USER MOD reduce.3.24.130724 H: found=0, std=0, add=1030, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 861 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 74 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 101 GLN : amide:sc= -0.0611 K(o=-0.061,f=-1.3!) USER MOD Set 2.1: A 10 TYR OH : rot 73:sc= 1.21 USER MOD Set 2.2: A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ -156:sc= 1.26 (180deg=1.13) USER MOD Single : A 6 THR OG1 : rot -160:sc= 0 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot -170:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 MET CE :methyl -167:sc= -0.184 (180deg=-0.596) USER MOD Single : A 23 LYS NZ :NH3+ 148:sc= 1.21 (180deg=0.346) USER MOD Single : A 25 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 160:sc= -0.0237 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 57 GLN : amide:sc= 0.759 K(o=0.76,f=-1.6) USER MOD Single : A 59 GLN : amide:sc= -0.401 X(o=-0.4,f=0) USER MOD Single : A 61 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= 0.804 K(o=0.8,f=0) USER MOD Single : A 71 ASN :FLIP amide:sc= -0.0165 F(o=-1.3,f=-0.017) USER MOD Single : A 75 ASN : amide:sc= -0.0166 X(o=-0.017,f=-0.25) USER MOD Single : A 76 ASN : amide:sc= 1.13 K(o=1.1,f=0) USER MOD Single : A 77 TYR OH : rot 153:sc= 0.618 USER MOD Single : A 84 SER OG : rot -64:sc= 0.622 USER MOD Single : A 88 SER OG : rot -130:sc= 0 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 60:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 MET CE :methyl 149:sc= -0.0296 (180deg=-1.04) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 105 TYR OH : rot 130:sc= 0.413 USER MOD Single : A 111 SER OG : rot -168:sc= 0.129 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot -148:sc= 0.347 USER MOD Single : A 119 ASN : amide:sc= -1.42 K(o=-1.4,f=-4.4!) USER MOD Single : A 120 HIS : no HD1:sc= -0.627 X(o=-0.63,f=-0.22) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 TYR OH : rot 180:sc= -0.113 USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 HIS : no HD1:sc= -0.881 K(o=-0.88,f=-1.4) USER MOD Single : A 128 ASN : amide:sc= -0.116 K(o=-0.12,f=-1.5!) USER MOD Single : A 135 ASN : amide:sc= -0.174 X(o=-0.17,f=0) USER MOD Single : A 144 SER OG : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ 176:sc= 1.27 (180deg=1.17) USER MOD Single : A 150 SER OG : rot 180:sc= 0 USER MOD Single : A 151 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0647) USER MOD ----------------------------------------------------------------- ATOM 23 N ALA A 3 -0.168 -20.132 -11.226 1.00 33.01 N ATOM 24 CA ALA A 3 0.929 -19.179 -11.305 1.00 51.53 C ATOM 25 C ALA A 3 0.652 -18.193 -10.174 1.00 10.24 C ATOM 26 O ALA A 3 -0.445 -17.635 -10.119 1.00 54.45 O ATOM 27 CB ALA A 3 0.969 -18.445 -12.656 1.00 23.32 C ATOM 0 HA ALA A 3 1.895 -19.677 -11.217 1.00 51.53 H new ATOM 0 HB1 ALA A 3 1.805 -17.745 -12.665 1.00 23.32 H new ATOM 0 HB2 ALA A 3 1.094 -19.170 -13.460 1.00 23.32 H new ATOM 0 HB3 ALA A 3 0.037 -17.899 -12.801 1.00 23.32 H new ATOM 33 N LYS A 4 1.586 -18.014 -9.245 1.00 52.45 N ATOM 34 CA LYS A 4 1.488 -17.012 -8.192 1.00 14.13 C ATOM 35 C LYS A 4 2.278 -15.799 -8.651 1.00 23.43 C ATOM 36 O LYS A 4 3.513 -15.851 -8.636 1.00 32.00 O ATOM 37 CB LYS A 4 2.024 -17.528 -6.856 1.00 31.43 C ATOM 38 CG LYS A 4 1.360 -18.827 -6.376 1.00 44.25 C ATOM 39 CD LYS A 4 1.413 -18.829 -4.851 1.00 3.54 C ATOM 40 CE LYS A 4 1.006 -20.150 -4.186 1.00 54.44 C ATOM 41 NZ LYS A 4 -0.244 -20.003 -3.406 1.00 33.40 N ATOM 0 H LYS A 4 2.442 -18.568 -9.203 1.00 52.45 H new ATOM 0 HA LYS A 4 0.441 -16.759 -8.023 1.00 14.13 H new ATOM 0 HB2 LYS A 4 3.098 -17.693 -6.946 1.00 31.43 H new ATOM 0 HB3 LYS A 4 1.882 -16.758 -6.098 1.00 31.43 H new ATOM 0 HG2 LYS A 4 0.329 -18.883 -6.724 1.00 44.25 H new ATOM 0 HG3 LYS A 4 1.880 -19.696 -6.779 1.00 44.25 H new ATOM 0 HD2 LYS A 4 2.427 -18.580 -4.538 1.00 3.54 H new ATOM 0 HD3 LYS A 4 0.762 -18.038 -4.480 1.00 3.54 H new ATOM 0 HE2 LYS A 4 0.872 -20.916 -4.949 1.00 54.44 H new ATOM 0 HE3 LYS A 4 1.807 -20.490 -3.530 1.00 54.44 H new ATOM 0 HZ1 LYS A 4 -0.490 -20.914 -2.970 1.00 33.40 H new ATOM 0 HZ2 LYS A 4 -0.107 -19.289 -2.662 1.00 33.40 H new ATOM 0 HZ3 LYS A 4 -1.014 -19.702 -4.037 1.00 33.40 H new ATOM 51 N LYS A 5 1.610 -14.753 -9.131 1.00 30.04 N ATOM 52 CA LYS A 5 2.307 -13.515 -9.474 1.00 50.21 C ATOM 53 C LYS A 5 2.231 -12.528 -8.338 1.00 72.05 C ATOM 54 O LYS A 5 1.465 -12.706 -7.393 1.00 64.25 O ATOM 55 CB LYS A 5 1.751 -12.881 -10.746 1.00 31.00 C ATOM 56 CG LYS A 5 1.797 -13.897 -11.862 1.00 14.40 C ATOM 57 CD LYS A 5 1.714 -13.218 -13.215 1.00 13.20 C ATOM 58 CE LYS A 5 1.829 -14.302 -14.280 1.00 62.32 C ATOM 59 NZ LYS A 5 2.592 -13.807 -15.437 1.00 23.10 N ATOM 0 H LYS A 5 0.603 -14.736 -9.290 1.00 30.04 H new ATOM 0 HA LYS A 5 3.350 -13.776 -9.655 1.00 50.21 H new ATOM 0 HB2 LYS A 5 0.726 -12.547 -10.583 1.00 31.00 H new ATOM 0 HB3 LYS A 5 2.335 -12.000 -11.014 1.00 31.00 H new ATOM 0 HG2 LYS A 5 2.719 -14.474 -11.796 1.00 14.40 H new ATOM 0 HG3 LYS A 5 0.972 -14.601 -11.753 1.00 14.40 H new ATOM 0 HD2 LYS A 5 0.772 -12.679 -13.316 1.00 13.20 H new ATOM 0 HD3 LYS A 5 2.513 -12.485 -13.326 1.00 13.20 H new ATOM 0 HE2 LYS A 5 2.320 -15.181 -13.862 1.00 62.32 H new ATOM 0 HE3 LYS A 5 0.835 -14.614 -14.599 1.00 62.32 H new ATOM 0 HZ1 LYS A 5 2.333 -14.353 -16.283 1.00 23.10 H new ATOM 0 HZ2 LYS A 5 2.373 -12.802 -15.593 1.00 23.10 H new ATOM 0 HZ3 LYS A 5 3.610 -13.915 -15.253 1.00 23.10 H new ATOM 69 N THR A 6 2.966 -11.447 -8.528 1.00 23.30 N ATOM 70 CA THR A 6 3.088 -10.358 -7.579 1.00 43.34 C ATOM 71 C THR A 6 2.940 -9.038 -8.339 1.00 12.21 C ATOM 72 O THR A 6 3.358 -8.931 -9.494 1.00 13.40 O ATOM 73 CB THR A 6 4.425 -10.515 -6.833 1.00 72.44 C ATOM 74 OG1 THR A 6 4.450 -11.769 -6.171 1.00 51.45 O ATOM 75 CG2 THR A 6 4.667 -9.401 -5.807 1.00 30.20 C ATOM 0 H THR A 6 3.512 -11.299 -9.377 1.00 23.30 H new ATOM 0 HA THR A 6 2.305 -10.369 -6.820 1.00 43.34 H new ATOM 0 HB THR A 6 5.218 -10.451 -7.578 1.00 72.44 H new ATOM 0 HG1 THR A 6 5.123 -11.750 -5.459 1.00 51.45 H new ATOM 0 HG21 THR A 6 5.624 -9.564 -5.312 1.00 30.20 H new ATOM 0 HG22 THR A 6 4.680 -8.436 -6.314 1.00 30.20 H new ATOM 0 HG23 THR A 6 3.869 -9.410 -5.065 1.00 30.20 H new ATOM 83 N LEU A 7 2.362 -8.023 -7.693 1.00 4.32 N ATOM 84 CA LEU A 7 2.320 -6.639 -8.164 1.00 3.23 C ATOM 85 C LEU A 7 3.004 -5.816 -7.076 1.00 42.50 C ATOM 86 O LEU A 7 2.913 -6.174 -5.901 1.00 24.21 O ATOM 87 CB LEU A 7 0.856 -6.198 -8.391 1.00 61.02 C ATOM 88 CG LEU A 7 0.665 -4.863 -9.152 1.00 53.11 C ATOM 89 CD1 LEU A 7 0.982 -5.016 -10.639 1.00 22.24 C ATOM 90 CD2 LEU A 7 -0.782 -4.373 -9.047 1.00 3.54 C ATOM 0 H LEU A 7 1.894 -8.148 -6.795 1.00 4.32 H new ATOM 0 HA LEU A 7 2.826 -6.508 -9.120 1.00 3.23 H new ATOM 0 HB2 LEU A 7 0.340 -6.985 -8.941 1.00 61.02 H new ATOM 0 HB3 LEU A 7 0.367 -6.115 -7.421 1.00 61.02 H new ATOM 0 HG LEU A 7 1.348 -4.149 -8.693 1.00 53.11 H new ATOM 0 HD11 LEU A 7 0.837 -4.060 -11.142 1.00 22.24 H new ATOM 0 HD12 LEU A 7 2.017 -5.336 -10.759 1.00 22.24 H new ATOM 0 HD13 LEU A 7 0.318 -5.761 -11.078 1.00 22.24 H new ATOM 0 HD21 LEU A 7 -0.888 -3.434 -9.590 1.00 3.54 H new ATOM 0 HD22 LEU A 7 -1.451 -5.119 -9.477 1.00 3.54 H new ATOM 0 HD23 LEU A 7 -1.038 -4.217 -7.999 1.00 3.54 H new ATOM 101 N ILE A 8 3.696 -4.745 -7.449 1.00 74.31 N ATOM 102 CA ILE A 8 4.392 -3.830 -6.551 1.00 63.02 C ATOM 103 C ILE A 8 4.011 -2.411 -6.978 1.00 4.55 C ATOM 104 O ILE A 8 4.714 -1.745 -7.754 1.00 50.21 O ATOM 105 CB ILE A 8 5.919 -4.030 -6.598 1.00 62.40 C ATOM 106 CG1 ILE A 8 6.460 -5.461 -6.376 1.00 30.01 C ATOM 107 CG2 ILE A 8 6.599 -3.037 -5.639 1.00 74.12 C ATOM 108 CD1 ILE A 8 7.637 -5.701 -7.327 1.00 34.24 C ATOM 0 H ILE A 8 3.791 -4.479 -8.429 1.00 74.31 H new ATOM 0 HA ILE A 8 4.097 -4.020 -5.519 1.00 63.02 H new ATOM 0 HB ILE A 8 6.179 -3.834 -7.638 1.00 62.40 H new ATOM 0 HG12 ILE A 8 6.780 -5.587 -5.342 1.00 30.01 H new ATOM 0 HG13 ILE A 8 5.674 -6.193 -6.558 1.00 30.01 H new ATOM 0 HG21 ILE A 8 7.679 -3.180 -5.673 1.00 74.12 H new ATOM 0 HG22 ILE A 8 6.358 -2.017 -5.940 1.00 74.12 H new ATOM 0 HG23 ILE A 8 6.242 -3.210 -4.624 1.00 74.12 H new ATOM 0 HD11 ILE A 8 8.026 -6.708 -7.178 1.00 34.24 H new ATOM 0 HD12 ILE A 8 7.300 -5.591 -8.358 1.00 34.24 H new ATOM 0 HD13 ILE A 8 8.424 -4.975 -7.123 1.00 34.24 H new ATOM 119 N LEU A 9 2.876 -1.939 -6.477 1.00 1.14 N ATOM 120 CA LEU A 9 2.427 -0.578 -6.743 1.00 5.32 C ATOM 121 C LEU A 9 3.192 0.343 -5.810 1.00 63.21 C ATOM 122 O LEU A 9 3.204 0.121 -4.594 1.00 71.43 O ATOM 123 CB LEU A 9 0.916 -0.463 -6.507 1.00 11.33 C ATOM 124 CG LEU A 9 0.117 -1.075 -7.665 1.00 62.22 C ATOM 125 CD1 LEU A 9 -1.310 -1.358 -7.205 1.00 51.54 C ATOM 126 CD2 LEU A 9 0.078 -0.159 -8.895 1.00 51.11 C ATOM 0 H LEU A 9 2.248 -2.480 -5.883 1.00 1.14 H new ATOM 0 HA LEU A 9 2.616 -0.303 -7.781 1.00 5.32 H new ATOM 0 HB2 LEU A 9 0.653 -0.966 -5.576 1.00 11.33 H new ATOM 0 HB3 LEU A 9 0.644 0.586 -6.390 1.00 11.33 H new ATOM 0 HG LEU A 9 0.618 -1.998 -7.955 1.00 62.22 H new ATOM 0 HD11 LEU A 9 -1.878 -1.793 -8.027 1.00 51.54 H new ATOM 0 HD12 LEU A 9 -1.291 -2.056 -6.368 1.00 51.54 H new ATOM 0 HD13 LEU A 9 -1.782 -0.427 -6.890 1.00 51.54 H new ATOM 0 HD21 LEU A 9 -0.499 -0.637 -9.687 1.00 51.11 H new ATOM 0 HD22 LEU A 9 -0.389 0.789 -8.628 1.00 51.11 H new ATOM 0 HD23 LEU A 9 1.094 0.023 -9.246 1.00 51.11 H new ATOM 137 N TYR A 10 3.765 