LEU A 84 0.100 -0.545 4.280 1.00 0.00 H new ATOM 1311 N MET A 85 -4.251 1.568 1.208 1.00 0.00 N ATOM 1312 CA MET A 85 -4.437 2.969 0.862 1.00 0.00 C ATOM 1313 C MET A 85 -3.759 3.824 1.929 1.00 0.00 C ATOM 1314 O MET A 85 -4.009 3.624 3.123 1.00 0.00 O ATOM 1315 CB MET A 85 -5.934 3.304 0.740 1.00 0.00 C ATOM 1316 CG MET A 85 -6.637 2.645 -0.454 1.00 0.00 C ATOM 1317 SD MET A 85 -6.353 3.478 -2.050 1.00 0.00 S ATOM 1318 CE MET A 85 -4.839 2.652 -2.617 1.00 0.00 C ATOM 0 H MET A 85 -5.089 1.120 1.579 1.00 0.00 H new ATOM 0 HA MET A 85 -3.984 3.178 -0.107 1.00 0.00 H new ATOM 0 HB2 MET A 85 -6.438 2.998 1.657 1.00 0.00 H new ATOM 0 HB3 MET A 85 -6.046 4.385 0.660 1.00 0.00 H new ATOM 0 HG2 MET A 85 -6.300 1.611 -0.533 1.00 0.00 H new ATOM 0 HG3 MET A 85 -7.709 2.617 -0.258 1.00 0.00 H new ATOM 0 HE1 MET A 85 -4.021 3.371 -2.645 1.00 0.00 H new ATOM 0 HE2 MET A 85 -4.587 1.843 -1.931 1.00 0.00 H new ATOM 0 HE3 MET A 85 -4.999 2.245 -3.616 1.00 0.00 H new ATOM 1328 N VAL A 86 -2.919 4.761 1.498 1.00 0.00 N ATOM 1329 CA VAL A 86 -2.212 5.739 2.309 1.00 0.00 C ATOM 1330 C VAL A 86 -2.334 7.059 1.547 1.00 0.00 C ATOM 1331 O VAL A 86 -1.826 7.168 0.437 1.00 0.00 O ATOM 1332 CB VAL A 86 -0.745 5.301 2.522 1.00 0.00 C ATOM 1333 CG1 VAL A 86 -0.014 6.299 3.423 1.00 0.00 C ATOM 1334 CG2 VAL A 86 -0.640 3.911 3.179 1.00 0.00 C ATOM 0 H VAL A 86 -2.702 4.861 0.506 1.00 0.00 H new ATOM 0 HA VAL A 86 -2.630 5.840 3.311 1.00 0.00 H new ATOM 0 HB VAL A 86 -0.290 5.263 1.532 1.00 0.00 H new ATOM 0 HG11 VAL A 86 1.017 5.975 3.563 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -0.025 7.285 2.958 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -0.513 6.349 4.391 1.00 0.00 H new ATOM 0 HG21 VAL A 86 0.410 3.648 3.308 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -1.131 3.930 4.152 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -1.124 3.170 2.543 1.00 0.00 H new ATOM 1344 N THR A 87 -3.098 8.021 2.062 1.00 0.00 N ATOM 1345 CA THR A 87 -3.435 9.225 1.309 1.00 0.00 C ATOM 1346 C THR A 87 -3.710 10.389 2.264 1.00 0.00 C ATOM 1347 O THR A 87 -3.881 10.192 3.469 1.00 0.00 O ATOM 1348 CB THR A 87 -4.631 8.891 0.393 1.00 0.00 C ATOM 1349 OG1 THR A 87 -4.958 9.957 -0.473 1.00 0.00 O ATOM 1350 CG2 THR A 87 -5.891 8.498 1.165 1.00 0.00 C ATOM 0 H THR A 87 -3.496 7.988 3.001 1.00 0.00 H new ATOM 0 HA THR A 87 -2.604 9.547 0.682 1.00 0.00 H new ATOM 0 HB THR A 87 -4.294 8.033 -0.189 1.00 0.00 H new ATOM 0 HG1 THR A 87 -4.338 9.963 -1.232 1.00 0.00 H new ATOM 0 HG21 THR A 87 -6.694 8.276 0.462 1.00 0.00 H new ATOM 0 HG22 THR A 87 -5.686 7.616 1.772 1.00 0.00 H new ATOM 0 HG23 THR A 87 -6.193 9.321 1.812 1.00 0.00 H new ATOM 1358 N ALA A 88 -3.791 11.614 1.743 1.00 0.00 N ATOM 1359 CA ALA A 88 -4.253 12.764 2.503 1.00 0.00 C ATOM 1360 C ALA A 88 -5.780 12.876 2.525 1.00 0.00 C ATOM 1361 O ALA A 88 -6.315 13.535 3.416 1.00 0.00 O ATOM 1362 CB ALA A 88 -3.653 14.037 1.897 1.00 0.00 C ATOM 0 H ALA A 88 -3.536 11.832 0.780 1.00 0.00 H new ATOM 0 HA ALA A 88 -3.925 12.635 3.534 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -3.995 14.905 2.461 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -2.565 13.982 1.939 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -3.972 14.131 0.859 1.00 0.00 H new ATOM 1368 N GLU A 89 -6.494 12.296 1.559 1.00 0.00 N ATOM 1369 CA GLU A 89 -7.940 12.455 1.425 1.00 0.00 C ATOM 1370 C GLU A 89 -8.643 11.463 2.341 1.00 0.00 C ATOM 1371 O GLU A 89 -8.518 10.262 2.117 1.00 0.00 O ATOM 1372 CB GLU A 89 -8.353 12.165 -0.022 1.00 0.00 C ATOM 1373 CG GLU A 89 -7.877 13.234 -1.004 1.00 0.00 C ATOM 1374 CD GLU A 89 -8.884 14.371 -1.168 1.00 0.00 C ATOM 1375 OE1 GLU A 89 -9.048 15.213 -0.251 1.00 0.00 O ATOM 1376 OE2 GLU A 89 -9.527 14.439 -2.243 1.00 0.00 O ATOM 0 H GLU A 89 -6.081 11.699 0.843 1.00 0.00 H new ATOM 0 HA GLU A 89 -8.217 13.474 1.694 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -7.950 11.198 -0.322 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -9.439 12.088 -0.076 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -6.927 13.642 -0.659 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -7.693 12.774 -1.975 1.00 0.00 H new ATOM 1383 N ALA A 90 -9.395 11.932 3.343 1.00 0.00 N ATOM 1384 CA ALA A 90 -10.315 11.061 4.058 1.00 0.00 C ATOM 1385 C ALA A 90 -11.422 10.635 3.097 1.00 0.00 C ATOM 1386 O ALA A 90 -11.311 9.557 2.534 1.00 0.00 O ATOM 1387 CB ALA A 90 -10.836 11.711 5.345 1.00 0.00 C ATOM 0 H ALA A 90 -9.381 12.898 3.669 1.00 0.00 H new ATOM 0 HA ALA A 90 -9.794 10.166 4.397 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -11.520 11.027 5.847 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -9.998 11.936 6.004 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -11.362 12.634 5.100 1.00 0.00 H new ATOM 1393 N LYS A 91 -12.448 11.470 2.875 1.00 0.00 N ATOM 1394 CA LYS A 91 -13.655 11.145 2.105 1.00 0.00 C ATOM 1395 C LYS A 91 -14.217 9.770 2.505 1.00 0.00 C ATOM 1396 O LYS A 91 -13.836 8.725 1.981 1.00 0.00 O ATOM 1397 CB LYS A 91 -13.369 11.286 0.596 1.00 0.00 C ATOM 1398 CG LYS A 91 -14.606 11.124 -0.307 1.00 0.00 C ATOM 1399 CD LYS A 91 -15.520 12.357 -0.302 1.00 0.00 C ATOM 1400 CE LYS A 91 -16.813 12.072 -1.078 1.00 0.00 C ATOM 1401 NZ LYS A 91 -17.622 13.287 -1.308 1.00 0.00 N ATOM 0 H LYS A 91 -12.459 12.422 3.240 1.00 0.00 H new ATOM 0 HA LYS A 91 -14.444 11.859 2.343 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -12.927 12.265 0.413 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -12.626 10.542 0.309 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -14.280 10.925 -1.328 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -15.176 10.255 0.021 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -15.759 12.635 0.724 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -15.000 13.204 -0.749 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -16.563 11.620 -2.038 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -17.408 11.343 -0.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -18.482 13.036 -1.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -17.886 13.706 -0.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -17.067 13.975 -1.857 1.00 0.00 H new ATOM 1415 N LYS A 92 -15.183 9.747 3.422 1.00 0.00 N ATOM 1416 CA LYS A 92 -15.791 8.491 3.868 1.00 0.00 C ATOM 1417 C LYS A 92 -16.272 7.634 2.694 1.00 0.00 C ATOM 1418 O LYS A 92 -16.118 6.425 2.769 1.00 0.00 O ATOM 1419 CB LYS A 92 -16.877 8.748 4.918 1.00 0.00 C ATOM 1420 CG LYS A 92 -16.257 9.111 6.275 1.00 0.00 C ATOM 1421 CD LYS A 92 -17.300 9.457 7.347 1.00 0.00 C ATOM 1422 CE LYS A 92 -17.627 10.951 7.474 1.00 0.00 C ATOM 1423 NZ LYS A 92 -18.340 11.519 6.313 1.00 0.00 N ATOM 0 H LYS A 92 -15.562 10.581 3.871 1.00 0.00 H new ATOM 0 HA LYS A 92 -15.018 7.899 4.359 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -17.527 9.557 4.583 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -17.501 7.861 5.025 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -15.651 8.275 6.625 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -15.585 9.960 6.144 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -18.220 8.916 7.125 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -16.942 9.095 8.311 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -18.233 11.103 8.367 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -16.698 11.503 7.620 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -18.627 12.496 6.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -17.712 11.516 5.484 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -19.184 10.947 6.110 1.00 0.00 H new ATOM 1437 N GLU A 93 -16.747 8.224 1.596 1.00 0.00 N ATOM 1438 CA GLU A 93 -17.099 7.516 0.364 1.00 0.00 C ATOM 1439 C GLU A 93 -15.917 6.726 -0.218 1.00 0.00 C ATOM 1440 O GLU A 93 -16.094 5.568 -0.591 1.00 0.00 O ATOM 1441 CB GLU A 93 -17.651 8.527 -0.652 1.00 0.00 C ATOM 1442 CG GLU A 93 -18.929 8.041 -1.344 1.00 0.00 C ATOM 1443 CD GLU A 93 -18.733 6.994 -2.441 1.00 0.00 C ATOM 1444 OE1 GLU A 93 -17.846 7.163 -3.311 1.00 0.00 O ATOM 1445 OE2 GLU A 93 -19.562 6.055 -2.503 1.00 0.00 O ATOM 0 H GLU A 93 -16.901 9.231 1.537 1.00 0.00 H new ATOM 0 HA GLU A 93 -17.865 6.777 0.598 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -17.855 9.470 -0.144 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -16.890 8.729 -1.406 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -19.595 7.627 -0.587 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -19.436 8.903 -1.777 1.00 0.00 H new ATOM 1452 N ASN A 94 -14.715 7.317 -0.236 1.00 0.00 N ATOM 1453 CA ASN A 94 -13.475 6.624 -0.585 1.00 0.00 C ATOM 1454 C ASN A 94 -13.260 5.467 0.385 1.00 0.00 C ATOM 1455 O ASN A 94 -12.907 4.371 -0.046 1.00 0.00 O ATOM 1456 CB ASN A 94 -12.215 7.513 -0.493 1.00 0.00 C ATOM 1457 CG ASN A 94 -12.050 8.604 -1.532 1.00 0.00 C ATOM 1458 OD1 ASN A 94 -12.912 8.845 -2.375 1.00 0.00 O ATOM 1459 ND2 ASN A 94 -10.936 9.314 -1.484 1.00 0.00 N ATOM 0 H ASN A 94 -14.578 8.301 -0.005 1.00 0.00 H new ATOM 0 HA ASN A 94 -13.596 6.302 -1.619 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -12.205 7.982 0.491 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -11.341 6.864 -0.545 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -10.785 10.071 -2.151 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -10.228 9.105 -0.780 1.00 0.00 H new ATOM 1466 N ILE A 95 -13.457 5.698 1.692 1.00 0.00 N ATOM 1467 CA ILE A 95 -13.326 4.628 2.684 1.00 0.00 C ATOM 1468 C ILE A 95 -14.283 3.476 2.342 1.00 0.00 C ATOM 1469 O ILE A 95 -13.835 2.326 2.393 1.00 0.00 O ATOM 1470 CB ILE A 95 -13.461 5.144 4.145 1.00 0.00 C ATOM 1471 CG1 ILE A 95 -12.123 5.692 4.688 1.00 0.00 C ATOM 1472 CG2 ILE A 95 -13.934 4.063 5.131 1.00 0.00 C ATOM 1473 CD1 ILE A 95 -11.784 7.086 4.160 1.00 0.00 C ATOM 0 H ILE A 95 -13.705 6.608 2.081 1.00 0.00 H new ATOM 0 HA ILE A 95 -12.312 4.232 2.634 1.00 0.00 H new ATOM 0 HB ILE A 95 -14.210 5.933 4.083 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -12.166 5.724 5.777 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -11.321 5.004 4.420 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -14.007 4.490 6.131 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -14.911 3.692 4.823 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -13.219 3.240 5.139 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -10.833 7.413 4.580 