1.415 -6.347 1.00 50.32 N ATOM 138 CA TYR A 10 4.437 2.432 -5.559 1.00 33.01 C ATOM 139 C TYR A 10 3.991 3.812 -6.051 1.00 53.13 C ATOM 140 O TYR A 10 3.653 3.974 -7.227 1.00 2.12 O ATOM 141 CB TYR A 10 5.966 2.225 -5.630 1.00 62.21 C ATOM 142 CG TYR A 10 6.638 1.894 -4.324 1.00 11.35 C ATOM 143 CD1 TYR A 10 6.391 2.659 -3.175 1.00 4.51 C ATOM 144 CD2 TYR A 10 7.589 0.861 -4.288 1.00 12.14 C ATOM 145 CE1 TYR A 10 7.086 2.381 -1.990 1.00 72.22 C ATOM 146 CE2 TYR A 10 8.263 0.573 -3.097 1.00 23.25 C ATOM 147 CZ TYR A 10 7.952 1.278 -1.919 1.00 22.14 C ATOM 148 OH TYR A 10 8.554 0.976 -0.739 1.00 72.04 O ATOM 0 H TYR A 10 3.774 1.600 -7.350 1.00 50.32 H new ATOM 0 HA TYR A 10 4.164 2.355 -4.506 1.00 33.01 H new ATOM 0 HB2 TYR A 10 6.174 1.423 -6.339 1.00 62.21 H new ATOM 0 HB3 TYR A 10 6.419 3.131 -6.032 1.00 62.21 H new ATOM 0 HD1 TYR A 10 5.667 3.460 -3.203 1.00 4.51 H new ATOM 0 HD2 TYR A 10 7.800 0.289 -5.180 1.00 12.14 H new ATOM 0 HE1 TYR A 10 6.955 3.018 -1.128 1.00 72.22 H new ATOM 0 HE2 TYR A 10 9.024 -0.193 -3.081 1.00 23.25 H new ATOM 0 HH TYR A 10 7.893 0.600 -0.121 1.00 72.04 H new ATOM 157 N TYR A 11 4.007 4.799 -5.150 1.00 12.34 N ATOM 158 CA TYR A 11 3.698 6.204 -5.404 1.00 50.51 C ATOM 159 C TYR A 11 4.938 7.014 -5.017 1.00 53.21 C ATOM 160 O TYR A 11 5.064 7.477 -3.884 1.00 71.31 O ATOM 161 CB TYR A 11 2.420 6.605 -4.631 1.00 44.33 C ATOM 162 CG TYR A 11 2.000 8.065 -4.673 1.00 73.34 C ATOM 163 CD1 TYR A 11 1.319 8.595 -5.787 1.00 42.50 C ATOM 164 CD2 TYR A 11 2.228 8.892 -3.553 1.00 5.41 C ATOM 165 CE1 TYR A 11 1.001 9.960 -5.836 1.00 25.34 C ATOM 166 CE2 TYR A 11 1.839 10.243 -3.566 1.00 70.23 C ATOM 167 CZ TYR A 11 1.250 10.792 -4.724 1.00 44.33 C ATOM 168 OH TYR A 11 0.970 12.117 -4.796 1.00 64.31 O ATOM 0 H TYR A 11 4.249 4.627 -4.174 1.00 12.34 H new ATOM 0 HA TYR A 11 3.477 6.400 -6.453 1.00 50.51 H new ATOM 0 HB2 TYR A 11 1.594 6.007 -5.015 1.00 44.33 H new ATOM 0 HB3 TYR A 11 2.558 6.325 -3.587 1.00 44.33 H new ATOM 0 HD1 TYR A 11 1.041 7.948 -6.606 1.00 42.50 H new ATOM 0 HD2 TYR A 11 2.707 8.483 -2.676 1.00 5.41 H new ATOM 0 HE1 TYR A 11 0.563 10.377 -6.731 1.00 25.34 H new ATOM 0 HE2 TYR A 11 1.991 10.859 -2.692 1.00 70.23 H new ATOM 0 HH TYR A 11 1.199 12.546 -3.945 1.00 64.31 H new ATOM 227 N GLU A 16 12.120 8.532 -5.271 1.00 41.31 N ATOM 228 CA GLU A 16 12.234 8.088 -3.882 1.00 71.23 C ATOM 229 C GLU A 16 12.113 6.574 -3.778 1.00 25.21 C ATOM 230 O GLU A 16 13.065 5.912 -3.354 1.00 71.04 O ATOM 231 CB GLU A 16 11.197 8.761 -2.964 1.00 10.14 C ATOM 232 CG GLU A 16 11.363 10.280 -2.841 1.00 21.32 C ATOM 233 CD GLU A 16 10.552 10.844 -1.666 1.00 41.24 C ATOM 234 OE1 GLU A 16 9.301 10.748 -1.663 1.00 30.01 O ATOM 235 OE2 GLU A 16 11.179 11.438 -0.756 1.00 64.21 O ATOM 0 HA GLU A 16 13.224 8.391 -3.542 1.00 71.23 H new ATOM 0 HB2 GLU A 16 10.198 8.545 -3.342 1.00 10.14 H new ATOM 0 HB3 GLU A 16 11.264 8.317 -1.971 1.00 10.14 H new ATOM 0 HG2 GLU A 16 12.417 10.522 -2.705 1.00 21.32 H new ATOM 0 HG3 GLU A 16 11.043 10.758 -3.767 1.00 21.32 H new ATOM 240 N THR A 17 10.967 6.026 -4.184 1.00 24.31 N ATOM 241 CA THR A 17 10.739 4.598 -4.068 1.00 11.32 C ATOM 242 C THR A 17 11.329 3.828 -5.251 1.00 10.55 C ATOM 243 O THR A 17 11.617 2.649 -5.090 1.00 31.01 O ATOM 244 CB THR A 17 9.246 4.275 -3.894 1.00 51.13 C ATOM 245 OG1 THR A 17 8.501 4.642 -5.035 1.00 21.15 O ATOM 246 CG2 THR A 17 8.581 4.935 -2.680 1.00 10.32 C ATOM 0 H THR A 17 10.193 6.550 -4.592 1.00 24.31 H new ATOM 0 HA THR A 17 11.259 4.269 -3.169 1.00 11.32 H new ATOM 0 HB THR A 17 9.235 3.196 -3.738 1.00 51.13 H new ATOM 0 HG1 THR A 17 7.544 4.572 -4.837 1.00 21.15 H new ATOM 0 HG21 THR A 17 7.530 4.649 -2.641 1.00 10.32 H new ATOM 0 HG22 THR A 17 9.081 4.607 -1.768 1.00 10.32 H new ATOM 0 HG23 THR A 17 8.659 6.019 -2.767 1.00 10.32 H new ATOM 254 N LYS A 18 11.530 4.440 -6.432 1.00 61.32 N ATOM 255 CA LYS A 18 11.897 3.705 -7.651 1.00 72.41 C ATOM 256 C LYS A 18 13.138 2.848 -7.423 1.00 50.20 C ATOM 257 O LYS A 18 13.134 1.645 -7.700 1.00 3.54 O ATOM 258 CB LYS A 18 12.079 4.650 -8.854 1.00 50.33 C ATOM 259 CG LYS A 18 12.377 3.824 -10.118 1.00 72.32 C ATOM 260 CD LYS A 18 12.431 4.647 -11.407 1.00 52.44 C ATOM 261 CE LYS A 18 12.721 3.675 -12.554 1.00 72.44 C ATOM 262 NZ LYS A 18 12.792 4.323 -13.876 1.00 74.31 N ATOM 0 H LYS A 18 11.443 5.447 -6.566 1.00 61.32 H new ATOM 0 HA LYS A 18 11.070 3.036 -7.891 1.00 72.41 H new ATOM 0 HB2 LYS A 18 11.178 5.246 -9.001 1.00 50.33 H new ATOM 0 HB3 LYS A 18 12.895 5.347 -8.662 1.00 50.33 H new ATOM 0 HG2 LYS A 18 13.330 3.312 -9.987 1.00 72.32 H new ATOM 0 HG3 LYS A 18 11.613 3.054 -10.224 1.00 72.32 H new ATOM 0 HD2 LYS A 18 11.487 5.166 -11.572 1.00 52.44 H new ATOM 0 HD3 LYS A 18 13.207 5.410 -11.344 1.00 52.44 H new ATOM 0 HE2 LYS A 18 13.665 3.166 -12.357 1.00 72.44 H new ATOM 0 HE3 LYS A 18 11.945 2.910 -12.575 1.00 72.44 H new ATOM 0 HZ1 LYS A 18 12.991 3.607 -14.603 1.00 74.31 H new ATOM 0 HZ2 LYS A 18 11.884 4.786 -14.085 1.00 74.31 H new ATOM 0 HZ3 LYS A 18 13.551 5.034 -13.874 1.00 74.31 H new ATOM 272 N LYS A 19 14.199 3.440 -6.879 1.00 5.44 N ATOM 273 CA LYS A 19 15.436 2.741 -6.598 1.00 32.15 C ATOM 274 C LYS A 19 15.268 1.582 -5.616 1.00 71.23 C ATOM 275 O LYS A 19 16.145 0.722 -5.583 1.00 53.34 O ATOM 276 CB LYS A 19 16.402 3.806 -6.058 1.00 32.33 C ATOM 277 CG LYS A 19 17.823 3.631 -6.583 1.00 11.25 C ATOM 278 CD LYS A 19 18.775 3.040 -5.534 1.00 73.41 C ATOM 279 CE LYS A 19 19.135 4.054 -4.448 1.00 73.02 C ATOM 280 NZ LYS A 19 20.151 5.028 -4.891 1.00 65.01 N ATOM 0 H LYS A 19 14.217 4.427 -6.621 1.00 5.44 H new ATOM 0 HA LYS A 19 15.815 2.268 -7.504 1.00 32.15 H new ATOM 0 HB2 LYS A 19 16.037 4.795 -6.333 1.00 32.33 H new ATOM 0 HB3 LYS A 19 16.413 3.762 -4.969 1.00 32.33 H new ATOM 0 HG2 LYS A 19 17.805 2.981 -7.458 1.00 11.25 H new ATOM 0 HG3 LYS A 19 18.206 4.597 -6.911 1.00 11.25 H new ATOM 0 HD2 LYS A 19 18.311 2.167 -5.075 1.00 73.41 H new ATOM 0 HD3 LYS A 19 19.686 2.696 -6.024 1.00 73.41 H new ATOM 0 HE2 LYS A 19 18.235 4.588 -4.143 1.00 73.02 H new ATOM 0 HE3 LYS A 19 19.504 3.524 -3.570 1.00 73.02 H new ATOM 0 HZ1 LYS A 19 20.357 5.691 -4.117 1.00 65.01 H new ATOM 0 HZ2 LYS A 19 21.021 4.525 -5.157 1.00 65.01 H new ATOM 0 HZ3 LYS A 19 19.791 5.556 -5.712 1.00 65.01 H new ATOM 290 N MET A 20 14.171 1.532 -4.865 1.00 25.15 N ATOM 291 CA MET A 20 13.811 0.540 -3.888 1.00 71.10 C ATOM 292 C MET A 20 12.445 -0.061 -4.279 1.00 13.34 C ATOM 293 O MET A 20 11.572 -0.281 -3.439 1.00 50.43 O ATOM 294 CB MET A 20 13.720 1.281 -2.553 1.00 5.34 C ATOM 295 CG MET A 20 14.990 2.006 -2.088 1.00 61.13 C ATOM 296 SD MET A 20 16.488 0.993 -1.969 1.00 74.34 S ATOM 297 CE MET A 20 15.810 -0.409 -1.049 1.00 62.23 C ATOM 0 H MET A 20 13.456 2.255 -4.941 1.00 25.15 H new ATOM 0 HA MET A 20 14.532 -0.275 -3.826 1.00 71.10 H new ATOM 0 HB2 MET A 20 12.915 2.012 -2.622 1.00 5.34 H new ATOM 0 HB3 MET A 20 13.434 0.564 -1.783 1.00 5.34 H new ATOM 0 HG2 MET A 20 15.186 2.829 -2.775 1.00 61.13 H new ATOM 0 HG3 MET A 20 14.795 2.446 -1.110 1.00 61.13 H new ATOM 0 HE1 MET A 20 16.626 -1.030 -0.679 1.00 62.23 H new ATOM 0 HE2 MET A 20 15.223 -0.042 -0.207 1.00 62.23 H new ATOM 0 HE3 MET A 20 15.172 -1.001 -1.706 1.00 62.23 H new ATOM 305 N ALA A 21 12.219 -0.212 -5.584 1.00 64.01 N ATOM 306 CA ALA A 21 11.062 -0.825 -6.219 1.00 42.31 C ATOM 307 C ALA A 21 11.619 -1.789 -7.281 1.00 41.23 C ATOM 308 O ALA A 21 11.276 -2.971 -7.334 1.00 73.32 O ATOM 309 CB ALA A 21 10.173 0.249 -6.846 1.00 12.13 C ATOM 0 H ALA A 21 12.894 0.118 -6.274 1.00 64.01 H new ATOM 0 HA ALA A 21 10.441 -1.362 -5.502 1.00 42.31 H new ATOM 0 HB1 ALA A 21 9.311 -0.222 -7.318 1.00 12.13 H new ATOM 0 HB2 ALA A 21 9.832 0.937 -6.072 1.00 12.13 H new ATOM 0 HB3 ALA A 21 10.741 0.799 -7.596 1.00 12.13 H new ATOM 315 N GLU A 22 12.552 -1.271 -8.096 1.00 5.21 N ATOM 316 CA GLU A 22 13.262 -1.961 -9.173 1.00 22.01 C ATOM 317 C GLU A 22 14.068 -3.146 -8.671 1.00 11.32 C ATOM 318 O GLU A 22 14.168 -4.154 -9.381 1.00 62.11 O ATOM 319 CB GLU A 22 14.223 -0.969 -9.833 1.00 31.44 C ATOM 320 CG GLU A 22 13.513 0.139 -10.620 1.00 2.52 C ATOM 321 CD GLU A 22 13.040 -0.276 -12.012 1.00 3.43 C ATOM 322 OE1 GLU A 22 13.036 -1.488 -12.332 1.00 23.32 O ATOM 323 OE2 GLU A 22 12.685 0.633 -12.793 1.00 62.00 O ATOM 0 H GLU A 22 12.845 -0.298 -8.011 1.00 5.21 H new ATOM 0 HA GLU A 22 12.518 -2.336 -9.876 1.00 22.01 H new ATOM 0 HB2 GLU A 22 14.848 -0.514 -9.064 1.00 31.44 H new ATOM 0 HB3 GLU A 22 14.888 -1.512 -10.505 1.00 31.44 H new ATOM 0 HG2 GLU A 22 12.653 0.482 -10.045 1.00 2.52 H new ATOM 0 HG3 GLU A 22 14.189 0.988 -10.718 1.00 2.52 H new ATOM 328 N LYS A 23 14.662 -3.024 -7.478 1.00 21.04 N ATOM 329 CA LYS A 23 15.425 -4.127 -6.908 1.00 10.54 C ATOM 330 C LYS A 23 14.511 -5.321 -6.662 1.00 33.40 C ATOM 331 O LYS A 23 14.673 -6.330 -7.341 1.00 23.40 O ATOM 332 CB LYS A 23 16.179 -3.701 -5.638 1.00 52.24 C ATOM 333 CG LYS A 23 17.705 -3.739 -5.780 1.00 12.44 C ATOM 334 CD LYS A 23 18.348 -2.369 -5.570 1.00 53.31 C ATOM 335 CE LYS A 23 18.112 -1.501 -6.803 1.00 32.22 C ATOM 336 NZ LYS A 23 18.580 -0.130 -6.572 1.00 73.24 N ATOM 0 H LYS A 23 14.627 -2.184 -6.900 1.00 21.04 H new ATOM 0 HA LYS A 23 16.187 -4.429 -7.626 1.00 10.54 H new ATOM 0 HB2 LYS A 23 15.874 -2.690 -5.368 1.00 52.24 H new ATOM 0 HB3 LYS A 23 15.884 -4.353 -4.816 1.00 52.24 H new ATOM 0 HG2 LYS A 23 18.116 -4.444 -5.057 1.00 12.44 H new ATOM 0 HG3 LYS A 23 17.965 -4.110 -6.771 1.00 12.44 H new ATOM 0 HD2 LYS A 23 17.925 -1.889 -4.688 1.00 53.31 H new ATOM 0 HD3 LYS A 23 19.417 -2.481 -5.390 1.00 53.31 H new ATOM 0 HE2 LYS A 23 18.633 -1.929 -7.659 1.00 32.22 H new ATOM 0 HE3 LYS A 23 17.050 -1.491 -7.049 1.00 32.22 H new ATOM 0 HZ1 LYS A 23 18.922 0.275 -7.467 1.00 73.24 H new ATOM 0 HZ2 LYS A 23 17.796 0.448 -6.207 1.00 73.24 H new ATOM 0 HZ3 LYS A 23 19.355 -0.140 -5.878 1.00 73.24 H new ATOM 346 N ILE A 24 13.525 -5.180 -5.766 1.00 2.33 N ATOM 347 CA ILE A 24 12.558 -6.225 -5.415 1.00 12.41 C ATOM 348 C ILE A 24 11.965 -6.901 -6.662 1.00 43.41 C ATOM 349 O ILE A 24 11.808 -8.121 -6.664 1.00 52.35 O ATOM 350 CB ILE A 24 11.464 -5.619 -4.497 1.00 43.11 C ATOM 351 CG1 ILE A 24 12.019 -5.415 -3.067 1.00 51.52 C ATOM 352 CG2 ILE A 24 10.199 -6.488 -4.419 1.00 63.02 C ATOM 353 CD1 ILE A 24 11.128 -4.526 -2.184 1.00 64.30 C ATOM 0 H ILE A 24 13.375 -4.312 -5.252 1.00 2.33 H new ATOM 0 HA ILE A 24 13.072 -7.016 -4.868 1.00 12.41 H new ATOM 0 HB ILE A 24 11.185 -4.663 -4.941 1.00 43.11 H new ATOM 0 HG12 ILE A 24 12.136 -6.388 -2.589 1.00 51.52 H new ATOM 0 HG13 ILE A 24 13.012 -4.970 -3.131 1.00 51.52 H new ATOM 0 HG21 ILE A 24 9.471 -6.012 -3.762 1.00 63.02 H new ATOM 0 HG22 ILE A 24 9.771 -6.599 -5.416 1.00 63.02 H new ATOM 0 HG23 ILE A 24 10.456 -7.471 -4.024 1.00 63.02 H new ATOM 0 HD11 ILE A 24 11.578 -4.427 -1.196 1.00 64.30 H new ATOM 0 HD12 ILE A 24 11.032 -3.541 -2.640 1.00 64.30 H new ATOM 0 HD13 ILE A 24 10.142 -4.980 -2.089 1.00 64.30 H new ATOM 364 N ASN A 25 11.644 -6.157 -7.732 1.00 30.11 N ATOM 365 CA ASN A 25 11.121 -6.760 -8.964 1.00 22.04 C ATOM 366 C ASN A 25 12.042 -7.858 -9.530 1.00 45.34 C ATOM 367 O ASN A 25 11.541 -8.841 -10.076 1.00 53.25 O ATOM 368 CB ASN A 25 10.897 -5.687 -10.035 1.00 12.40 C ATOM 369 CG ASN A 25 10.591 -6.313 -11.385 1.00 13.31 C ATOM 370 OD1 ASN A 25 11.377 -6.183 -12.319 1.00 33.22 O ATOM 371 ND2 ASN A 25 9.459 -6.981 -11.521 1.00 54.53 N ATOM 0 H ASN A 25 11.737 -5.142 -7.767 1.00 30.11 H new ATOM 0 HA ASN A 25 10.173 -7.227 -8.698 1.00 22.04 H new ATOM 0 HB2 ASN A 25 10.073 -5.038 -9.737 1.00 12.40 H new ATOM 0 HB3 ASN A 25 11.784 -5.059 -10.115 1.00 12.40 H new ATOM 0 HD21 ASN A 25 9.221 -7.404 -12.418 1.00 54.53 H new ATOM 0 HD22 ASN A 25 8.823 -7.074 -10.729 1.00 54.53 H new ATOM 377 N SER A 26 13.360 -7.695 -9.419 1.00 30.14 N ATOM 378 CA SER A 26 14.352 -8.669 -9.861 1.00 12.42 C ATOM 379 C SER A 26 14.576 -9.811 -8.852 1.00 22.33 C ATOM 380 O SER A 26 15.296 -10.762 -9.183 1.00 73.02 O ATOM 381 CB SER A 26 15.669 -7.951 -10.176 1.00 14.10 C ATOM 382 OG SER A 26 16.010 -8.016 -11.555 1.00 73.21 O ATOM 0 H SER A 26 13.776 -6.859 -9.008 1.00 30.14 H new ATOM 0 HA SER A 26 13.963 -9.142 -10.763 1.00 12.42 H new ATOM 0 HB2 SER A 26 15.591 -6.907 -9.874 1.00 14.10 H new ATOM 0 HB3 SER A 26 16.471 -8.395 -9.586 1.00 14.10 H new ATOM 0 HG SER A 26 16.855 -7.543 -11.706 1.00 73.21 H new ATOM 387 N GLU A 27 13.991 -9.752 -7.650 1.00 71.41 N ATOM 388 CA GLU A 27 14.109 -10.732 -6.581 1.00 30.21 C ATOM 389 C GLU A 27 12.761 -11.391 -6.231 1.00 74.12 C ATOM 390 O GLU A 27 12.647 -12.098 -5.226 1.00 42.25 O ATOM 391 CB GLU A 27 14.891 -10.198 -5.376 1.00 4.11 C ATOM 392 CG GLU A 27 14.632 -8.815 -4.886 1.00 71.42 C ATOM 393 CD GLU A 27 15.707 -8.356 -3.886 1.00 53.43 C ATOM 394 OE1 GLU A 27 15.954 -9.082 -2.888 1.00 50.34 O ATOM 395 OE2 GLU A 27 16.375 -7.323 -4.088 1.00 1.14 O ATOM 0 H GLU A 27 13.389 -8.971 -7.389 1.00 71.41 H new ATOM 0 HA GLU A 27 14.721 -11.548 -6.964 1.00 30.21 H new ATOM 0 HB2 GLU A 27 14.712 -10.878 -4.543 1.00 4.11 H new ATOM 0 HB3 GLU A 27 15.951 -10.265 -5.620 1.00 4.11 H new ATOM 0 HG2 GLU A 27 14.605 -8.128 -5.732 1.00 71.42 H new ATOM 0 HG3 GLU A 27 13.652 -8.775 -4.411 1.00 71.42 H new ATOM 400 N ILE A 28 11.731 -11.203 -7.062 1.00 24.14 N ATOM 401 CA ILE A 28 10.466 -11.920 -6.968 1.00 11.40 C ATOM 402 C ILE A 28 10.146 -12.460 -8.348 1.00 41.51 C ATOM 403 O ILE A 28 10.097 -11.706 -9.329 1.00 61.23 O ATOM 404 CB ILE A 28 9.324 -11.038 -6.443 1.00 43.23 C ATOM 405 CG1 ILE A 28 9.645 -10.441 -5.067 1.00 72.44 C ATOM 406 CG2 ILE A 28 8.018 -11.859 -6.346 1.00 51.55 C ATOM 407 CD1 ILE A 28 8.560 -9.462 -4.608 1.00 24.42 C ATOM 0 H ILE A 28 11.759 -10.534 -7.832 1.00 24.14 H new ATOM 0 HA ILE A 28 10.565 -12.730 -6.246 1.00 11.40 H new ATOM 0 HB ILE A 28 9.200 -10.218 -7.150 1.00 43.23 H new ATOM 0 HG12 ILE A 28 9.744 -11.244 -4.336 1.00 72.44 H new ATOM 0 HG13 ILE A 28 10.605 -9.927 -5.108 1.00 72.44 H new ATOM 0 HG21 ILE A 28 7.215 -11.223 -5.973 1.00 51.55 H new ATOM 0 HG22 ILE A 28 7.752 -12.237 -7.333 1.00 51.55 H new ATOM 0 HG23 ILE A 28 8.165 -12.696 -5.664 1.00 51.55 H new ATOM 0 HD11 ILE A 28 8.823 -9.060 -3.629 1.00 24.42 H new ATOM 0 HD12 ILE A 28 8.479 -8.646 -5.326 1.00 24.42 H new ATOM 0 HD13 ILE A 28 7.605 -9.983 -4.542 1.00 24.42 H new ATOM 418 N LYS A 29 9.872 -13.762 -8.407 1.00 13.41 N ATOM 419 CA LYS A 29 9.522 -14.389 -9.666 1.00 53.42 C ATOM 420 C LYS A 29 8.151 -13.907 -10.117 1.00 5.34 C ATOM 421 O LYS A 29 7.221 -13.832 -9.319 1.00 22.33 O ATOM 422 CB LYS A 29 9.526 -15.915 -9.541 1.00 5.44 C ATOM 423 CG LYS A 29 9.773 -16.518 -10.926 1.00 65.42 C ATOM 424 CD LYS A 29 9.393 -17.992 -11.011 1.00 14.12 C ATOM 425 CE LYS A 29 9.602 -18.408 -12.466 1.00 52.42 C ATOM 426 NZ LYS A 29 9.152 -19.787 -12.717 1.00 44.54 N ATOM 0 H LYS A 29 9.887 -14.391 -7.604 1.00 13.41 H new ATOM 0 HA LYS A 29 10.268 -14.108 -10.409 1.00 53.42 H new ATOM 0 HB2 LYS A 29 10.301 -16.235 -8.845 1.00 5.44 H new ATOM 0 HB3 LYS A 29 8.574 -16.264 -9.141 1.00 5.44 H new ATOM 0 HG2 LYS A 29 9.202 -15.958 -11.667 1.00 65.42 H new ATOM 0 HG3 LYS A 29 10.826 -16.405 -11.183 1.00 65.42 H new ATOM 0 HD2 LYS A 29 10.011 -18.592 -10.343 1.00 14.12 H new ATOM 0 HD3 LYS A 29 8.357 -18.144 -10.709 1.00 14.12 H new ATOM 0 HE2 LYS A 29 9.059 -17.725 -13.120 1.00 52.42 H new ATOM 0 HE3 LYS A 29 10.658 -18.320 -12.720 1.00 52.42 H new ATOM 0 HZ1 LYS A 29 9.312 -20.028 -13.716 1.00 44.54 H new ATOM 0 HZ2 LYS A 29 9.688 -20.442 -12.113 1.00 44.54 H new ATOM 0 HZ3 LYS A 29 8.138 -19.866 -12.500 1.00 44.54 H new ATOM 436 N ASP A 30 8.021 -13.667 -11.419 1.00 64.44 N ATOM 437 CA ASP A 30 6.762 -13.369 -12.103 1.00 73.43 C ATOM 438 C ASP A 30 6.085 -12.114 -11.532 1.00 13.31 C ATOM 439 O ASP A 30 4.871 -11.935 -11.646 1.00 70.41 O ATOM 440 CB ASP A 30 5.865 -14.625 -12.104 1.00 45.35 C ATOM 441 CG ASP A 30 5.065 -14.846 -13.394 1.00 21.11 C ATOM 442 OD1 ASP A 30 5.097 -14.019 -14.333 1.00 12.11 O ATOM 443 OD2 ASP A 30 4.493 -15.951 -13.547 1.00 62.33 O ATOM 0 H ASP A 30 8.820 -13.675 -12.053 1.00 64.44 H new ATOM 0 HA ASP A 30 6.963 -13.120 -13.145 1.00 73.43 H new ATOM 0 HB2 ASP A 30 6.490 -15.500 -11.927 1.00 45.35 H new ATOM 0 HB3 ASP A 30 5.168 -14.557 -11.269 1.00 45.35 H new ATOM 447 N SER A 31 6.881 -11.259 -10.879 1.00 70.04 N ATOM 448 CA SER A 31 6.477 -10.011 -10.269 1.00 64.14 C ATOM 449 C SER A 31 6.398 -8.905 -11.316 1.00 74.22 C ATOM 450 O SER A 31 6.728 -9.104 -12.489 1.00 53.54 O ATOM 451 CB SER A 31 7.501 -9.694 -9.185 1.00 30.23 C ATOM 452 OG SER A 31 7.004 -8.766 -8.243 1.00 33.14 O ATOM 0 H SER A 31 7.878 -11.440 -10.762 1.00 70.04 H new ATOM 0 HA SER A 31 5.482 -10.089 -9.830 1.00 64.14 H new ATOM 0 HB2 SER A 31 7.784 -10.614 -8.673 1.00 30.23 H new ATOM 0 HB3 SER A 31 8.405 -9.295 -9.645 1.00 30.23 H new ATOM 0 HG SER A 31 7.528 -8.826 -7.417 1.00 33.14 H new ATOM 457 N GLU A 32 5.960 -7.716 -10.905 1.00 32.20 N ATOM 458 CA GLU A 32 5.567 -6.690 -11.852 1.00 73.34 C ATOM 459 C GLU A 32 5.525 -5.323 -11.226 1.00 62.43 C ATOM 460 O GLU A 32 5.420 -5.196 -10.005 1.00 31.13 O ATOM 461 CB GLU A 32 4.177 -7.081 -12.406 1.00 31.11 C ATOM 462 CG GLU A 32 4.098 -7.208 -13.928 1.00 34.42 C ATOM 463 CD GLU A 32 3.461 -5.950 -14.507 1.00 23.24 C ATOM 464 OE1 GLU A 32 4.154 -4.904 -14.506 1.00 53.21 O ATOM 465 OE2 GLU A 32 2.274 -6.012 -14.901 1.00 5.44 O ATOM 0 H GLU A 32 5.871 -7.446 -9.925 1.00 32.20 H new ATOM 0 HA GLU A 32 6.305 -6.632 -12.652 1.00 73.34 H new ATOM 0 HB2 GLU A 32 3.880 -8.031 -11.962 1.00 31.11 H new ATOM 0 HB3 GLU A 32 3.451 -6.336 -12.081 1.00 31.11 H new ATOM 0 HG2 GLU A 32 5.095 -7.349 -14.345 1.00 34.42 H new ATOM 0 HG3 GLU A 32 3.511 -8.085 -14.201 1.00 34.42 H new ATOM 470 N LEU A 33 5.617 -4.296 -12.071 1.00 64.21 N ATOM 471 CA LEU A 33 6.129 -2.998 -11.685 1.00 10.41 C ATOM 472 C LEU A 33 5.301 -1.919 -12.368 1.00 65.32 C ATOM 473 O LEU A 33 5.335 -1.790 -13.590 1.00 1.15 O ATOM 474 CB LEU A 33 7.645 -2.936 -11.991 1.00 31.14 C ATOM 475 CG LEU A 33 8.433 -2.457 -10.775 1.00 43.33 C ATOM 476 CD1 LEU A 33 8.188 -3.485 -9.680 1.00 14.23 C ATOM 477 CD2 LEU A 33 9.922 -2.331 -11.083 1.00 10.11 C ATOM 0 H LEU A 33 5.334 -4.351 -13.049 1.00 64.21 H new ATOM 0 HA LEU A 33 6.033 -2.825 -10.613 1.00 10.41 H new ATOM 0 HB2 LEU A 33 7.999 -3.922 -12.292 1.00 31.14 H new ATOM 0 HB3 LEU A 33 7.822 -2.264 -12.831 1.00 31.14 H new ATOM 0 HG LEU A 33 8.106 -1.463 -10.469 1.00 43.33 H new ATOM 0 HD11 LEU A 33 8.730 -3.194 -8.780 1.00 14.23 H new ATOM 0 HD12 LEU A 33 7.121 -3.536 -9.461 1.00 14.23 H new ATOM 0 HD13 LEU A 33 8.537 -4.462 -10.014 1.00 14.23 H new ATOM 0 HD21 LEU A 33 10.450 -1.988 -10.193 1.00 10.11 H new ATOM 0 HD22 LEU A 33 10.314 -3.302 -11.386 1.00 10.11 H new ATOM 0 HD23 LEU A 33 10.067 -1.613 -11.890 1.00 10.11 