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -11.710 7.055 3.073 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -12.568 7.786 4.450 1.00 0.00 H new ATOM 1485 N ILE A 96 -15.558 3.748 2.012 1.00 0.00 N ATOM 1486 CA ILE A 96 -16.519 2.710 1.660 1.00 0.00 C ATOM 1487 C ILE A 96 -16.013 1.982 0.417 1.00 0.00 C ATOM 1488 O ILE A 96 -15.915 0.762 0.468 1.00 0.00 O ATOM 1489 CB ILE A 96 -17.902 3.352 1.440 1.00 0.00 C ATOM 1490 CG1 ILE A 96 -18.524 3.639 2.823 1.00 0.00 C ATOM 1491 CG2 ILE A 96 -18.882 2.461 0.658 1.00 0.00 C ATOM 1492 CD1 ILE A 96 -19.063 5.063 2.859 1.00 0.00 C ATOM 0 H ILE A 96 -15.942 4.693 1.984 1.00 0.00 H new ATOM 0 HA ILE A 96 -16.623 1.979 2.462 1.00 0.00 H new ATOM 0 HB ILE A 96 -17.743 4.254 0.849 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -19.328 2.931 3.025 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -17.776 3.503 3.604 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -19.833 2.980 0.543 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -18.468 2.240 -0.326 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -19.041 1.530 1.202 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -19.501 5.262 3.837 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -18.249 5.765 2.677 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -19.825 5.183 2.089 1.00 0.00 H new ATOM 1504 N ALA A 97 -15.675 2.689 -0.671 1.00 0.00 N ATOM 1505 CA ALA A 97 -15.198 2.067 -1.907 1.00 0.00 C ATOM 1506 C ALA A 97 -14.023 1.137 -1.631 1.00 0.00 C ATOM 1507 O ALA A 97 -13.986 0.013 -2.126 1.00 0.00 O ATOM 1508 CB ALA A 97 -14.753 3.135 -2.910 1.00 0.00 C ATOM 0 H ALA A 97 -15.726 3.707 -0.715 1.00 0.00 H new ATOM 0 HA ALA A 97 -16.025 1.492 -2.323 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -14.402 2.653 -3.822 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -15.594 3.787 -3.145 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -13.946 3.726 -2.478 1.00 0.00 H new ATOM 1514 N ALA A 98 -13.067 1.607 -0.836 1.00 0.00 N ATOM 1515 CA ALA A 98 -11.874 0.862 -0.502 1.00 0.00 C ATOM 1516 C ALA A 98 -12.246 -0.390 0.290 1.00 0.00 C ATOM 1517 O ALA A 98 -11.790 -1.481 -0.051 1.00 0.00 O ATOM 1518 CB ALA A 98 -10.905 1.804 0.217 1.00 0.00 C ATOM 0 H ALA A 98 -13.107 2.530 -0.403 1.00 0.00 H new ATOM 0 HA ALA A 98 -11.362 0.496 -1.392 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -9.997 1.261 0.478 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -10.654 2.637 -0.439 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -11.374 2.185 1.124 1.00 0.00 H new ATOM 1524 N ALA A 99 -13.105 -0.279 1.306 1.00 0.00 N ATOM 1525 CA ALA A 99 -13.553 -1.433 2.074 1.00 0.00 C ATOM 1526 C ALA A 99 -14.302 -2.421 1.175 1.00 0.00 C ATOM 1527 O ALA A 99 -14.006 -3.614 1.209 1.00 0.00 O ATOM 1528 CB ALA A 99 -14.423 -0.979 3.253 1.00 0.00 C ATOM 0 H ALA A 99 -13.504 0.608 1.614 1.00 0.00 H new ATOM 0 HA ALA A 99 -12.681 -1.949 2.476 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -14.752 -1.850 3.819 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -13.843 -0.322 3.902 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -15.293 -0.441 2.877 1.00 0.00 H new ATOM 1534 N GLN A 100 -15.232 -1.931 0.355 1.00 0.00 N ATOM 1535 CA GLN A 100 -16.039 -2.684 -0.598 1.00 0.00 C ATOM 1536 C GLN A 100 -15.153 -3.480 -1.550 1.00 0.00 C ATOM 1537 O GLN A 100 -15.340 -4.688 -1.697 1.00 0.00 O ATOM 1538 CB GLN A 100 -16.942 -1.710 -1.380 1.00 0.00 C ATOM 1539 CG GLN A 100 -18.150 -1.222 -0.572 1.00 0.00 C ATOM 1540 CD GLN A 100 -19.249 -2.273 -0.586 1.00 0.00 C ATOM 1541 OE1 GLN A 100 -20.045 -2.330 -1.523 1.00 0.00 O ATOM 1542 NE2 GLN A 100 -19.282 -3.169 0.381 1.00 0.00 N ATOM 0 H GLN A 100 -15.454 -0.935 0.340 1.00 0.00 H new ATOM 0 HA GLN A 100 -16.662 -3.395 -0.055 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -16.351 -0.849 -1.693 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -17.295 -2.201 -2.287 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -17.850 -1.013 0.455 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -18.524 -0.288 -0.991 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -18.617 -3.112 1.152 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -19.972 -3.920 0.357 1.00 0.00 H new ATOM 1551 N ALA A 101 -14.180 -2.820 -2.175 1.00 0.00 N ATOM 1552 CA ALA A 101 -13.242 -3.442 -3.092 1.00 0.00 C ATOM 1553 C ALA A 101 -12.306 -4.431 -2.392 1.00 0.00 C ATOM 1554 O ALA A 101 -11.765 -5.312 -3.062 1.00 0.00 O ATOM 1555 CB ALA A 101 -12.441 -2.346 -3.786 1.00 0.00 C ATOM 0 H ALA A 101 -14.023 -1.820 -2.052 1.00 0.00 H new ATOM 0 HA ALA A 101 -13.808 -4.020 -3.823 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -11.731 -2.798 -4.479 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -13.119 -1.692 -4.335 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -11.900 -1.763 -3.041 1.00 0.00 H new ATOM 1561 N GLY A 102 -12.127 -4.321 -1.073 1.00 0.00 N ATOM 1562 CA GLY A 102 -11.340 -5.246 -0.273 1.00 0.00 C ATOM 1563 C GLY A 102 -9.950 -4.709 0.058 1.00 0.00 C ATOM 1564 O GLY A 102 -9.042 -5.512 0.287 1.00 0.00 O ATOM 0 H GLY A 102 -12.538 -3.566 -0.524 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -11.872 -5.460 0.654 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -11.241 -6.190 -0.809 1.00 0.00 H new ATOM 1568 N ALA A 103 -9.754 -3.383 0.079 1.00 0.00 N ATOM 1569 CA ALA A 103 -8.475 -2.770 0.420 1.00 0.00 C ATOM 1570 C ALA A 103 -8.150 -3.174 1.855 1.00 0.00 C ATOM 1571 O ALA A 103 -9.027 -3.118 2.727 1.00 0.00 O ATOM 1572 CB ALA A 103 -8.510 -1.232 0.289 1.00 0.00 C ATOM 0 H ALA A 103 -10.486 -2.708 -0.142 1.00 0.00 H new ATOM 0 HA ALA A 103 -7.709 -3.117 -0.274 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -7.535 -0.822 0.553 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -8.752 -0.960 -0.738 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -9.268 -0.827 0.959 1.00 0.00 H new ATOM 1578 N SER A 104 -6.901 -3.553 2.127 1.00 0.00 N ATOM 1579 CA SER A 104 -6.533 -4.042 3.449 1.00 0.00 C ATOM 1580 C SER A 104 -6.438 -2.914 4.487 1.00 0.00 C ATOM 1581 O SER A 104 -6.161 -3.181 5.661 1.00 0.00 O ATOM 1582 CB SER A 104 -5.257 -4.882 3.355 1.00 0.00 C ATOM 1583 OG SER A 104 -4.092 -4.095 3.201 1.00 0.00 O ATOM 0 H SER A 104 -6.135 -3.530 1.454 1.00 0.00 H new ATOM 0 HA SER A 104 -7.331 -4.689 3.813 1.00 0.00 H new ATOM 0 HB2 SER A 104 -5.162 -5.491 4.254 1.00 0.00 H new ATOM 0 HB3 SER A 104 -5.340 -5.568 2.512 1.00 0.00 H new ATOM 0 HG SER A 104 -4.141 -3.599 2.357 1.00 0.00 H new ATOM 1589 N GLY A 105 -6.653 -1.654 4.096 1.00 0.00 N ATOM 1590 CA GLY A 105 -6.741 -0.534 5.010 1.00 0.00 C ATOM 1591 C GLY A 105 -6.813 0.786 4.270 1.00 0.00 C ATOM 1592 O GLY A 105 -6.531 0.836 3.071 1.00 0.00 O ATOM 0 H GLY A 105 -6.771 -1.390 3.118 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -7.623 -0.647 5.641 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -5.874 -0.534 5.671 1.00 0.00 H new ATOM 1596 N TYR A 106 -7.124 1.839 5.026 1.00 0.00 N ATOM 1597 CA TYR A 106 -7.167 3.212 4.563 1.00 0.00 C ATOM 1598 C TYR A 106 -6.570 4.114 5.646 1.00 0.00 C ATOM 1599 O TYR A 106 -7.257 4.520 6.589 1.00 0.00 O ATOM 1600 CB TYR A 106 -8.610 3.570 4.182 1.00 0.00 C ATOM 1601 CG TYR A 106 -8.732 4.761 3.257 1.00 0.00 C ATOM 1602 CD1 TYR A 106 -8.385 6.051 3.695 1.00 0.00 C ATOM 1603 CD2 TYR A 106 -9.208 4.576 1.946 1.00 0.00 C ATOM 1604 CE1 TYR A 106 -8.537 7.147 2.831 1.00 0.00 C ATOM 1605 CE2 TYR A 106 -9.372 5.673 1.085 1.00 0.00 C ATOM 1606 CZ TYR A 106 -9.056 6.974 1.530 1.00 0.00 C ATOM 1607 OH TYR A 106 -9.244 8.054 0.722 1.00 0.00 O ATOM 0 H TYR A 106 -7.361 1.748 6.014 1.00 0.00 H new ATOM 0 HA TYR A 106 -6.567 3.356 3.665 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -9.073 2.706 3.706 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -9.174 3.772 5.092 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -8.002 6.199 4.694 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -9.449 3.582 1.599 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -8.254 8.134 3.166 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -9.740 5.521 0.081 1.00 0.00 H new ATOM 0 HH TYR A 106 -9.032 8.873 1.216 1.00 0.00 H new ATOM 1617 N VAL A 107 -5.272 4.381 5.552 1.00 0.00 N ATOM 1618 CA VAL A 107 -4.580 5.394 6.331 1.00 0.00 C ATOM 1619 C VAL A 107 -4.867 6.733 5.652 1.00 0.00 C ATOM 1620 O VAL A 107 -4.428 6.960 4.526 1.00 0.00 O ATOM 1621 CB VAL A 107 -3.072 5.069 6.386 1.00 0.00 C ATOM 1622 CG1 VAL A 107 -2.268 6.172 7.079 1.00 0.00 C ATOM 1623 CG2 VAL A 107 -2.813 3.757 7.145 1.00 0.00 C ATOM 0 H VAL A 107 -4.656 3.881 4.911 1.00 0.00 H new ATOM 0 HA VAL A 107 -4.923 5.429 7.365 1.00 0.00 H new ATOM 0 HB VAL A 107 -2.749 4.980 5.349 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -1.213 5.899 7.094 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -2.393 7.109 6.536 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -2.625 6.295 8.101 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -1.742 3.555 7.167 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -3.186 3.847 8.165 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -3.327 2.938 6.642 1.00 0.00 H new ATOM 1633 N VAL A 108 -5.618 7.612 6.314 1.00 0.00 N ATOM 1634 CA VAL A 108 -5.560 9.031 5.970 1.00 0.00 C ATOM 1635 C VAL A 108 -4.328 9.590 6.685 1.00 0.00 C ATOM 1636 O VAL A 108 -3.917 9.043 7.715 1.00 0.00 O ATOM 1637 CB VAL A 108 -6.821 9.799 6.422 1.00 0.00 C ATOM 1638 CG1 VAL A 108 -6.954 11.100 5.614 1.00 0.00 C ATOM 1639 CG2 VAL A 108 -8.113 8.991 6.251 1.00 0.00 C ATOM 0 H VAL A 108 -6.258 7.375 7.072 1.00 0.00 H new ATOM 0 HA VAL A 108 -5.504 9.149 4.888 1.00 0.00 H new ATOM 0 HB VAL A 108 -6.692 10.002 7.485 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -7.845 11.639 5.936 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -6.074 11.722 5.779 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -7.037 10.863 4.553 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -8.962 9.587 6.587 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -8.244 8.732 5.200 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -8.053 8.079 6.844 1.00 0.00 H new ATOM 1649 N LYS A 109 -3.768 10.708 6.225 1.00 0.00 N ATOM 1650 CA LYS A 109 -2.917 11.524 7.081 1.00 0.00 C ATOM 1651 C LYS A 109 -3.760 12.081 8.243 1.00 0.00 C ATOM 1652 O LYS A 109 -4.980 12.193 8.096 1.00 