H new ATOM 488 N LYS A 34 4.468 -1.242 -11.576 1.00 5.13 N ATOM 489 CA LYS A 34 3.433 -0.317 -12.013 1.00 11.41 C ATOM 490 C LYS A 34 3.495 0.921 -11.132 1.00 10.33 C ATOM 491 O LYS A 34 3.914 0.855 -9.972 1.00 21.14 O ATOM 492 CB LYS A 34 2.063 -1.019 -11.925 1.00 54.13 C ATOM 493 CG LYS A 34 1.811 -2.009 -13.075 1.00 74.34 C ATOM 494 CD LYS A 34 1.618 -1.395 -14.475 1.00 34.41 C ATOM 495 CE LYS A 34 0.148 -1.068 -14.746 1.00 74.03 C ATOM 496 NZ LYS A 34 -0.114 -0.691 -16.149 1.00 4.33 N ATOM 0 H LYS A 34 4.503 -1.332 -10.561 1.00 5.13 H new ATOM 0 HA LYS A 34 3.584 -0.011 -13.048 1.00 11.41 H new ATOM 0 HB2 LYS A 34 1.995 -1.551 -10.976 1.00 54.13 H new ATOM 0 HB3 LYS A 34 1.276 -0.265 -11.925 1.00 54.13 H new ATOM 0 HG2 LYS A 34 2.650 -2.703 -13.119 1.00 74.34 H new ATOM 0 HG3 LYS A 34 0.924 -2.595 -12.833 1.00 74.34 H new ATOM 0 HD2 LYS A 34 2.216 -0.487 -14.561 1.00 34.41 H new ATOM 0 HD3 LYS A 34 1.983 -2.090 -15.232 1.00 34.41 H new ATOM 0 HE2 LYS A 34 -0.463 -1.933 -14.489 1.00 74.03 H new ATOM 0 HE3 LYS A 34 -0.163 -0.252 -14.093 1.00 74.03 H new ATOM 0 HZ1 LYS A 34 -1.126 -0.482 -16.269 1.00 4.33 H new ATOM 0 HZ2 LYS A 34 0.445 0.151 -16.392 1.00 4.33 H new ATOM 0 HZ3 LYS A 34 0.154 -1.477 -16.775 1.00 4.33 H new ATOM 506 N GLU A 35 3.075 2.054 -11.676 1.00 43.52 N ATOM 507 CA GLU A 35 3.154 3.349 -11.013 1.00 70.11 C ATOM 508 C GLU A 35 1.764 3.787 -10.556 1.00 45.21 C ATOM 509 O GLU A 35 0.758 3.448 -11.192 1.00 34.13 O ATOM 510 CB GLU A 35 3.852 4.386 -11.912 1.00 3.55 C ATOM 511 CG GLU A 35 3.154 4.753 -13.233 1.00 1.43 C ATOM 512 CD GLU A 35 3.540 6.159 -13.729 1.00 70.23 C ATOM 513 OE1 GLU A 35 4.742 6.476 -13.907 1.00 54.50 O ATOM 514 OE2 GLU A 35 2.624 6.992 -13.929 1.00 24.04 O ATOM 0 H GLU A 35 2.662 2.101 -12.608 1.00 43.52 H new ATOM 0 HA GLU A 35 3.772 3.263 -10.119 1.00 70.11 H new ATOM 0 HB2 GLU A 35 3.984 5.301 -11.334 1.00 3.55 H new ATOM 0 HB3 GLU A 35 4.848 4.012 -12.149 1.00 3.55 H new ATOM 0 HG2 GLU A 35 3.414 4.018 -13.995 1.00 1.43 H new ATOM 0 HG3 GLU A 35 2.074 4.703 -13.096 1.00 1.43 H new ATOM 519 N VAL A 36 1.707 4.550 -9.466 1.00 71.30 N ATOM 520 CA VAL A 36 0.489 5.175 -8.964 1.00 54.22 C ATOM 521 C VAL A 36 0.643 6.690 -9.134 1.00 50.13 C ATOM 522 O VAL A 36 1.688 7.267 -8.815 1.00 61.30 O ATOM 523 CB VAL A 36 0.254 4.765 -7.496 1.00 53.20 C ATOM 524 CG1 VAL A 36 -0.999 5.426 -6.902 1.00 31.22 C ATOM 525 CG2 VAL A 36 0.096 3.246 -7.344 1.00 65.11 C ATOM 0 H VAL A 36 2.527 4.754 -8.895 1.00 71.30 H new ATOM 0 HA VAL A 36 -0.389 4.845 -9.520 1.00 54.22 H new ATOM 0 HB VAL A 36 1.139 5.104 -6.958 1.00 53.20 H new ATOM 0 HG11 VAL A 36 -1.123 5.107 -5.867 1.00 31.22 H new ATOM 0 HG12 VAL A 36 -0.890 6.510 -6.937 1.00 31.22 H new ATOM 0 HG13 VAL A 36 -1.875 5.131 -7.480 1.00 31.22 H new ATOM 0 HG21 VAL A 36 -0.068 3.000 -6.295 1.00 65.11 H new ATOM 0 HG22 VAL A 36 -0.757 2.908 -7.933 1.00 65.11 H new ATOM 0 HG23 VAL A 36 1.000 2.749 -7.696 1.00 65.11 H new ATOM 535 N LYS A 37 -0.417 7.343 -9.603 1.00 51.41 N ATOM 536 CA LYS A 37 -0.515 8.784 -9.803 1.00 53.10 C ATOM 537 C LYS A 37 -1.548 9.354 -8.830 1.00 12.25 C ATOM 538 O LYS A 37 -2.204 8.605 -8.102 1.00 52.44 O ATOM 539 CB LYS A 37 -0.915 9.052 -11.266 1.00 50.12 C ATOM 540 CG LYS A 37 0.150 8.587 -12.269 1.00 31.25 C ATOM 541 CD LYS A 37 -0.135 9.133 -13.672 1.00 22.01 C ATOM 542 CE LYS A 37 0.333 10.589 -13.774 1.00 30.14 C ATOM 543 NZ LYS A 37 -0.180 11.252 -14.985 1.00 23.22 N ATOM 0 H LYS A 37 -1.273 6.856 -9.867 1.00 51.41 H new ATOM 0 HA LYS A 37 0.441 9.270 -9.609 1.00 53.10 H new ATOM 0 HB2 LYS A 37 -1.855 8.544 -11.480 1.00 50.12 H new ATOM 0 HB3 LYS A 37 -1.092 10.119 -11.400 1.00 50.12 H new ATOM 0 HG2 LYS A 37 1.134 8.920 -11.939 1.00 31.25 H new ATOM 0 HG3 LYS A 37 0.175 7.498 -12.298 1.00 31.25 H new ATOM 0 HD2 LYS A 37 0.376 8.525 -14.418 1.00 22.01 H new ATOM 0 HD3 LYS A 37 -1.202 9.070 -13.886 1.00 22.01 H new ATOM 0 HE2 LYS A 37 0.002 11.138 -12.893 1.00 30.14 H new ATOM 0 HE3 LYS A 37 1.423 10.620 -13.778 1.00 30.14 H new ATOM 0 HZ1 LYS A 37 0.161 12.234 -15.014 1.00 23.22 H new ATOM 0 HZ2 LYS A 37 0.156 10.744 -15.828 1.00 23.22 H new ATOM 0 HZ3 LYS A 37 -1.220 11.247 -14.970 1.00 23.22 H new ATOM 553 N VAL A 38 -1.729 10.671 -8.840 1.00 10.11 N ATOM 554 CA VAL A 38 -2.850 11.350 -8.192 1.00 44.43 C ATOM 555 C VAL A 38 -3.658 12.117 -9.250 1.00 30.25 C ATOM 556 O VAL A 38 -3.198 12.260 -10.385 1.00 51.50 O ATOM 557 CB VAL A 38 -2.389 12.234 -7.012 1.00 31.31 C ATOM 558 CG1 VAL A 38 -2.272 11.396 -5.733 1.00 51.54 C ATOM 559 CG2 VAL A 38 -1.071 12.984 -7.269 1.00 3.45 C ATOM 0 H VAL A 38 -1.088 11.311 -9.308 1.00 10.11 H new ATOM 0 HA VAL A 38 -3.509 10.608 -7.742 1.00 44.43 H new ATOM 0 HB VAL A 38 -3.158 12.998 -6.895 1.00 31.31 H new ATOM 0 HG11 VAL A 38 -1.946 12.032 -4.910 1.00 51.54 H new ATOM 0 HG12 VAL A 38 -3.242 10.961 -5.493 1.00 51.54 H new ATOM 0 HG13 VAL A 38 -1.544 10.599 -5.886 1.00 51.54 H new ATOM 0 HG21 VAL A 38 -0.816 13.582 -6.394 1.00 3.45 H new ATOM 0 HG22 VAL A 38 -0.275 12.265 -7.462 1.00 3.45 H new ATOM 0 HG23 VAL A 38 -1.187 13.637 -8.134 1.00 3.45 H new ATOM 569 N SER A 39 -4.844 12.621 -8.900 1.00 22.03 N ATOM 570 CA SER A 39 -5.680 13.473 -9.746 1.00 71.20 C ATOM 571 C SER A 39 -5.942 14.791 -9.018 1.00 11.54 C ATOM 572 O SER A 39 -5.711 14.891 -7.811 1.00 10.22 O ATOM 573 CB SER A 39 -7.016 12.777 -10.022 1.00 23.02 C ATOM 574 OG SER A 39 -7.484 12.948 -11.344 1.00 61.04 O ATOM 0 H SER A 39 -5.262 12.440 -7.987 1.00 22.03 H new ATOM 0 HA SER A 39 -5.170 13.661 -10.691 1.00 71.20 H new ATOM 0 HB2 SER A 39 -6.909 11.711 -9.819 1.00 23.02 H new ATOM 0 HB3 SER A 39 -7.765 13.160 -9.329 1.00 23.02 H new ATOM 0 HG SER A 39 -8.337 12.478 -11.452 1.00 61.04 H new ATOM 770 N ALA A 54 5.503 16.442 3.609 1.00 21.23 N ATOM 771 CA ALA A 54 5.467 16.892 5.002 1.00 70.32 C ATOM 772 C ALA A 54 4.050 16.854 5.606 1.00 41.40 C ATOM 773 O ALA A 54 3.233 16.033 5.199 1.00 71.10 O ATOM 774 CB ALA A 54 6.233 18.212 5.207 1.00 44.54 C ATOM 0 HA ALA A 54 6.019 16.162 5.594 1.00 70.32 H new ATOM 0 HB1 ALA A 54 6.178 18.505 6.255 1.00 44.54 H new ATOM 0 HB2 ALA A 54 7.276 18.075 4.923 1.00 44.54 H new ATOM 0 HB3 ALA A 54 5.788 18.991 4.588 1.00 44.54 H new ATOM 780 N LEU A 55 3.811 17.619 6.679 1.00 70.44 N ATOM 781 CA LEU A 55 2.531 17.787 7.378 1.00 3.42 C ATOM 782 C LEU A 55 1.555 18.472 6.419 1.00 43.41 C ATOM 783 O LEU A 55 1.333 19.685 6.511 1.00 25.25 O ATOM 784 CB LEU A 55 2.750 18.649 8.645 1.00 62.23 C ATOM 785 CG LEU A 55 3.183 17.926 9.930 1.00 43.10 C ATOM 786 CD1 LEU A 55 2.001 17.209 10.591 1.00 53.30 C ATOM 787 CD2 LEU A 55 4.371 16.980 9.763 1.00 13.13 C ATOM 0 H LEU A 55 4.553 18.171 7.109 1.00 70.44 H new ATOM 0 HA LEU A 55 2.125 16.824 7.686 1.00 3.42 H new ATOM 0 HB2 LEU A 55 3.503 19.402 8.413 1.00 62.23 H new ATOM 0 HB3 LEU A 55 1.822 19.180 8.855 1.00 62.23 H new ATOM 0 HG LEU A 55 3.537 18.718 10.590 1.00 43.10 H new ATOM 0 HD11 LEU A 55 2.340 16.707 11.497 1.00 53.30 H new ATOM 0 HD12 LEU A 55 1.230 17.937 10.846 1.00 53.30 H new ATOM 0 HD13 LEU A 55 1.590 16.472 9.901 1.00 53.30 H new ATOM 0 HD21 LEU A 55 4.604 16.516 10.721 1.00 13.13 H new ATOM 0 HD22 LEU A 55 4.121 16.207 9.037 1.00 13.13 H new ATOM 0 HD23 LEU A 55 5.237 17.542 9.412 1.00 13.13 H new ATOM 798 N ASP A 56 0.956 17.699 5.519 1.00 21.31 N ATOM 799 CA ASP A 56 -0.090 18.133 4.609 1.00 62.01 C ATOM 800 C ASP A 56 -1.253 17.156 4.715 1.00 44.51 C ATOM 801 O ASP A 56 -1.113 15.988 4.364 1.00 4.35 O ATOM 802 CB ASP A 56 0.409 18.236 3.161 1.00 13.11 C ATOM 803 CG ASP A 56 -0.730 18.748 2.270 1.00 33.02 C ATOM 804 OD1 ASP A 56 -1.437 19.693 2.694 1.00 21.31 O ATOM 805 OD2 ASP A 56 -0.908 18.264 1.127 1.00 70.24 O ATOM 0 H ASP A 56 1.198 16.715 5.402 1.00 21.31 H new ATOM 0 HA ASP A 56 -0.413 19.135 4.893 1.00 62.01 H new ATOM 0 HB2 ASP A 56 1.262 18.912 3.105 1.00 13.11 H new ATOM 0 HB3 ASP A 56 0.750 17.262 2.811 1.00 13.11 H new ATOM 809 N GLN A 57 -2.394 17.636 5.209 1.00 65.12 N ATOM 810 CA GLN A 57 -3.671 16.932 5.271 1.00 25.21 C ATOM 811 C GLN A 57 -3.745 15.860 6.377 1.00 5.42 C ATOM 812 O GLN A 57 -4.632 15.005 6.345 1.00 1.33 O ATOM 813 CB GLN A 57 -4.057 16.420 3.859 1.00 24.24 C ATOM 814 CG GLN A 57 -5.539 16.608 3.501 1.00 21.04 C ATOM 815 CD GLN A 57 -5.971 18.071 3.380 1.00 45.13 C ATOM 816 OE1 GLN A 57 -5.190 18.996 3.609 1.00 4.53 O ATOM 817 NE2 GLN A 57 -7.228 18.326 3.054 1.00 10.42 N ATOM 0 H GLN A 57 -2.454 18.577 5.597 1.00 65.12 H new ATOM 0 HA GLN A 57 -4.433 17.647 5.582 1.00 25.21 H new ATOM 0 HB2 GLN A 57 -3.448 16.938 3.118 1.00 24.24 H new ATOM 0 HB3 GLN A 57 -3.810 15.361 3.790 1.00 24.24 H new ATOM 0 HG2 GLN A 57 -5.741 16.101 2.557 1.00 21.04 H new ATOM 0 HG3 GLN A 57 -6.150 16.121 4.261 1.00 21.04 H new ATOM 0 HE21 GLN A 57 -7.872 17.558 2.865 1.00 10.42 H new ATOM 0 HE22 GLN A 57 -7.553 19.291 2.992 1.00 10.42 H new ATOM 824 N ILE A 58 -2.883 15.919 7.401 1.00 22.42 N ATOM 825 CA ILE A 58 -2.904 15.007 8.554 1.00 12.42 C ATOM 826 C ILE A 58 -3.592 15.691 9.737 1.00 45.30 C ATOM 827 O ILE A 58 -4.656 15.251 10.168 1.00 42.14 O ATOM 828 CB ILE A 58 -1.477 14.512 8.901 1.00 4.11 C ATOM 829 CG1 ILE A 58 -0.932 13.431 7.935 1.00 43.50 C ATOM 830 CG2 ILE A 58 -1.368 13.873 10.303 1.00 22.41 C ATOM 831 CD1 ILE A 58 -0.885 13.792 6.452 1.00 13.24 C ATOM 0 H ILE A 58 -2.138 16.614 7.453 1.00 22.42 H new ATOM 0 HA ILE A 58 -3.481 14.118 8.301 