0.00 O ATOM 1653 CB LYS A 109 -2.174 12.597 6.253 1.00 0.00 C ATOM 1654 CG LYS A 109 -2.847 13.981 6.175 1.00 0.00 C ATOM 1655 CD LYS A 109 -1.960 14.961 5.385 1.00 0.00 C ATOM 1656 CE LYS A 109 -2.127 16.433 5.782 1.00 0.00 C ATOM 1657 NZ LYS A 109 -1.716 16.676 7.182 1.00 0.00 N ATOM 0 H LYS A 109 -3.887 11.064 5.277 1.00 0.00 H new ATOM 0 HA LYS A 109 -2.126 10.922 7.529 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -1.176 12.724 6.673 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -2.047 12.220 5.238 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -3.821 13.893 5.694 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -3.021 14.366 7.180 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -0.916 14.677 5.522 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -2.182 14.857 4.323 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -1.533 17.059 5.115 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -3.168 16.728 5.653 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -1.534 17.691 7.319 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -2.475 16.370 7.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -0.850 16.138 7.388 1.00 0.00 H new ATOM 1671 N PRO A 110 -3.155 12.505 9.363 1.00 0.00 N ATOM 1672 CA PRO A 110 -1.759 12.295 9.728 1.00 0.00 C ATOM 1673 C PRO A 110 -1.540 10.841 10.156 1.00 0.00 C ATOM 1674 O PRO A 110 -2.498 10.143 10.503 1.00 0.00 O ATOM 1675 CB PRO A 110 -1.539 13.251 10.900 1.00 0.00 C ATOM 1676 CG PRO A 110 -2.879 13.210 11.622 1.00 0.00 C ATOM 1677 CD PRO A 110 -3.881 13.102 10.476 1.00 0.00 C ATOM 0 HA PRO A 110 -1.067 12.481 8.907 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -0.723 12.922 11.543 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -1.292 14.257 10.561 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -2.947 12.359 12.299 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -3.044 14.107 12.219 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -4.734 12.486 10.760 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -4.272 14.083 10.206 1.00 0.00 H new ATOM 1685 N PHE A 111 -0.287 10.400 10.266 1.00 0.00 N ATOM 1686 CA PHE A 111 0.047 9.001 10.512 1.00 0.00 C ATOM 1687 C PHE A 111 1.556 8.805 10.636 1.00 0.00 C ATOM 1688 O PHE A 111 2.347 9.629 10.180 1.00 0.00 O ATOM 1689 CB PHE A 111 -0.436 8.105 9.352 1.00 0.00 C ATOM 1690 CG PHE A 111 0.398 8.114 8.080 1.00 0.00 C ATOM 1691 CD1 PHE A 111 0.288 9.173 7.162 1.00 0.00 C ATOM 1692 CD2 PHE A 111 1.228 7.018 7.775 1.00 0.00 C ATOM 1693 CE1 PHE A 111 0.960 9.120 5.932 1.00 0.00 C ATOM 1694 CE2 PHE A 111 1.915 6.975 6.551 1.00 0.00 C ATOM 1695 CZ PHE A 111 1.777 8.020 5.624 1.00 0.00 C ATOM 0 H PHE A 111 0.528 11.008 10.186 1.00 0.00 H new ATOM 0 HA PHE A 111 -0.448 8.724 11.443 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -0.488 7.079 9.716 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -1.452 8.404 9.093 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -0.318 10.033 7.405 1.00 0.00 H new ATOM 0 HD2 PHE A 111 1.336 6.210 8.483 1.00 0.00 H new ATOM 0 HE1 PHE A 111 0.849 9.926 5.221 1.00 0.00 H new ATOM 0 HE2 PHE A 111 2.553 6.134 6.322 1.00 0.00 H new ATOM 0 HZ PHE A 111 2.297 7.978 4.678 1.00 0.00 H new ATOM 1705 N THR A 112 1.932 7.705 11.279 1.00 0.00 N ATOM 1706 CA THR A 112 3.290 7.338 11.659 1.00 0.00 C ATOM 1707 C THR A 112 3.378 5.813 11.788 1.00 0.00 C ATOM 1708 O THR A 112 2.399 5.095 11.522 1.00 0.00 O ATOM 1709 CB THR A 112 3.680 8.048 12.974 1.00 0.00 C ATOM 1710 OG1 THR A 112 2.580 8.078 13.861 1.00 0.00 O ATOM 1711 CG2 THR A 112 4.215 9.463 12.790 1.00 0.00 C ATOM 0 H THR A 112 1.252 7.001 11.567 1.00 0.00 H new ATOM 0 HA THR A 112 3.996 7.659 10.893 1.00 0.00 H new ATOM 0 HB THR A 112 4.498 7.458 13.389 1.00 0.00 H new ATOM 0 HG1 THR A 112 2.841 8.529 14.691 1.00 0.00 H new ATOM 0 HG21 THR A 112 4.464 9.887 13.763 1.00 0.00 H new ATOM 0 HG22 THR A 112 5.109 9.436 12.166 1.00 0.00 H new ATOM 0 HG23 THR A 112 3.456 10.079 12.309 1.00 0.00 H new ATOM 1719 N ALA A 113 4.551 5.303 12.187 1.00 0.00 N ATOM 1720 CA ALA A 113 4.786 3.882 12.381 1.00 0.00 C ATOM 1721 C ALA A 113 3.807 3.306 13.402 1.00 0.00 C ATOM 1722 O ALA A 113 3.485 2.133 13.282 1.00 0.00 O ATOM 1723 CB ALA A 113 6.249 3.594 12.756 1.00 0.00 C ATOM 0 H ALA A 113 5.368 5.881 12.384 1.00 0.00 H new ATOM 0 HA ALA A 113 4.605 3.378 11.432 1.00 0.00 H new ATOM 0 HB1 ALA A 113 6.385 2.521 12.893 1.00 0.00 H new ATOM 0 HB2 ALA A 113 6.905 3.944 11.959 1.00 0.00 H new ATOM 0 HB3 ALA A 113 6.496 4.112 13.683 1.00 0.00 H new ATOM 1729 N ALA A 114 3.248 4.128 14.297 1.00 0.00 N ATOM 1730 CA ALA A 114 2.156 3.744 15.181 1.00 0.00 C ATOM 1731 C ALA A 114 0.970 3.154 14.409 1.00 0.00 C ATOM 1732 O ALA A 114 0.521 2.056 14.743 1.00 0.00 O ATOM 1733 CB ALA A 114 1.723 4.955 16.010 1.00 0.00 C ATOM 0 H ALA A 114 3.551 5.094 14.425 1.00 0.00 H new ATOM 0 HA ALA A 114 2.515 2.959 15.847 1.00 0.00 H new ATOM 0 HB1 ALA A 114 0.906 4.669 16.672 1.00 0.00 H new ATOM 0 HB2 ALA A 114 2.565 5.309 16.605 1.00 0.00 H new ATOM 0 HB3 ALA A 114 1.389 5.751 15.344 1.00 0.00 H new ATOM 1739 N THR A 115 0.437 3.853 13.395 1.00 0.00 N ATOM 1740 CA THR A 115 -0.654 3.283 12.606 1.00 0.00 C ATOM 1741 C THR A 115 -0.107 2.213 11.654 1.00 0.00 C ATOM 1742 O THR A 115 -0.831 1.267 11.355 1.00 0.00 O ATOM 1743 CB THR A 115 -1.514 4.355 11.896 1.00 0.00 C ATOM 1744 OG1 THR A 115 -2.864 3.941 11.771 1.00 0.00 O ATOM 1745 CG2 THR A 115 -1.065 4.671 10.470 1.00 0.00 C ATOM 0 H THR A 115 0.736 4.786 13.111 1.00 0.00 H new ATOM 0 HA THR A 115 -1.347 2.795 13.291 1.00 0.00 H new ATOM 0 HB THR A 115 -1.398 5.233 12.531 1.00 0.00 H new ATOM 0 HG1 THR A 115 -3.380 4.641 11.320 1.00 0.00 H new ATOM 0 HG21 THR A 115 -1.719 5.431 10.043 1.00 0.00 H new ATOM 0 HG22 THR A 115 -0.040 5.041 10.485 1.00 0.00 H new ATOM 0 HG23 THR A 115 -1.116 3.767 9.864 1.00 0.00 H new ATOM 1753 N LEU A 116 1.145 2.330 11.179 1.00 0.00 N ATOM 1754 CA LEU A 116 1.728 1.312 10.300 1.00 0.00 C ATOM 1755 C LEU A 116 1.698 -0.045 11.020 1.00 0.00 C ATOM 1756 O LEU A 116 1.140 -1.002 10.490 1.00 0.00 O ATOM 1757 CB LEU A 116 3.150 1.718 9.857 1.00 0.00 C ATOM 1758 CG LEU A 116 3.728 1.090 8.571 1.00 0.00 C ATOM 1759 CD1 LEU A 116 3.585 -0.424 8.527 1.00 0.00 C ATOM 1760 CD2 LEU A 116 3.142 1.680 7.281 1.00 0.00 C ATOM 0 H LEU A 116 1.764 3.113 11.389 1.00 0.00 H new ATOM 0 HA LEU A 116 1.139 1.225 9.387 1.00 0.00 H new ATOM 0 HB2 LEU A 116 3.162 2.801 9.731 1.00 0.00 H new ATOM 0 HB3 LEU A 116 3.831 1.485 10.675 1.00 0.00 H new ATOM 0 HG LEU A 116 4.787 1.344 8.616 1.00 0.00 H new ATOM 0 HD11 LEU A 116 4.011 -0.803 7.598 1.00 0.00 H new ATOM 0 HD12 LEU A 116 4.112 -0.864 9.374 1.00 0.00 H new ATOM 0 HD13 LEU A 116 2.530 -0.691 8.578 1.00 0.00 H new ATOM 0 HD21 LEU A 116 3.595 1.191 6.419 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.064 1.520 7.265 1.00 0.00 H new ATOM 0 HD23 LEU A 116 3.351 2.749 7.242 1.00 0.00 H new ATOM 1772 N GLU A 117 2.246 -0.135 12.234 1.00 0.00 N ATOM 1773 CA GLU A 117 2.320 -1.382 12.986 1.00 0.00 C ATOM 1774 C GLU A 117 0.934 -1.867 13.401 1.00 0.00 C ATOM 1775 O GLU A 117 0.648 -3.054 13.293 1.00 0.00 O ATOM 1776 CB GLU A 117 3.279 -1.274 14.178 1.00 0.00 C ATOM 1777 CG GLU A 117 2.835 -0.411 15.370 1.00 0.00 C ATOM 1778 CD GLU A 117 3.911 -0.366 16.462 1.00 0.00 C ATOM 1779 OE1 GLU A 117 4.403 -1.448 16.852 1.00 0.00 O ATOM 1780 OE2 GLU A 117 4.242 0.739 16.968 1.00 0.00 O ATOM 0 H GLU A 117 2.652 0.663 12.723 1.00 0.00 H new ATOM 0 HA GLU A 117 2.736 -2.139 12.321 1.00 0.00 H new ATOM 0 HB2 GLU A 117 3.473 -2.282 14.546 1.00 0.00 H new ATOM 0 HB3 GLU A 117 4.227 -0.880 13.812 1.00 0.00 H new ATOM 0 HG2 GLU A 117 2.620 0.601 15.028 1.00 0.00 H new ATOM 0 HG3 GLU A 117 1.910 -0.811 15.785 1.00 0.00 H new ATOM 1787 N GLU A 118 0.047 -0.964 13.808 1.00 0.00 N ATOM 1788 CA GLU A 118 -1.354 -1.258 14.081 1.00 0.00 C ATOM 1789 C GLU A 118 -1.999 -1.915 12.851 1.00 0.00 C ATOM 1790 O GLU A 118 -2.656 -2.952 12.946 1.00 0.00 O ATOM 1791 CB GLU A 118 -1.998 0.062 14.501 1.00 0.00 C ATOM 1792 CG GLU A 118 -3.498 -0.005 14.712 1.00 0.00 C ATOM 1793 CD GLU A 118 -3.932 -0.913 15.858 1.00 0.00 C ATOM 1794 OE1 GLU A 118 -4.231 -2.094 15.593 1.00 0.00 O ATOM 1795 OE2 GLU A 118 -4.141 -0.419 16.985 1.00 0.00 O ATOM 0 H GLU A 118 0.289 0.015 13.960 1.00 0.00 H new ATOM 0 HA GLU A 118 -1.490 -1.979 14.887 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -1.529 0.402 15.425 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -1.785 0.813 13.740 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -3.872 1.001 14.900 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -3.967 -0.352 13.791 1.00 0.00 H new ATOM 1802 N LYS A 119 -1.797 -1.347 11.661 1.00 0.00 N ATOM 1803 CA LYS A 119 -2.327 -1.905 10.428 1.00 0.00 C ATOM 1804 C LYS A 119 -1.664 -3.222 10.058 1.00 0.00 C ATOM 1805 O LYS A 119 -2.390 -4.065 9.520 1.00 0.00 O ATOM 1806 CB LYS A 119 -2.180 -0.896 9.283 1.00 0.00 C ATOM 1807 CG LYS A 119 -3.311 0.137 9.231 1.00 0.00 C ATOM 1808 CD LYS A 119 -4.708 -0.456 8.971 1.00 0.00 C ATOM 1809 CE LYS A 119 -4.795 -1.351 7.729 1.00 0.00 C ATOM 1810 NZ LYS A 119 -4.467 -2.777 7.949 1.00 0.00 N ATOM 0 H LYS A 119 -1.261 -0.489 11.531 1.00 0.00 H new ATOM 0 HA LYS A 119 -3.384 -2.112 10.595 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -1.228 -0.376 9.387 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -2.147 -1.435 8.336 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -3.332 0.682 10.175 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -3.087 0.863 8.449 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -5.012 -1.035 9.843 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -5.422 0.361 8.866 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -5.806 -1.286 7.326 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -4.122 -0.954 6.969 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -5.065 -3.369 7.