1.00 12.42 H new ATOM 0 HB ILE A 58 -0.898 15.433 8.831 1.00 4.11 H new ATOM 0 HG12 ILE A 58 0.077 13.169 8.253 1.00 43.50 H new ATOM 0 HG13 ILE A 58 -1.544 12.536 8.047 1.00 43.50 H new ATOM 0 HG21 ILE A 58 -0.342 13.550 10.477 1.00 22.41 H new ATOM 0 HG22 ILE A 58 -1.651 14.605 11.059 1.00 22.41 H new ATOM 0 HG23 ILE A 58 -2.034 13.012 10.363 1.00 22.41 H new ATOM 0 HD11 ILE A 58 -0.485 12.951 5.885 1.00 13.24 H new ATOM 0 HD12 ILE A 58 -1.891 14.020 6.101 1.00 13.24 H new ATOM 0 HD13 ILE A 58 -0.245 14.663 6.310 1.00 13.24 H new ATOM 842 N GLN A 59 -2.967 16.713 10.325 1.00 70.33 N ATOM 843 CA GLN A 59 -3.404 17.243 11.610 1.00 45.41 C ATOM 844 C GLN A 59 -4.622 18.133 11.410 1.00 45.53 C ATOM 845 O GLN A 59 -4.515 19.172 10.758 1.00 52.32 O ATOM 846 CB GLN A 59 -2.281 18.005 12.324 1.00 63.30 C ATOM 847 CG GLN A 59 -1.196 17.067 12.869 1.00 74.00 C ATOM 848 CD GLN A 59 -0.423 17.750 13.990 1.00 62.34 C ATOM 849 OE1 GLN A 59 -0.856 17.742 15.141 1.00 70.23 O ATOM 850 NE2 GLN A 59 0.709 18.359 13.701 1.00 32.01 N ATOM 0 H GLN A 59 -2.156 17.188 9.928 1.00 70.33 H new ATOM 0 HA GLN A 59 -3.675 16.404 12.250 1.00 45.41 H new ATOM 0 HB2 GLN A 59 -1.830 18.715 11.631 1.00 63.30 H new ATOM 0 HB3 GLN A 59 -2.703 18.585 13.145 1.00 63.30 H new ATOM 0 HG2 GLN A 59 -1.652 16.149 13.239 1.00 74.00 H new ATOM 0 HG3 GLN A 59 -0.514 16.784 12.067 1.00 74.00 H new ATOM 0 HE21 GLN A 59 1.058 18.359 12.743 1.00 32.01 H new ATOM 0 HE22 GLN A 59 1.236 18.831 14.436 1.00 32.01 H new ATOM 857 N GLY A 60 -5.771 17.730 11.956 1.00 44.23 N ATOM 858 CA GLY A 60 -7.035 18.438 11.792 1.00 44.24 C ATOM 859 C GLY A 60 -7.675 18.176 10.426 1.00 51.53 C ATOM 860 O GLY A 60 -8.806 18.618 10.195 1.00 11.52 O ATOM 0 H GLY A 60 -5.847 16.891 12.531 1.00 44.23 H new ATOM 0 HA2 GLY A 60 -7.725 18.132 12.579 1.00 44.24 H new ATOM 0 HA3 GLY A 60 -6.868 19.508 11.913 1.00 44.24 H new ATOM 864 N ASN A 61 -7.003 17.427 9.538 1.00 52.10 N ATOM 865 CA ASN A 61 -7.591 16.936 8.298 1.00 41.41 C ATOM 866 C ASN A 61 -7.768 15.423 8.415 1.00 30.25 C ATOM 867 O ASN A 61 -7.429 14.814 9.433 1.00 33.33 O ATOM 868 CB ASN A 61 -6.737 17.365 7.104 1.00 31.14 C ATOM 869 CG ASN A 61 -6.946 18.829 6.751 1.00 70.21 C ATOM 870 OD1 ASN A 61 -6.148 19.676 7.138 1.00 32.32 O ATOM 871 ND2 ASN A 61 -8.007 19.158 6.037 1.00 52.12 N ATOM 0 H ASN A 61 -6.031 17.147 9.668 1.00 52.10 H new ATOM 0 HA ASN A 61 -8.576 17.370 8.127 1.00 41.41 H new ATOM 0 HB2 ASN A 61 -5.685 17.193 7.331 1.00 31.14 H new ATOM 0 HB3 ASN A 61 -6.982 16.745 6.241 1.00 31.14 H new ATOM 0 HD21 ASN A 61 -8.177 20.134 5.796 1.00 52.12 H new ATOM 0 HD22 ASN A 61 -8.657 18.436 5.726 1.00 52.12 H new ATOM 877 N LYS A 62 -8.416 14.810 7.429 1.00 4.21 N ATOM 878 CA LYS A 62 -8.836 13.408 7.481 1.00 45.13 C ATOM 879 C LYS A 62 -9.359 12.958 6.121 1.00 64.00 C ATOM 880 O LYS A 62 -9.241 11.779 5.778 1.00 65.44 O ATOM 881 CB LYS A 62 -9.920 13.220 8.570 1.00 5.41 C ATOM 882 CG LYS A 62 -9.481 12.307 9.733 1.00 52.41 C ATOM 883 CD LYS A 62 -10.461 11.154 9.969 1.00 63.40 C ATOM 884 CE LYS A 62 -10.528 10.227 8.749 1.00 51.50 C ATOM 885 NZ LYS A 62 -9.998 8.878 9.023 1.00 64.30 N ATOM 0 H LYS A 62 -8.669 15.277 6.558 1.00 4.21 H new ATOM 0 HA LYS A 62 -7.974 12.792 7.736 1.00 45.13 H new ATOM 0 HB2 LYS A 62 -10.193 14.196 8.970 1.00 5.41 H new ATOM 0 HB3 LYS A 62 -10.815 12.802 8.110 1.00 5.41 H new ATOM 0 HG2 LYS A 62 -8.492 11.902 9.520 1.00 52.41 H new ATOM 0 HG3 LYS A 62 -9.394 12.899 10.644 1.00 52.41 H new ATOM 0 HD2 LYS A 62 -10.153 10.584 10.846 1.00 63.40 H new ATOM 0 HD3 LYS A 62 -11.453 11.553 10.181 1.00 63.40 H new ATOM 0 HE2 LYS A 62 -11.563 10.145 8.418 1.00 51.50 H new ATOM 0 HE3 LYS A 62 -9.966 10.673 7.929 1.00 51.50 H new ATOM 0 HZ1 LYS A 62 -10.069 8.296 8.164 1.00 64.30 H new ATOM 0 HZ2 LYS A 62 -9.002 8.949 9.312 1.00 64.30 H new ATOM 0 HZ3 LYS A 62 -10.550 8.437 9.786 1.00 64.30 H new ATOM 895 N ASP A 63 -9.935 13.903 5.377 1.00 42.12 N ATOM 896 CA ASP A 63 -10.067 13.856 3.928 1.00 41.54 C ATOM 897 C ASP A 63 -8.689 13.921 3.256 1.00 52.14 C ATOM 898 O ASP A 63 -7.684 14.130 3.938 1.00 42.33 O ATOM 899 CB ASP A 63 -10.957 15.014 3.462 1.00 41.23 C ATOM 900 CG ASP A 63 -10.243 16.370 3.510 1.00 41.54 C ATOM 901 OD1 ASP A 63 -9.501 16.684 2.548 1.00 22.33 O ATOM 902 OD2 ASP A 63 -10.491 17.125 4.476 1.00 42.11 O ATOM 0 H ASP A 63 -10.334 14.749 5.784 1.00 42.12 H new ATOM 0 HA ASP A 63 -10.531 12.913 3.640 1.00 41.54 H new ATOM 0 HB2 ASP A 63 -11.292 14.821 2.443 1.00 41.23 H new ATOM 0 HB3 ASP A 63 -11.848 15.056 4.088 1.00 41.23 H new ATOM 906 N PHE A 64 -8.658 13.732 1.934 1.00 74.13 N ATOM 907 CA PHE A 64 -7.473 13.627 1.078 1.00 2.42 C ATOM 908 C PHE A 64 -7.913 13.738 -0.397 1.00 4.13 C ATOM 909 O PHE A 64 -9.123 13.703 -0.650 1.00 63.03 O ATOM 910 CB PHE A 64 -6.747 12.299 1.357 1.00 25.15 C ATOM 911 CG PHE A 64 -7.641 11.105 1.615 1.00 5.34 C ATOM 912 CD1 PHE A 64 -8.543 10.670 0.629 1.00 53.30 C ATOM 913 CD2 PHE A 64 -7.603 10.459 2.863 1.00 44.32 C ATOM 914 CE1 PHE A 64 -9.432 9.625 0.908 1.00 72.33 C ATOM 915 CE2 PHE A 64 -8.457 9.375 3.121 1.00 14.13 C ATOM 916 CZ PHE A 64 -9.383 8.963 2.149 1.00 43.43 C ATOM 0 H PHE A 64 -9.520 13.642 1.396 1.00 74.13 H new ATOM 0 HA PHE A 64 -6.774 14.435 1.292 1.00 2.42 H new ATOM 0 HB2 PHE A 64 -6.104 12.072 0.507 1.00 25.15 H new ATOM 0 HB3 PHE A 64 -6.096 12.436 2.221 1.00 25.15 H new ATOM 0 HD1 PHE A 64 -8.550 11.141 -0.343 1.00 53.30 H new ATOM 0 HD2 PHE A 64 -6.916 10.797 3.624 1.00 44.32 H new ATOM 0 HE1 PHE A 64 -10.159 9.325 0.167 1.00 72.33 H new ATOM 0 HE2 PHE A 64 -8.402 8.858 4.067 1.00 14.13 H new ATOM 0 HZ PHE A 64 -10.054 8.142 2.353 1.00 43.43 H new ATOM 925 N PRO A 65 -6.998 13.944 -1.362 1.00 51.20 N ATOM 926 CA PRO A 65 -7.303 13.866 -2.793 1.00 30.45 C ATOM 927 C PRO A 65 -7.393 12.412 -3.293 1.00 52.11 C ATOM 928 O PRO A 65 -6.937 11.478 -2.626 1.00 64.14 O ATOM 929 CB PRO A 65 -6.140 14.601 -3.466 1.00 51.42 C ATOM 930 CG PRO A 65 -4.955 14.305 -2.550 1.00 41.32 C ATOM 931 CD PRO A 65 -5.599 14.308 -1.164 1.00 5.23 C ATOM 0 HA PRO A 65 -8.274 14.305 -3.020 1.00 30.45 H new ATOM 0 HB2 PRO A 65 -5.966 14.236 -4.478 1.00 51.42 H new ATOM 0 HB3 PRO A 65 -6.331 15.671 -3.542 1.00 51.42 H new ATOM 0 HG2 PRO A 65 -4.494 13.345 -2.781 1.00 41.32 H new ATOM 0 HG3 PRO A 65 -4.176 15.062 -2.637 1.00 41.32 H new ATOM 0 HD2 PRO A 65 -5.102 13.598 -0.503 1.00 5.23 H new ATOM 0 HD3 PRO A 65 -5.515 15.290 -0.698 1.00 5.23 H new ATOM 936 N GLU A 66 -7.949 12.213 -4.490 1.00 54.34 N ATOM 937 CA GLU A 66 -8.054 10.925 -5.176 1.00 64.00 C ATOM 938 C GLU A 66 -6.739 10.507 -5.864 1.00 24.03 C ATOM 939 O GLU A 66 -5.818 11.308 -6.062 1.00 43.52 O ATOM 940 CB GLU A 66 -9.212 10.979 -6.193 1.00 52.10 C ATOM 941 CG GLU A 66 -8.832 11.827 -7.419 1.00 50.21 C ATOM 942 CD GLU A 66 -10.006 12.312 -8.272 1.00 44.14 C ATOM 943 OE1 GLU A 66 -10.871 13.041 -7.726 1.00 30.14 O ATOM 944 OE2 GLU A 66 -9.998 12.046 -9.496 1.00 25.34 O ATOM 0 H GLU A 66 -8.355 12.977 -5.030 1.00 54.34 H new ATOM 0 HA GLU A 66 -8.259 10.164 -4.423 1.00 64.00 H new ATOM 0 HB2 GLU A 66 -9.468 9.968 -6.511 1.00 52.10 H new ATOM 0 HB3 GLU A 66 -10.099 11.398 -5.717 1.00 52.10 H new ATOM 0 HG2 GLU A 66 -8.269 12.696 -7.078 1.00 50.21 H new ATOM 0 HG3 GLU A 66 -8.163 11.242 -8.051 1.00 50.21 H new ATOM 949 N ILE A 67 -6.685 9.246 -6.306 1.00 73.30 N ATOM 950 CA ILE A 67 -5.565 8.663 -7.048 1.00 14.11 C ATOM 951 C ILE A 67 -5.825 8.709 -8.560 1.00 72.23 C ATOM 952 O ILE A 67 -6.925 9.042 -9.003 1.00 2.13 O ATOM 953 CB ILE A 67 -5.298 7.213 -6.580 1.00 11.55 C ATOM 954 CG1 ILE A 67 -6.536 6.309 -6.783 1.00 14.24 C ATOM 955 CG2 ILE A 67 -4.813 7.210 -5.120 1.00 31.41 C ATOM 956 CD1 ILE A 67 -6.186 4.824 -6.716 1.00 30.42 C ATOM 0 H ILE A 67 -7.445 8.583 -6.152 1.00 73.30 H new ATOM 0 HA ILE A 67 -4.675 9.258 -6.842 1.00 14.11 H new ATOM 0 HB ILE A 67 -4.507 6.791 -7.200 1.00 11.55 H new ATOM 0 HG12 ILE A 67 -7.280 6.539 -6.021 1.00 14.24 H new ATOM 0 HG13 ILE A 67 -6.990 6.530 -7.749 1.00 14.24 H new ATOM 0 HG21 ILE A 67 -4.628 6.185 -4.800 1.00 31.41 H new ATOM 0 HG22 ILE A 67 -3.891 7.787 -5.042 1.00 31.41 H new ATOM 0 HG23 ILE A 67 -5.576 7.657 -4.482 1.00 31.41 H new ATOM 0 HD11 ILE A 67 -7.088 4.231 -6.864 1.00 30.42 H new ATOM 0 HD12 ILE A 67 -5.462 4.585 -7.495 1.00 30.42 H new ATOM 0 HD13 ILE A 67 -5.757 4.595 -5.740 1.00 30.42 H new ATOM 967 N GLN A 68 -4.837 8.288 -9.348 1.00 24.12 N ATOM 968 CA GLN A 68 -4.979 7.851 -10.730 1.00 74.03 C ATOM 969 C GLN A 68 -4.041 6.672 -10.971 1.00 71.00 C ATOM 970 O GLN A 68 -3.039 6.528 -10.264 1.00 54.42 O ATOM 971 CB GLN A 68 -4.630 9.001 -11.683 1.00 23.04 C ATOM 972 CG GLN A 68 -5.868 9.808 -12.082 1.00 64.42 C ATOM 973 CD GLN A 68 -5.530 10.892 -13.097 1.00 74.03 C ATOM 974 OE1 GLN A 68 -6.163 11.001 -14.143 1.00 14.35 O ATOM 975 NE2 GLN A 68 -4.524 11.704 -12.826 1.00 51.34 N ATOM 0 H GLN A 68 -3.872 8.241 -9.022 1.00 24.12 H new ATOM 0 HA GLN A 68 -6.009 7.547 -10.916 1.00 74.03 H new ATOM 0 HB2 GLN A 68 -3.905 9.661 -11.206 1.00 23.04 H new ATOM 0 HB3 GLN A 68 -4.155 8.599 -12.578 1.00 23.04 H new ATOM 0 HG2 GLN A 68 -6.619 9.139 -12.501 1.00 64.42 H new ATOM 0 HG3 GLN A 68 -6.307 10.264 -11.195 1.00 64.42 H new ATOM 0 HE21 GLN A 68 -4.007 11.602 -11.953 1.00 51.34 H new ATOM 0 HE22 GLN A 68 -4.264 12.433 -13.490 1.00 51.34 H new ATOM 982 N LEU A 69 -4.342 5.866 -11.991 1.00 5.31 N ATOM 