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -3.466 -2.943 7.719 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -4.639 -3.023 8.945 1.00 0.00 H new ATOM 1824 N LEU A 120 -0.357 -3.387 10.282 1.00 0.00 N ATOM 1825 CA LEU A 120 0.354 -4.640 10.045 1.00 0.00 C ATOM 1826 C LEU A 120 -0.266 -5.709 10.921 1.00 0.00 C ATOM 1827 O LEU A 120 -0.756 -6.702 10.404 1.00 0.00 O ATOM 1828 CB LEU A 120 1.855 -4.564 10.374 1.00 0.00 C ATOM 1829 CG LEU A 120 2.749 -3.841 9.360 1.00 0.00 C ATOM 1830 CD1 LEU A 120 4.159 -3.764 9.956 1.00 0.00 C ATOM 1831 CD2 LEU A 120 2.803 -4.551 8.003 1.00 0.00 C ATOM 0 H LEU A 120 0.242 -2.642 10.638 1.00 0.00 H new ATOM 0 HA LEU A 120 0.266 -4.865 8.982 1.00 0.00 H new ATOM 0 HB2 LEU A 120 1.967 -4.069 11.339 1.00 0.00 H new ATOM 0 HB3 LEU A 120 2.229 -5.581 10.492 1.00 0.00 H new ATOM 0 HG LEU A 120 2.333 -2.851 9.176 1.00 0.00 H new ATOM 0 HD11 LEU A 120 4.822 -3.254 9.257 1.00 0.00 H new ATOM 0 HD12 LEU A 120 4.127 -3.212 10.895 1.00 0.00 H new ATOM 0 HD13 LEU A 120 4.532 -4.772 10.140 1.00 0.00 H new ATOM 0 HD21 LEU A 120 3.451 -3.994 7.326 1.00 0.00 H new ATOM 0 HD22 LEU A 120 3.197 -5.559 8.135 1.00 0.00 H new ATOM 0 HD23 LEU A 120 1.799 -4.607 7.581 1.00 0.00 H new ATOM 1843 N ASN A 121 -0.276 -5.505 12.236 1.00 0.00 N ATOM 1844 CA ASN A 121 -0.773 -6.454 13.197 1.00 0.00 C ATOM 1845 C ASN A 121 -2.238 -6.781 12.898 1.00 0.00 C ATOM 1846 O ASN A 121 -2.623 -7.943 12.955 1.00 0.00 O ATOM 1847 CB ASN A 121 -0.522 -5.866 14.589 1.00 0.00 C ATOM 1848 CG ASN A 121 0.969 -5.819 14.942 1.00 0.00 C ATOM 1849 OD1 ASN A 121 1.724 -6.739 14.631 1.00 0.00 O ATOM 1850 ND2 ASN A 121 1.452 -4.747 15.552 1.00 0.00 N ATOM 0 H ASN A 121 0.074 -4.647 12.662 1.00 0.00 H new ATOM 0 HA ASN A 121 -0.256 -7.412 13.144 1.00 0.00 H new ATOM 0 HB2 ASN A 121 -0.936 -4.859 14.635 1.00 0.00 H new ATOM 0 HB3 ASN A 121 -1.050 -6.462 15.333 1.00 0.00 H new ATOM 0 HD21 ASN A 121 2.448 -4.686 15.763 1.00 0.00 H new ATOM 0 HD22 ASN A 121 0.828 -3.983 15.811 1.00 0.00 H new ATOM 1857 N LYS A 122 -3.042 -5.813 12.440 1.00 0.00 N ATOM 1858 CA LYS A 122 -4.365 -6.116 11.897 1.00 0.00 C ATOM 1859 C LYS A 122 -4.318 -7.105 10.735 1.00 0.00 C ATOM 1860 O LYS A 122 -5.035 -8.093 10.803 1.00 0.00 O ATOM 1861 CB LYS A 122 -5.127 -4.847 11.511 1.00 0.00 C ATOM 1862 CG LYS A 122 -5.983 -4.373 12.689 1.00 0.00 C ATOM 1863 CD LYS A 122 -6.768 -3.118 12.309 1.00 0.00 C ATOM 1864 CE LYS A 122 -5.952 -1.842 12.557 1.00 0.00 C ATOM 1865 NZ LYS A 122 -6.469 -1.128 13.742 1.00 0.00 N ATOM 0 H LYS A 122 -2.799 -4.822 12.436 1.00 0.00 H new ATOM 0 HA LYS A 122 -4.914 -6.604 12.702 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -4.425 -4.065 11.223 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -5.760 -5.042 10.646 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -6.672 -5.164 12.987 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -5.346 -4.164 13.548 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -7.051 -3.170 11.258 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -7.692 -3.078 12.887 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -4.902 -2.096 12.706 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -6.002 -1.194 11.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -6.105 -0.154 13.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -7.508 -1.109 13.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -6.158 -1.618 14.605 1.00 0.00 H new ATOM 1879 N ILE A 123 -3.576 -6.868 9.648 1.00 0.00 N ATOM 1880 CA ILE A 123 -3.578 -7.823 8.521 1.00 0.00 C ATOM 1881 C ILE A 123 -2.894 -9.158 8.865 1.00 0.00 C ATOM 1882 O ILE A 123 -3.242 -10.194 8.290 1.00 0.00 O ATOM 1883 CB ILE A 123 -3.022 -7.202 7.224 1.00 0.00 C ATOM 1884 CG1 ILE A 123 -1.602 -6.637 7.389 1.00 0.00 C ATOM 1885 CG2 ILE A 123 -4.002 -6.132 6.723 1.00 0.00 C ATOM 1886 CD1 ILE A 123 -1.071 -5.859 6.188 1.00 0.00 C ATOM 0 H ILE A 123 -2.981 -6.050 9.520 1.00 0.00 H new ATOM 0 HA ILE A 123 -4.625 -8.059 8.332 1.00 0.00 H new ATOM 0 HB ILE A 123 -2.932 -7.993 6.480 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -1.587 -5.983 8.261 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -0.921 -7.462 7.597 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -3.617 -5.687 5.806 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -4.971 -6.590 6.525 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -4.115 -5.358 7.482 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -0.064 -5.502 6.402 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -1.047 -6.510 5.314 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -1.723 -5.008 5.988 1.00 0.00 H new ATOM 1898 N PHE A 124 -1.969 -9.161 9.823 1.00 0.00 N ATOM 1899 CA PHE A 124 -1.404 -10.380 10.379 1.00 0.00 C ATOM 1900 C PHE A 124 -2.557 -11.204 10.937 1.00 0.00 C ATOM 1901 O PHE A 124 -2.782 -12.331 10.512 1.00 0.00 O ATOM 1902 CB PHE A 124 -0.375 -10.060 11.465 1.00 0.00 C ATOM 1903 CG PHE A 124 1.003 -9.548 11.050 1.00 0.00 C ATOM 1904 CD1 PHE A 124 1.239 -8.867 9.836 1.00 0.00 C ATOM 1905 CD2 PHE A 124 2.084 -9.749 11.931 1.00 0.00 C ATOM 1906 CE1 PHE A 124 2.525 -8.410 9.501 1.00 0.00 C ATOM 1907 CE2 PHE A 124 3.372 -9.305 11.589 1.00 0.00 C ATOM 1908 CZ PHE A 124 3.598 -8.638 10.374 1.00 0.00 C ATOM 0 H PHE A 124 -1.590 -8.309 10.236 1.00 0.00 H new ATOM 0 HA PHE A 124 -0.878 -10.943 9.608 1.00 0.00 H new ATOM 0 HB2 PHE A 124 -0.817 -9.316 12.128 1.00 0.00 H new ATOM 0 HB3 PHE A 124 -0.226 -10.965 12.055 1.00 0.00 H new ATOM 0 HD1 PHE A 124 0.419 -8.695 9.155 1.00 0.00 H new ATOM 0 HD2 PHE A 124 1.921 -10.248 12.875 1.00 0.00 H new ATOM 0 HE1 