983 CA LEU A 69 -3.478 4.852 -12.593 1.00 1.22 C ATOM 984 C LEU A 69 -4.126 4.379 -13.904 1.00 31.13 C ATOM 985 O LEU A 69 -5.056 5.022 -14.408 1.00 62.23 O ATOM 986 CB LEU A 69 -3.142 3.706 -11.608 1.00 34.14 C ATOM 987 CG LEU A 69 -4.190 2.601 -11.389 1.00 11.53 C ATOM 988 CD1 LEU A 69 -3.776 1.801 -10.154 1.00 30.22 C ATOM 989 CD2 LEU A 69 -5.627 3.095 -11.187 1.00 62.43 C ATOM 0 H LEU A 69 -5.254 5.908 -12.446 1.00 5.31 H new ATOM 0 HA LEU A 69 -2.506 5.285 -12.831 1.00 1.22 H new ATOM 0 HB2 LEU A 69 -2.224 3.230 -11.953 1.00 34.14 H new ATOM 0 HB3 LEU A 69 -2.924 4.154 -10.639 1.00 34.14 H new ATOM 0 HG LEU A 69 -4.207 2.008 -12.303 1.00 11.53 H new ATOM 0 HD11 LEU A 69 -4.502 1.008 -9.974 1.00 30.22 H new ATOM 0 HD12 LEU A 69 -2.792 1.361 -10.318 1.00 30.22 H new ATOM 0 HD13 LEU A 69 -3.738 2.462 -9.288 1.00 30.22 H new ATOM 0 HD21 LEU A 69 -6.288 2.241 -11.041 1.00 62.43 H new ATOM 0 HD22 LEU A 69 -5.670 3.741 -10.310 1.00 62.43 H new ATOM 0 HD23 LEU A 69 -5.946 3.655 -12.066 1.00 62.43 H new ATOM 1000 N ASP A 70 -3.584 3.319 -14.494 1.00 63.21 N ATOM 1001 CA ASP A 70 -4.093 2.655 -15.696 1.00 52.54 C ATOM 1002 C ASP A 70 -5.199 1.645 -15.351 1.00 51.34 C ATOM 1003 O ASP A 70 -5.598 1.516 -14.198 1.00 33.41 O ATOM 1004 CB ASP A 70 -2.929 1.963 -16.399 1.00 2.15 C ATOM 1005 CG ASP A 70 -3.123 1.761 -17.912 1.00 73.04 C ATOM 1006 OD1 ASP A 70 -4.244 1.923 -18.450 1.00 52.54 O ATOM 1007 OD2 ASP A 70 -2.105 1.411 -18.553 1.00 11.42 O ATOM 0 H ASP A 70 -2.739 2.876 -14.133 1.00 63.21 H new ATOM 0 HA ASP A 70 -4.536 3.399 -16.358 1.00 52.54 H new ATOM 0 HB2 ASP A 70 -2.024 2.549 -16.237 1.00 2.15 H new ATOM 0 HB3 ASP A 70 -2.767 0.991 -15.934 1.00 2.15 H new ATOM 1011 N ASN A 71 -5.689 0.896 -16.335 1.00 51.52 N ATOM 1012 CA ASN A 71 -6.653 -0.188 -16.197 1.00 50.50 C ATOM 1013 C ASN A 71 -5.988 -1.460 -15.670 1.00 30.35 C ATOM 1014 O ASN A 71 -6.017 -2.515 -16.305 1.00 11.53 O ATOM 1015 CB ASN A 71 -7.292 -0.432 -17.564 1.00 14.54 C ATOM 1016 CG ASN A 71 -8.546 -1.301 -17.564 1.00 10.31 C ATOM 1017 OD1 ASN A 71 -8.861 -2.066 -16.528 1.00 53.30 O flip ATOM 1018 ND2 ASN A 71 -9.294 -1.237 -18.533 1.00 23.32 N flip ATOM 0 H ASN A 71 -5.407 1.039 -17.305 1.00 51.52 H new ATOM 0 HA ASN A 71 -7.417 0.091 -15.471 1.00 50.50 H new ATOM 0 HB2 ASN A 71 -7.541 0.533 -18.005 1.00 14.54 H new ATOM 0 HB3 ASN A 71 -6.550 -0.897 -18.213 1.00 14.54 H new ATOM 0 HD21 ASN A 71 -9.049 -0.648 -19.328 1.00 23.32 H new ATOM 0 HD22 ASN A 71 -10.162 -1.773 -18.544 1.00 23.32 H new ATOM 1024 N ILE A 72 -5.397 -1.383 -14.488 1.00 5.22 N ATOM 1025 CA ILE A 72 -4.840 -2.555 -13.823 1.00 51.52 C ATOM 1026 C ILE A 72 -5.996 -3.442 -13.379 1.00 74.20 C ATOM 1027 O ILE A 72 -7.109 -2.990 -13.097 1.00 13.44 O ATOM 1028 CB ILE A 72 -3.902 -2.132 -12.661 1.00 33.05 C ATOM 1029 CG1 ILE A 72 -2.978 -0.967 -13.092 1.00 44.24 C ATOM 1030 CG2 ILE A 72 -3.067 -3.329 -12.158 1.00 61.20 C ATOM 1031 CD1 ILE A 72 -1.924 -0.561 -12.065 1.00 25.05 C ATOM 0 H ILE A 72 -5.289 -0.514 -13.964 1.00 5.22 H new ATOM 0 HA ILE A 72 -4.214 -3.131 -14.504 1.00 51.52 H new ATOM 0 HB ILE A 72 -4.528 -1.785 -11.838 1.00 33.05 H new ATOM 0 HG12 ILE A 72 -2.473 -1.248 -14.016 1.00 44.24 H new ATOM 0 HG13 ILE A 72 -3.596 -0.098 -13.318 1.00 44.24 H new ATOM 0 HG21 ILE A 72 -2.419 -3.004 -11.344 1.00 61.20 H new ATOM 0 HG22 ILE A 72 -3.734 -4.113 -11.800 1.00 61.20 H new ATOM 0 HG23 ILE A 72 -2.458 -3.716 -12.975 1.00 61.20 H new ATOM 0 HD11 ILE A 72 -1.328 0.262 -12.461 1.00 25.05 H new ATOM 0 HD12 ILE A 72 -2.415 -0.244 -11.145 1.00 25.05 H new ATOM 0 HD13 ILE A 72 -1.275 -1.411 -11.855 1.00 25.05 H new ATOM 1042 N ASP A 73 -5.712 -4.735 -13.327 1.00 21.45 N ATOM 1043 CA ASP A 73 -6.539 -5.744 -12.708 1.00 51.50 C ATOM 1044 C ASP A 73 -5.781 -6.307 -11.522 1.00 63.34 C ATOM 1045 O ASP A 73 -4.643 -6.752 -11.687 1.00 41.54 O ATOM 1046 CB ASP A 73 -6.819 -6.864 -13.700 1.00 71.00 C ATOM 1047 CG ASP A 73 -7.438 -8.034 -12.926 1.00 54.23 C ATOM 1048 OD1 ASP A 73 -8.515 -7.849 -12.314 1.00 21.05 O ATOM 1049 OD2 ASP A 73 -6.745 -9.066 -12.780 1.00 71.02 O ATOM 0 H ASP A 73 -4.860 -5.120 -13.735 1.00 21.45 H new ATOM 0 HA ASP A 73 -7.486 -5.309 -12.390 1.00 51.50 H new ATOM 0 HB2 ASP A 73 -7.498 -6.521 -14.481 1.00 71.00 H new ATOM 0 HB3 ASP A 73 -5.898 -7.177 -14.193 1.00 71.00 H new ATOM 1053 N TYR A 74 -6.398 -6.281 -10.341 1.00 12.12 N ATOM 1054 CA TYR A 74 -5.758 -6.810 -9.146 1.00 51.53 C ATOM 1055 C TYR A 74 -5.860 -8.334 -9.049 1.00 2.12 C ATOM 1056 O TYR A 74 -5.025 -8.938 -8.379 1.00 43.33 O ATOM 1057 CB TYR A 74 -6.336 -6.141 -7.890 1.00 13.25 C ATOM 1058 CG TYR A 74 -6.247 -4.626 -7.927 1.00 14.52 C ATOM 1059 CD1 TYR A 74 -4.993 -3.987 -7.991 1.00 12.35 C ATOM 1060 CD2 TYR A 74 -7.425 -3.858 -7.987 1.00 74.00 C ATOM 1061 CE1 TYR A 74 -4.924 -2.589 -8.134 1.00 32.24 C ATOM 1062 CE2 TYR A 74 -7.360 -2.463 -8.146 1.00 4.11 C ATOM 1063 CZ TYR A 74 -6.105 -1.823 -8.228 1.00 45.23 C ATOM 1064 OH TYR A 74 -6.030 -0.483 -8.438 1.00 1.25 O ATOM 0 H TYR A 74 -7.333 -5.902 -10.191 1.00 12.12 H new ATOM 0 HA TYR A 74 -4.696 -6.573 -9.218 1.00 51.53 H new ATOM 0 HB2 TYR A 74 -7.380 -6.435 -7.777 1.00 13.25 H new ATOM 0 HB3 TYR A 74 -5.804 -6.509 -7.012 1.00 13.25 H new ATOM 0 HD1 TYR A 74 -4.086 -4.570 -7.930 1.00 12.35 H new ATOM 0 HD2 TYR A 74 -8.386 -4.344 -7.910 1.00 74.00 H new ATOM 0 HE1 TYR A 74 -3.962 -2.100 -8.172 1.00 32.24 H new ATOM 0 HE2 TYR A 74 -8.269 -1.882 -8.205 1.00 4.11 H new ATOM 0 HH TYR A 74 -6.934 -0.107 -8.478 1.00 1.25 H new ATOM 1073 N ASN A 75 -6.865 -8.948 -9.694 1.00 22.02 N ATOM 1074 CA ASN A 75 -7.227 -10.352 -9.474 1.00 24.24 C ATOM 1075 C ASN A 75 -6.080 -11.263 -9.876 1.00 71.31 C ATOM 1076 O ASN A 75 -5.757 -12.220 -9.175 1.00 22.31 O ATOM 1077 CB ASN A 75 -8.469 -10.776 -10.296 1.00 33.33 C ATOM 1078 CG ASN A 75 -9.809 -10.378 -9.698 1.00 70.02 C ATOM 1079 OD1 ASN A 75 -10.641 -11.233 -9.398 1.00 45.31 O ATOM 1080 ND2 ASN A 75 -10.065 -9.091 -9.545 1.00 25.34 N ATOM 0 H ASN A 75 -7.450 -8.479 -10.386 1.00 22.02 H new ATOM 0 HA ASN A 75 -7.452 -10.446 -8.412 1.00 24.24 H new ATOM 0 HB2 ASN A 75 -8.391 -10.341 -11.293 1.00 33.33 H new ATOM 0 HB3 ASN A 75 -8.451 -11.859 -10.418 1.00 33.33 H new ATOM 0 HD21 ASN A 75 -10.966 -8.791 -9.172 1.00 25.34 H new ATOM 0 HD22 ASN A 75 -9.362 -8.397 -9.800 1.00 25.34 H new ATOM 1086 N ASN A 76 -5.485 -10.998 -11.037 1.00 53.45 N ATOM 1087 CA ASN A 76 -4.555 -11.918 -11.675 1.00 21.02 C ATOM 1088 C ASN A 76 -3.141 -11.922 -11.068 1.00 14.24 C ATOM 1089 O ASN A 76 -2.228 -12.503 -11.663 1.00 32.20 O ATOM 1090 CB ASN A 76 -4.615 -11.759 -13.201 1.00 63.24 C ATOM 1091 CG ASN A 76 -3.721 -10.693 -13.820 1.00 73.13 C ATOM 1092 OD1 ASN A 76 -2.699 -11.011 -14.432 1.00 51.51 O ATOM 1093 ND2 ASN A 76 -4.155 -9.445 -13.774 1.00 61.11 N ATOM 0 H ASN A 76 -5.637 -10.136 -11.561 1.00 53.45 H new ATOM 0 HA ASN A 76 -4.888 -12.932 -11.452 1.00 21.02 H new ATOM 0 HB2 ASN A 76 -4.361 -12.718 -13.652 1.00 63.24 H new ATOM 0 HB3 ASN A 76 -5.646 -11.540 -13.479 1.00 63.24 H new ATOM 0 HD21 ASN A 76 -3.640 -8.708 -14.255 1.00 61.11 H new ATOM 0 HD22 ASN A 76 -5.005 -9.219 -13.257 1.00 61.11 H new ATOM 1099 N TYR A 77 -2.966 -11.361 -9.862 1.00 52.21 N ATOM 1100 CA TYR A 77 -1.758 -11.500 -9.048 1.00 31.22 C ATOM 1101 C TYR A 77 -2.135 -12.083 -7.675 1.00 25.10 C ATOM 1102 O TYR A 77 -3.081 -11.615 -7.041 1.00 22.00 O ATOM 1103 CB TYR A 77 -1.022 -10.159 -8.922 1.00 12.24 C ATOM 1104 CG TYR A 77 -0.755 -9.412 -10.226 1.00 10.53 C ATOM 1105 CD1 TYR A 77 -1.711 -8.501 -10.703 1.00 70.32 C ATOM 1106 CD2 TYR A 77 0.465 -9.541 -10.924 1.00 52.51 C ATOM 1107 CE1 TYR A 77 -1.432 -7.689 -11.808 1.00 12.23 C ATOM 1108 CE2 TYR A 77 0.734 -8.762 -12.070 1.00 2.22 C ATOM 1109 CZ TYR A 77 -0.220 -7.821 -12.522 1.00 54.31 C ATOM 1110 OH TYR A 77 -0.005 -7.013 -13.606 1.00 61.24 O ATOM 0 H TYR A 77 -3.681 -10.784 -9.418 1.00 52.21 H new ATOM 0 HA TYR A 77 -1.068 -12.188 -9.536 1.00 31.22 H new ATOM 0 HB2 TYR A 77 -1.603 -9.509 -8.268 1.00 12.24 H new ATOM 0 HB3 TYR A 77 -0.067 -10.337 -8.428 1.00 12.24 H new ATOM 0 HD1 TYR A 77 -2.670 -8.426 -10.213 1.00 70.32 H new ATOM 0 HD2 TYR A 77 1.204 -10.247 -10.576 1.00 52.51 H new ATOM 0 HE1 TYR A 77 -2.155 -6.950 -12.120 1.00 12.23 H new ATOM 0 HE2 TYR A 77 1.667 -8.884 -12.601 1.00 2.22 H new ATOM 0 HH TYR A 77 0.958 -6.882 -13.731 1.00 61.24 H new ATOM 1119 N ASP A 78 -1.406 -13.110 -7.223 1.00 51.42 N ATOM 1120 CA ASP A 78 -1.623 -13.821 -5.951 1.00 2.23 C ATOM 1121 C ASP A 78 -1.019 -13.059 -4.760 1.00 42.43 C ATOM 1122 O ASP A 78 -1.321 -13.353 -3.605 1.00 22.03 O ATOM 1123 CB ASP A 78 -0.998 -15.224 -6.032 1.00 24.10 C ATOM 1124 CG ASP A 78 -1.477 -16.181 -4.927 1.00 21.42 C ATOM 1125 OD1 ASP A 78 -2.463 -16.924 -5.153 1.00 51.44 O ATOM 1126 OD2 ASP A 78 -0.777 -16.336 -3.904 1.00 54.21 O ATOM 0 H ASP A 78 -0.618 -13.485 -7.751 1.00 51.42 H new ATOM 0 HA ASP A 78 -2.698 -13.896 -5.790 1.00 2.23 H new ATOM 0 HB2 ASP A 78 -1.231 -15.660 -7.004 1.00 24.10 H new ATOM 0 HB3 ASP A 78 0.087 -15.132 -5.976 1.00 24.10 H new ATOM 1130 N LEU A 79 -0.198 -12.038 -5.013 1.00 72.22 N ATOM 1131 CA LEU A 79 0.436 -11.217 -3.990 1.00 50.43 C ATOM 1132 C LEU A 79 0.356 -9.763 -4.445 1.00 32.13 C ATOM 1133 O LEU A 79 0.566 -9.471 -5.626 1.00 1.51 O ATOM 1134 CB LEU A 79 1.901 -11.663 -3.821 1.00 22.20 C ATOM 1135 CG LEU A 79 2.458 -11.692 -2.385 1.00 32.23 C ATOM 1136 CD1 LEU A 79 1.997 -10.542 -1.478 1.00 41.45 C ATOM 1137 CD2 LEU A 79 2.168 -13.030 -1.697 1.00 72.12 C ATOM 0 H LEU A 79 0.048 -11.755 -5.962 1.00 72.22 H new ATOM 0 HA LEU A 79 -0.064 -11.325 -3.028 1.00 50.43 H new ATOM 0 HB2 LEU A 79 2.003 -12.662 -4.245 1.00 22.20 H new ATOM 0 HB3 LEU A 79 2.529 -10.999 -4.415 1.00 22.20 H new ATOM 0 HG LEU A 79 3.531 -11.559 -2.521 1.00 32.23 H new ATOM 0 HD11 LEU A 79 2.445 -10.655 -0.491 1.00 41.45 H new ATOM 0 HD12 LEU A 79 2.307 -9.591 -1.910 1.00 41.45 H new ATOM 0 HD13 LEU A 79 0.911 -10.562 -1.388 1.00 41.45 H new ATOM 0 HD21 LEU A 79 2.575 -13.015 -0.686 1.00 72.12 H new ATOM 0 HD22 LEU A 79 1.091 -13.190 -1.652 1.00 72.12 H new ATOM 0 HD23 LEU A 79 2.632 -13.838 -2.263 1.00 72.12 H new ATOM 1148 N ILE A 80 0.073 -8.835 -3.531 1.00 12.54 N ATOM 1149 CA ILE A 80 0.081 -7.407 -3.827 1.00 22.12 C ATOM 1150 C ILE A 80 0.938 -6.737 -2.768 1.00 22.15 C ATOM 1151 O ILE A 80 0.562 -6.682 -1.596 1.00 54.23 O ATOM 1152 CB ILE A 80 -1.345 -6.821 -3.943 1.00 33.22 C ATOM 1153 CG1 ILE A 80 -2.127 -7.593 -5.029 1.00 71.03 C ATOM 1154 CG2 ILE A 80 -1.255 -5.322 -4.313 1.00 52.23 C ATOM 1155 CD1 ILE A 80 -3.588 -7.161 -5.200 1.00 24.11 C ATOM 0 H ILE A 80 -0.168 -9.055 -2.565 1.00 12.54 H new ATOM 0 HA ILE A 80 0.513 -7.218 -4.810 1.00 22.12 H new ATOM 0 HB ILE A 80 -1.866 -6.920 -2.991 1.00 33.22 H new ATOM 0 HG12 ILE A 80 -1.613 -7.471 -5.982 1.00 71.03 H new ATOM 0 HG13 ILE A 80 -2.103 -8.656 -4.788 1.00 71.03 H new ATOM 0 HG21 ILE A 80 -2.259 -4.907 -4.395 1.00 52.23 H new ATOM 0 HG22 ILE A 80 -0.704 -4.788 -3.538 1.00 52.23 H new ATOM 0 HG23 ILE A 80 -0.738 -5.213 -5.266 1.00 52.23 H new ATOM 0 HD11 ILE A 80 -4.055 -7.758 -5.983 1.00 24.11 H new ATOM 0 HD12 ILE A 80 -4.124 -7.310 -4.262 1.00 24.11 H new ATOM 0 HD13 ILE A 80 -3.626 -6.107 -5.476 1.00 24.11 H new ATOM 1166 N LEU A 81 2.105 -6.265 -3.195 1.00 24.42 N ATOM 1167 CA LEU A 81 2.951 -5.333 -2.489 1.00 44.30 C ATOM 1168 C LEU A 81 2.482 -3.922 -2.834 1.00 32.43 C ATOM 1169 O LEU A 81 2.037 -3.632 -3.950 1.00 1.45 O ATOM 1170 CB LEU A 81 4.414 -5.558 -2.911 1.00 45.24 C ATOM 1171 CG LEU A 81 5.157 -6.655 -2.129 1.00 70.40 C ATOM 1172 CD1 LEU A 81 4.327 -7.882 -1.747 1.00 53.41 C ATOM 1173 CD2 LEU A 81 6.384 -7.136 -2.902 1.00 24.13 C ATOM 0 H LEU A 81 2.500 -6.543 -4.093 1.00 24.42 H new ATOM 0 HA LEU A 81 2.889 -5.477 -1.410 1.00 44.30 H new ATOM 0 HB2 LEU A 81 4.435 -5.811 -3.971 1.00 45.24 H new ATOM 0 HB3 LEU A 81 4.957 -4.620 -2.796 1.00 45.24 H new ATOM 0 HG LEU A 81 5.429 -6.162 -1.196 1.00 70.40 H new ATOM 0 HD11 LEU A 81 4.952 -8.588 -1.200 1.00 53.41 H new ATOM 0 HD12 LEU A 81 3.491 -7.575 -1.118 1.00 53.41 H new ATOM 0 HD13 LEU A 81 3.946 -8.359 -2.650 1.00 53.41 H new ATOM 0 HD21 LEU A 81 6.894 -7.911 -2.330 1.00 24.13 H new ATOM 0 HD22 LEU A 81 6.072 -7.541 -3.865 1.00 24.13 H new ATOM 0 HD23 LEU A 81 7.063 -6.299 -3.064 1.00 24.13 H new ATOM 1184 N ILE A 82 2.641 -3.034 -1.862 1.00 2.11 N ATOM 1185 CA ILE A 82 2.277 -1.626 -1.897 1.00 22.12 C ATOM 1186 C ILE A 82 3.455 -0.894 -1.236 1.00 22.34 C ATOM 1187 O ILE A 82 4.078 -1.496 -0.360 1.00 24.14 O ATOM 1188 CB ILE A 82 0.974 -1.409 -1.076 1.00 4.11 C ATOM 1189 CG1 ILE A 82 -0.111 -2.504 -1.238 1.00 11.42 C ATOM 1190 CG2 ILE A 82 0.374 -0.040 -1.407 1.00 43.42 C ATOM 1191 CD1 ILE A 82 -1.398 -2.245 -0.438 1.00 51.34 C ATOM 0 H ILE A 82 3.056 -3.297 -0.968 1.00 2.11 H new ATOM 0 HA ILE A 82 2.093 -1.264 -2.908 1.00 22.12 H new ATOM 0 HB ILE A 82 1.286 -1.468 -0.033 1.00 4.11 H new ATOM 0 HG12 ILE A 82 -0.366 -2.593 -2.294 1.00 11.42 H new ATOM 0 HG13 ILE A 82 0.308 -3.462 -0.929 1.00 11.42 H new ATOM 0 HG21 ILE A 82 -0.538 0.107 -0.829 1.00 43.42 H new ATOM 0 HG22 ILE A 82 1.091 0.742 -1.157 1.00 43.42 H new ATOM 0 HG23 ILE A 82 0.141 0.008 -2.471 1.00 43.42 H new ATOM 0 HD11 ILE A 82 -2.103 -3.059 -0.609 1.00 51.34 H new ATOM 0 HD12 ILE A 82 -1.161 -2.187 0.624 1.00 51.34 H new ATOM 0 HD13 ILE A 82 -1.845 -1.305 -0.762 1.00 51.34 H new ATOM 1202 N GLY A 83 3.745 0.376 -1.540 1.00 42.33 N ATOM 1203 CA GLY A 83 4.567 1.173 -0.643 1.00 23.34 C ATOM 1204 C GLY A 83 4.250 2.667 -0.677 1.00 63.43 C ATOM 1205 O GLY A 83 3.666 3.168 -1.641 1.00 30.14 O ATOM 0 H GLY A 83 3.428 0.859 -2.381 1.00 42.33 H new ATOM 0 HA2 GLY A 83 4.436 0.807 0.375 1.00 23.34 H new ATOM 0 HA3 GLY A 83 5.616 1.028 -0.902 1.00 23.34 H new ATOM 1209 N SER A 84 4.720 3.381 0.351 1.00 5.45 N ATOM 1210 CA SER A 84 4.649 4.826 0.546 1.00 1.42 C ATOM 1211 C SER A 84 5.928 5.256 1.294 1.00 70.31 C ATOM 1212 O SER A 84 6.569 4.411 1.924 1.00 11.11 O ATOM 1213 CB SER A 84 3.365 5.119 1.352 1.00 23.41 C ATOM 1214 OG SER A 84 3.277 6.420 1.911 1.00 62.12 O ATOM 0 H SER A 84 5.197 2.923 1.128 1.00 5.45 H new ATOM 0 HA SER A 84 4.600 5.384 -0.389 1.00 1.42 H new ATOM 0 HB2 SER A 84 2.505 4.964 0.701 1.00 23.41 H new ATOM 0 HB3 SER A 84 3.289 4.390 2.159 1.00 23.41 H new ATOM 0 HG SER A 84 3.992 6.542 2.571 1.00 62.12 H new ATOM 1219 N PRO A 85 6.305 6.549 1.287 1.00 41.41 N ATOM 1220 CA PRO A 85 7.255 7.114 2.248 1.00 41.20 C ATOM 1221 C PRO A 85 6.585 7.334 3.622 1.00 14.42 C ATOM 1222 O PRO A 85 5.366 7.155 3.766 1.00 50.13 O ATOM 1223 CB PRO A 85 7.692 8.437 1.608 1.00 70.20 C ATOM 1224 CG PRO A 85 6.421 8.893 0.891 1.00 34.12 C ATOM 1225 CD PRO A 85 5.836 7.581 0.369 1.00 31.15 C ATOM 0 HA PRO A 85 8.102 6.456 2.443 1.00 41.20 H new ATOM 0 HB2 PRO A 85 8.019 9.161 2.355 1.00 70.20 H new ATOM 0 HB3 PRO A 85 8.521 8.298 0.915 1.00 70.20 H new ATOM 0 HG2 PRO A 85 5.734 9.400 1.569 1.00 34.12 H new ATOM 0 HG3 PRO A 85 6.641 9.588 0.081 1.00 34.12 H new ATOM 0 HD2 PRO A 85 4.747 7.619 0.346 1.00 31.15 H new ATOM 0 HD3 PRO A 85 6.170 7.381 -0.649 1.00 31.15 H new ATOM 1230 N VAL A 86 7.365 7.753 4.628 1.00 12.55 N ATOM 1231 CA VAL A 86 6.873 8.205 5.931 1.00 2.21 C ATOM 1232 C VAL A 86 7.895 9.160 6.567 1.00 53.31 C ATOM 1233 O VAL A 86 9.103 8.994 6.379 1.00 21.25 O ATOM 1234 CB VAL A 86 6.584 6.986 6.830 1.00 70.40 C ATOM 1235 CG1 VAL A 86 7.825 6.237 7.318 1.00 10.44 C ATOM 1236 CG2 VAL A 86 5.752 7.400 8.047 1.00 32.43 C ATOM 0 H VAL A 86 8.382 7.787 4.553 1.00 12.55 H new ATOM 0 HA VAL A 86 5.939 8.753 5.808 1.00 2.21 H new ATOM 0 HB VAL A 86 6.034 6.297 6.189 1.00 70.40 H new ATOM 0 HG11 VAL A 86 7.521 5.397 7.942 1.00 10.44 H new ATOM 0 HG12 VAL A 86 8.387 5.867 6.461 1.00 10.44 H new ATOM 0 HG13 VAL A 86 8.453 6.913 7.899 1.00 10.44 H new ATOM 0 HG21 VAL A 86 5.558 6.526 8.669 1.00 32.43 H new ATOM 0 HG22 VAL A 86 6.299 8.144 8.626 1.00 32.43 H new ATOM 0 HG23 VAL A 86 4.805 7.825 7.713 1.00 32.43 H new ATOM 1246 N TRP A 87 7.440 10.096 7.411 1.00 51.23 N ATOM 1247 CA TRP A 87 8.312 10.844 8.317 1.00 63.32 C ATOM 1248 C TRP A 87 7.641 11.328 9.589 1.00 30.25 C ATOM 1249 O TRP A 87 8.251 11.304 10.658 1.00 51.14 O ATOM 1250 CB TRP A 87 9.020 11.986 7.572 1.00 45.51 C ATOM 1251 CG TRP A 87 10.271 12.496 8.213 1.00 74.31 C ATOM 1252 CD1 TRP A 87 11.237 11.727 8.764 1.00 42.22 C ATOM 1253 CD2 TRP A 87 10.720 13.874 8.382 1.00 62.32 C ATOM 1254 NE1 TRP A 87 12.238 12.525 9.262 1.00 23.34 N ATOM 1255 CE2 TRP A 87 11.994 13.854 9.024 1.00 10.11 C ATOM 1256 CE3 TRP A 87 10.186 15.141 8.069 1.00 11.23 C ATOM 1257 CZ2 TRP A 87 12.717 15.020 9.295 1.00 63.10 C ATOM 1258 CZ3 TRP A 87 10.890 16.321 8.373 1.00 51.42 C ATOM 1259 CH2 TRP A 87 12.160 16.264 8.967 1.00 22.42 C ATOM 0 H TRP A 87 6.456 10.354 7.482 1.00 51.23 H new ATOM 0 HA TRP A 87 9.060 10.130 8.661 1.00 63.32 H new ATOM 0 HB2 TRP A 87 9.262 11.645 6.565 1.00 45.51 H new ATOM 0 HB3 TRP A 87 8.322 12.816 7.468 1.00 45.51 H new ATOM 0 HD1 TRP A 87 11.224 10.648 8.806 1.00 42.22 H new ATOM 0 HE1 TRP A 87 13.062 12.173 9.749 1.00 23.34 H new ATOM 0 HE3 TRP A 87 9.221 15.207 7.588 1.00 11.23 H new ATOM 0 HZ2 TRP A 87 13.694 14.963 9.752 1.00 63.10 H new ATOM 0 HZ3 TRP A 87 10.448 17.280 8.147 1.00 51.42 H new ATOM 0 HH2 TRP A 87 12.705 17.174 9.170 1.00 22.42 H new ATOM 1269 N SER A 88 6.369 11.682 9.499 1.00 1.31 N ATOM 1270 CA SER A 88 5.556 12.076 10.639 1.00 64.42 C ATOM 1271 C SER A 88 4.303 11.202 10.678 1.00 41.12 C ATOM 1272 O SER A 88 3.206 11.636 10.320 1.00 34.04 O ATOM 1273 CB SER A 88 5.292 13.592 10.614 1.00 54.23 C ATOM 1274 OG SER A 88 4.563 14.016 11.757 1.00 2.42 O ATOM 0 H SER A 88 5.863 11.704 8.614 1.00 1.31 H new ATOM 0 HA SER A 88 6.081 11.903 11.579 1.00 64.42 H new ATOM 0 HB2 SER A 88 6.241 14.126 10.569 1.00 54.23 H new ATOM 0 HB3 SER A 88 4.737 13.850 9.712 1.00 54.23 H new ATOM 0 HG SER A 88 3.800 14.562 11.474 1.00 2.42 H new ATOM 1279 N GLY A 89 4.485 9.936 11.060 1.00 65.32 N ATOM 1280 CA GLY A 89 3.437 8.951 11.273 1.00 52.30 C ATOM 1281 C GLY A 89 2.894 8.417 9.955 1.00 33.31 C ATOM 1282 O GLY A 89 3.104 7.262 9.596 1.00 34.14 O ATOM 0 H GLY A 89 5.415 9.557 11.236 1.00 65.32 H new ATOM 0 HA2 GLY A 89 3.828 8.125 11.867 1.00 52.30 H new ATOM 0 HA3 GLY A 89 2.626 9.400 11.846 1.00 52.30 H new ATOM 1286 N TYR A 90 2.195 9.282 9.240 1.00 10.54 N ATOM 1287 CA TYR A 90 1.474 9.006 8.014 1.00 50.51 C ATOM 1288 C TYR A 90 1.315 10.317 7.225 1.00 5.51 C ATOM 1289 O TYR A 90 0.198 10.741 6.972 1.00 4.51 O ATOM 1290 CB TYR A 90 0.131 8.319 8.349 1.00 34.02 C ATOM 1291 CG TYR A 90 -0.688 8.777 9.563 1.00 44.11 C ATOM 1292 CD1 TYR A 90 -0.525 10.030 10.195 1.00 45.43 C ATOM 1293 CD2 TYR A 90 -1.624 7.872 10.098 1.00 53.31 C ATOM 1294 CE1 TYR A 90 -1.194 10.313 11.400 1.00 73.04 C ATOM 