PHE A 124 2.687 -7.884 8.572 1.00 0.00 H new ATOM 0 HE2 PHE A 124 4.195 -9.478 12.266 1.00 0.00 H new ATOM 0 HZ PHE A 124 4.591 -8.303 10.114 1.00 0.00 H new ATOM 1918 N GLU A 125 -3.340 -10.613 11.834 1.00 0.00 N ATOM 1919 CA GLU A 125 -4.454 -11.292 12.464 1.00 0.00 C ATOM 1920 C GLU A 125 -5.540 -11.655 11.451 1.00 0.00 C ATOM 1921 O GLU A 125 -6.057 -12.772 11.464 1.00 0.00 O ATOM 1922 CB GLU A 125 -5.051 -10.371 13.541 1.00 0.00 C ATOM 1923 CG GLU A 125 -4.128 -10.109 14.741 1.00 0.00 C ATOM 1924 CD GLU A 125 -4.052 -11.253 15.743 1.00 0.00 C ATOM 1925 OE1 GLU A 125 -4.957 -12.125 15.761 1.00 0.00 O ATOM 1926 OE2 GLU A 125 -3.138 -11.225 16.594 1.00 0.00 O ATOM 0 H GLU A 125 -3.215 -9.648 12.141 1.00 0.00 H new ATOM 0 HA GLU A 125 -4.086 -12.218 12.907 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -5.309 -9.416 13.082 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -5.980 -10.812 13.903 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -3.124 -9.899 14.372 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -4.471 -9.213 15.258 1.00 0.00 H new ATOM 1933 N LYS A 126 -5.920 -10.706 10.599 1.00 0.00 N ATOM 1934 CA LYS A 126 -7.094 -10.800 9.736 1.00 0.00 C ATOM 1935 C LYS A 126 -6.781 -11.685 8.537 1.00 0.00 C ATOM 1936 O LYS A 126 -7.340 -12.778 8.439 1.00 0.00 O ATOM 1937 CB LYS A 126 -7.607 -9.386 9.386 1.00 0.00 C ATOM 1938 CG LYS A 126 -8.589 -9.266 8.210 1.00 0.00 C ATOM 1939 CD LYS A 126 -9.714 -10.309 8.118 1.00 0.00 C ATOM 1940 CE LYS A 126 -10.208 -10.383 6.666 1.00 0.00 C ATOM 1941 NZ LYS A 126 -10.903 -11.652 6.370 1.00 0.00 N ATOM 0 H LYS A 126 -5.408 -9.831 10.487 1.00 0.00 H new ATOM 0 HA LYS A 126 -7.921 -11.287 10.252 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -8.089 -8.973 10.272 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -6.743 -8.757 9.170 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -9.048 -8.278 8.254 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -8.014 -9.309 7.285 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -9.351 -11.284 8.443 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -10.535 -10.037 8.782 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -10.883 -9.549 6.472 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -9.360 -10.271 5.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -11.217 -11.653 5.378 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -10.253 -12.449 6.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -11.729 -11.749 6.995 1.00 0.00 H new ATOM 1955 N LEU A 127 -5.961 -11.205 7.598 1.00 0.00 N ATOM 1956 CA LEU A 127 -5.618 -11.944 6.388 1.00 0.00 C ATOM 1957 C LEU A 127 -4.833 -13.209 6.718 1.00 0.00 C ATOM 1958 O LEU A 127 -4.796 -14.117 5.887 1.00 0.00 O ATOM 1959 CB LEU A 127 -4.791 -11.085 5.411 1.00 0.00 C ATOM 1960 CG LEU A 127 -5.250 -9.627 5.218 1.00 0.00 C ATOM 1961 CD1 LEU A 127 -4.423 -8.926 4.133 1.00 0.00 C ATOM 1962 CD2 LEU A 127 -6.739 -9.506 4.880 1.00 0.00 C ATOM 0 H LEU A 127 -5.517 -10.289 7.659 1.00 0.00 H new ATOM 0 HA LEU A 127 -6.561 -12.215 5.912 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -3.758 -11.074 5.757 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -4.796 -11.576 4.438 1.00 0.00 H new ATOM 0 HG LEU A 127 -5.089 -9.136 6.178 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -4.769 -7.899 4.019 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -3.372 -8.925 4.421 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -4.540 -9.456 3.188 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -7.000 -8.455 4.756 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -6.947 -10.043 3.954 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -7.332 -9.934 5.688 1.00 0.00 H new ATOM 1974 N GLY A 128 -4.210 -13.278 7.896 1.00 0.00 N ATOM 1975 CA GLY A 128 -3.218 -14.294 8.169 1.00 0.00 C ATOM 1976 C GLY A 128 -1.931 -13.866 7.489 1.00 0.00 C ATOM 1977 O GLY A 128 -1.304 -14.694 6.825 1.00 0.00 O ATOM 0 H GLY A 128 -4.382 -12.637 8.671 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -3.067 -14.404 9.243 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -3.547 -15.263 7.793 1.00 0.00 H new ATOM 1981 N MET A 129 -1.574 -12.574 7.571 1.00 0.00 N ATOM 1982 CA MET A 129 -0.234 -12.175 7.135 1.00 0.00 C ATOM 1983 C MET A 129 0.788 -12.617 8.181 1.00 0.00 C ATOM 1984 O MET A 129 2.002 -12.426 7.956 1.00 0.00 O ATOM 1985 CB MET A 129 -0.137 -10.670 6.845 1.00 0.00 C ATOM 1986 CG MET A 129 -1.022 -10.137 5.718 1.00 0.00 C ATOM 1987 SD MET A 129 -1.111 -11.094 4.180 1.00 0.00 S ATOM 1988 CE MET A 129 0.622 -11.008 3.671 1.00 0.00 C ATOM 1989 OXT MET A 129 0.406 -13.178 9.232 1.00 0.00 O ATOM 0 H MET A 129 -2.167 -11.821 7.919 1.00 0.00 H new ATOM 0 HA MET A 129 -0.016 -12.673 6.190 1.00 0.00 H new ATOM 0 HB2 MET A 129 -0.384 -10.129 7.759 1.00 0.00 H new ATOM 0 HB3 MET A 129 0.900 -10.434 6.606 1.00 0.00 H new ATOM 0 HG2 MET A 129 -2.035 -10.037 6.108 1.00 0.00 H new ATOM 0 HG3 MET A 129 -0.676 -9.134 5.468 1.00 0.00 H new ATOM 0 HE1 MET A 129 0.753 -11.549 2.734 1.00 0.00 H new ATOM 0 HE2 MET A 129 0.909 -9.966 3.532 1.00 0.00 H new ATOM 0 HE3 MET A 129 1.250 -11.458 4.440 1.00 0.00 H new TER 1999 MET A 129