1295 CE2 TYR A 90 -2.291 8.139 11.305 1.00 22.31 C ATOM 1296 CZ TYR A 90 -2.069 9.361 11.973 1.00 43.20 C ATOM 1297 OH TYR A 90 -2.693 9.626 13.156 1.00 30.34 O ATOM 0 H TYR A 90 2.112 10.259 9.521 1.00 10.54 H new ATOM 0 HA TYR A 90 2.024 8.313 7.377 1.00 50.51 H new ATOM 0 HB2 TYR A 90 -0.509 8.416 7.472 1.00 34.02 H new ATOM 0 HB3 TYR A 90 0.335 7.256 8.479 1.00 34.02 H new ATOM 0 HD1 TYR A 90 0.117 10.776 9.750 1.00 45.43 H new ATOM 0 HD2 TYR A 90 -1.834 6.954 9.570 1.00 53.31 H new ATOM 0 HE1 TYR A 90 -1.038 11.263 11.890 1.00 73.04 H new ATOM 0 HE2 TYR A 90 -2.972 7.411 11.720 1.00 22.31 H new ATOM 0 HH TYR A 90 -3.259 8.865 13.405 1.00 30.34 H new ATOM 1306 N PRO A 91 2.415 10.998 6.854 1.00 11.12 N ATOM 1307 CA PRO A 91 2.408 12.291 6.162 1.00 74.03 C ATOM 1308 C PRO A 91 1.952 12.208 4.696 1.00 42.22 C ATOM 1309 O PRO A 91 2.150 13.162 3.952 1.00 41.11 O ATOM 1310 CB PRO A 91 3.838 12.814 6.283 1.00 21.31 C ATOM 1311 CG PRO A 91 4.615 11.520 6.149 1.00 31.23 C ATOM 1312 CD PRO A 91 3.794 10.551 6.988 1.00 23.24 C ATOM 0 HA PRO A 91 1.679 12.962 6.617 1.00 74.03 H new ATOM 0 HB2 PRO A 91 4.086 13.530 5.499 1.00 21.31 H new ATOM 0 HB3 PRO A 91 4.019 13.310 7.237 1.00 21.31 H new ATOM 0 HG2 PRO A 91 4.687 11.196 5.111 1.00 31.23 H new ATOM 0 HG3 PRO A 91 5.634 11.618 6.524 1.00 31.23 H new ATOM 0 HD2 PRO A 91 3.912 9.527 6.633 1.00 23.24 H new ATOM 0 HD3 PRO A 91 4.113 10.566 8.030 1.00 23.24 H new ATOM 1317 N ALA A 92 1.487 11.052 4.216 1.00 64.13 N ATOM 1318 CA ALA A 92 0.930 10.900 2.884 1.00 53.33 C ATOM 1319 C ALA A 92 -0.342 10.068 3.021 1.00 14.51 C ATOM 1320 O ALA A 92 -0.420 9.249 3.942 1.00 64.04 O ATOM 1321 CB ALA A 92 1.966 10.208 1.983 1.00 25.05 C ATOM 0 H ALA A 92 1.490 10.187 4.756 1.00 64.13 H new ATOM 0 HA ALA A 92 0.688 11.861 2.429 1.00 53.33 H new ATOM 0 HB1 ALA A 92 1.555 10.090 0.980 1.00 25.05 H new ATOM 0 HB2 ALA A 92 2.870 10.815 1.936 1.00 25.05 H new ATOM 0 HB3 ALA A 92 2.208 9.228 2.393 1.00 25.05 H new ATOM 1327 N THR A 93 -1.267 10.166 2.069 1.00 5.43 N ATOM 1328 CA THR A 93 -2.439 9.301 1.996 1.00 2.43 C ATOM 1329 C THR A 93 -2.670 8.772 0.566 1.00 2.34 C ATOM 1330 O THR A 93 -3.823 8.666 0.139 1.00 3.24 O ATOM 1331 CB THR A 93 -3.669 10.121 2.459 1.00 5.11 C ATOM 1332 OG1 THR A 93 -3.798 11.363 1.796 1.00 61.43 O ATOM 1333 CG2 THR A 93 -3.644 10.507 3.935 1.00 13.31 C ATOM 0 H THR A 93 -1.222 10.856 1.319 1.00 5.43 H new ATOM 0 HA THR A 93 -2.283 8.435 2.639 1.00 2.43 H new ATOM 0 HB THR A 93 -4.486 9.437 2.232 1.00 5.11 H new ATOM 0 HG1 THR A 93 -3.883 11.212 0.832 1.00 61.43 H new ATOM 0 HG21 THR A 93 -4.540 11.079 4.177 1.00 13.31 H new ATOM 0 HG22 THR A 93 -3.613 9.605 4.546 1.00 13.31 H new ATOM 0 HG23 THR A 93 -2.761 11.113 4.138 1.00 13.31 H new ATOM 1341 N PRO A 94 -1.663 8.188 -0.111 1.00 62.10 N ATOM 1342 CA PRO A 94 -1.898 7.439 -1.339 1.00 54.52 C ATOM 1343 C PRO A 94 -2.556 6.093 -1.005 1.00 2.24 C ATOM 1344 O PRO A 94 -3.309 5.540 -1.814 1.00 74.32 O ATOM 1345 CB PRO A 94 -0.511 7.292 -1.992 1.00 52.33 C ATOM 1346 CG PRO A 94 0.441 7.323 -0.800 1.00 51.53 C ATOM 1347 CD PRO A 94 -0.234 8.310 0.129 1.00 34.33 C ATOM 0 HA PRO A 94 -2.583 7.935 -2.027 1.00 54.52 H new ATOM 0 HB2 PRO A 94 -0.426 6.360 -2.551 1.00 52.33 H new ATOM 0 HB3 PRO A 94 -0.307 8.103 -2.691 1.00 52.33 H new ATOM 0 HG2 PRO A 94 0.549 6.341 -0.340 1.00 51.53 H new ATOM 0 HG3 PRO A 94 1.440 7.652 -1.086 1.00 51.53 H new ATOM 0 HD2 PRO A 94 0.005 8.090 1.169 1.00 34.33 H new ATOM 0 HD3 PRO A 94 0.108 9.326 -0.069 1.00 34.33 H new ATOM 1352 N ILE A 95 -2.307 5.542 0.189 1.00 73.11 N ATOM 1353 CA ILE A 95 -2.725 4.196 0.557 1.00 14.42 C ATOM 1354 C ILE A 95 -4.038 4.300 1.335 1.00 22.23 C ATOM 1355 O ILE A 95 -4.156 3.891 2.487 1.00 50.22 O ATOM 1356 CB ILE A 95 -1.614 3.439 1.315 1.00 14.14 C ATOM 1357 CG1 ILE A 95 -0.170 3.790 0.909 1.00 2.52 C ATOM 1358 CG2 ILE A 95 -1.849 1.926 1.179 1.00 2.23 C ATOM 1359 CD1 ILE A 95 0.173 3.601 -0.573 1.00 33.05 C ATOM 0 H ILE A 95 -1.804 6.029 0.931 1.00 73.11 H new ATOM 0 HA ILE A 95 -2.902 3.597 -0.336 1.00 14.42 H new ATOM 0 HB ILE A 95 -1.693 3.766 2.352 1.00 14.14 H new ATOM 0 HG12 ILE A 95 0.020 4.830 1.176 1.00 2.52 H new ATOM 0 HG13 ILE A 95 0.512 3.179 1.501 1.00 2.52 H new ATOM 0 HG21 ILE A 95 -1.067 1.387 1.713 1.00 2.23 H new ATOM 0 HG22 ILE A 95 -2.820 1.669 1.602 1.00 2.23 H new ATOM 0 HG23 ILE A 95 -1.827 1.648 0.125 1.00 2.23 H new ATOM 0 HD11 ILE A 95 1.213 3.878 -0.744 1.00 33.05 H new ATOM 0 HD12 ILE A 95 0.025 2.557 -0.851 1.00 33.05 H new ATOM 0 HD13 ILE A 95 -0.475 4.233 -1.180 1.00 33.05 H new ATOM 1370 N LYS A 96 -5.032 4.895 0.688 1.00 3.55 N ATOM 1371 CA LYS A 96 -6.406 4.959 1.163 1.00 24.15 C ATOM 1372 C LYS A 96 -7.363 4.611 0.030 1.00 70.20 C ATOM 1373 O LYS A 96 -8.144 3.669 0.154 1.00 63.00 O ATOM 1374 CB LYS A 96 -6.658 6.342 1.794 1.00 1.52 C ATOM 1375 CG LYS A 96 -6.735 6.262 3.326 1.00 61.10 C ATOM 1376 CD LYS A 96 -8.092 5.718 3.791 1.00 45.41 C ATOM 1377 CE LYS A 96 -8.168 5.734 5.322 1.00 70.23 C ATOM 1378 NZ LYS A 96 -9.518 6.076 5.816 1.00 43.33 N ATOM 0 H LYS A 96 -4.899 5.361 -0.210 1.00 3.55 H new ATOM 0 HA LYS A 96 -6.586 4.220 1.944 1.00 24.15 H new ATOM 0 HB2 LYS A 96 -5.859 7.025 1.505 1.00 1.52 H new ATOM 0 HB3 LYS A 96 -7.588 6.756 1.404 1.00 1.52 H new ATOM 0 HG2 LYS A 96 -5.937 5.620 3.699 1.00 61.10 H new ATOM 0 HG3 LYS A 96 -6.573 7.252 3.752 1.00 61.10 H new ATOM 0 HD2 LYS A 96 -8.897 6.322 3.373 1.00 45.41 H new ATOM 0 HD3 LYS A 96 -8.231 4.702 3.423 1.00 45.41 H new ATOM 0 HE2 LYS A 96 -7.880 4.756 5.707 1.00 70.23 H new ATOM 0 HE3 LYS A 96 -7.448 6.454 5.711 1.00 70.23 H new ATOM 0 HZ1 LYS A 96 -9.518 6.074 6.856 1.00 43.33 H new ATOM 0 HZ2 LYS A 96 -9.785 7.020 5.472 1.00 43.33 H new ATOM 0 HZ3 LYS A 96 -10.203 5.375 5.468 1.00 43.33 H new ATOM 1388 N THR A 97 -7.298 5.315 -1.094 1.00 63.13 N ATOM 1389 CA THR A 97 -8.235 5.099 -2.193 1.00 31.23 C ATOM 1390 C THR A 97 -7.869 3.822 -2.956 1.00 11.42 C ATOM 1391 O THR A 97 -8.755 3.027 -3.254 1.00 51.33 O ATOM 1392 CB THR A 97 -8.253 6.368 -3.068 1.00 14.32 C ATOM 1393 OG1 THR A 97 -8.409 7.525 -2.253 1.00 72.04 O ATOM 1394 CG2 THR A 97 -9.400 6.381 -4.071 1.00 53.24 C ATOM 0 H THR A 97 -6.605 6.042 -1.270 1.00 63.13 H new ATOM 0 HA THR A 97 -9.249 4.938 -1.828 1.00 31.23 H new ATOM 0 HB THR A 97 -7.305 6.370 -3.605 1.00 14.32 H new ATOM 0 HG1 THR A 97 -8.417 8.325 -2.819 1.00 72.04 H new ATOM 0 HG21 THR A 97 -9.360 7.299 -4.658 1.00 53.24 H new ATOM 0 HG22 THR A 97 -9.312 5.521 -4.735 1.00 53.24 H new ATOM 0 HG23 THR A 97 -10.350 6.332 -3.538 1.00 53.24 H new ATOM 1402 N LEU A 98 -6.576 3.567 -3.208 1.00 53.44 N ATOM 1403 CA LEU A 98 -6.120 2.358 -3.906 1.00 62.02 C ATOM 1404 C LEU A 98 -6.628 1.113 -3.180 1.00 22.12 C ATOM 1405 O LEU A 98 -7.175 0.214 -3.803 1.00 24.41 O ATOM 1406 CB LEU A 98 -4.584 2.355 -3.987 1.00 41.52 C ATOM 1407 CG LEU A 98 -3.933 1.491 -5.091 1.00 30.05 C ATOM 1408 CD1 LEU A 98 -4.513 0.085 -5.258 1.00 41.13 C ATOM 1409 CD2 LEU A 98 -4.007 2.191 -6.444 1.00 74.33 C ATOM 0 H LEU A 98 -5.819 4.193 -2.934 1.00 53.44 H new ATOM 0 HA LEU A 98 -6.521 2.351 -4.919 1.00 62.02 H new ATOM 0 HB2 LEU A 98 -4.252 3.384 -4.124 1.00 41.52 H new ATOM 0 HB3 LEU A 98 -4.196 2.021 -3.025 1.00 41.52 H new ATOM 0 HG LEU A 98 -2.905 1.371 -4.749 1.00 30.05 H new ATOM 0 HD11 LEU A 98 -3.985 -0.434 -6.058 1.00 41.13 H new ATOM 0 HD12 LEU A 98 -4.397 -0.469 -4.327 1.00 41.13 H new ATOM 0 HD13 LEU A 98 -5.571 0.155 -5.509 1.00 41.13 H new ATOM 0 HD21 LEU A 98 -3.542 1.563 -7.204 1.00 74.33 H new ATOM 0 HD22 LEU A 98 -5.050 2.367 -6.706 1.00 74.33 H new ATOM 0 HD23 LEU A 98 -3.481 3.144 -6.390 1.00 74.33 H new ATOM 1420 N LEU A 99 -6.502 1.094 -1.851 1.00 24.31 N ATOM 1421 CA LEU A 99 -6.965 -0.002 -1.003 1.00 71.04 C ATOM 1422 C LEU A 99 -8.397 -0.394 -1.344 1.00 21.44 C ATOM 1423 O LEU A 99 -8.684 -1.580 -1.475 1.00 30.22 O ATOM 1424 CB LEU A 99 -6.893 0.381 0.487 1.00 12.22 C ATOM 1425 CG LEU A 99 -5.513 0.190 1.136 1.00 14.42 C ATOM 1426 CD1 LEU A 99 -5.553 0.845 2.522 1.00 4.21 C ATOM 1427 CD2 LEU A 99 -5.165 -1.297 1.276 1.00 25.42 C ATOM 0 H LEU A 99 -6.068 1.854 -1.327 1.00 24.31 H new ATOM 0 HA LEU A 99 -6.306 -0.850 -1.190 1.00 71.04 H new ATOM 0 HB2 LEU A 99 -7.188 1.425 0.594 1.00 12.22 H new ATOM 0 HB3 LEU A 99 -7.623 -0.214 1.036 1.00 12.22 H new ATOM 0 HG LEU A 99 -4.749 0.648 0.508 1.00 14.42 H new ATOM 0 HD11 LEU A 99 -4.585 0.726 3.009 1.00 4.21 H new ATOM 0 HD12 LEU A 99 -5.778 1.906 2.417 1.00 4.21 H new ATOM 0 HD13 LEU A 99 -6.325 0.369 3.127 1.00 4.21 H new ATOM 0 HD21 LEU A 99 -4.183 -1.399 1.738 1.00 25.42 H new ATOM 0 HD22 LEU A 99 -5.912 -1.788 1.899 1.00 25.42 H new ATOM 0 HD23 LEU A 99 -5.152 -1.762 0.290 1.00 25.42 H new ATOM 1438 N ASP A 100 -9.298 0.575 -1.514 1.00 65.40 N ATOM 1439 CA ASP A 100 -10.698 0.276 -1.800 1.00 65.01 C ATOM 1440 C ASP A 100 -10.924 -0.164 -3.245 1.00 34.03 C ATOM 1441 O ASP A 100 -11.918 -0.820 -3.556 1.00 33.05 O ATOM 1442 CB ASP A 100 -11.590 1.476 -1.493 1.00 23.04 C ATOM 1443 CG ASP A 100 -13.013 0.984 -1.203 1.00 30.35 C ATOM 1444 OD1 ASP A 100 -13.183 0.083 -0.344 1.00 72.22 O ATOM 1445 OD2 ASP A 100 -13.949 1.466 -1.872 1.00 73.32 O ATOM 0 H ASP A 100 -9.082 1.570 -1.458 1.00 65.40 H new ATOM 0 HA ASP A 100 -10.966 -0.557 -1.150 1.00 65.01 H new ATOM 0 HB2 ASP A 100 -11.200 2.025 -0.636 1.00 23.04 H new ATOM 0 HB3 ASP A 100 -11.596 2.166 -2.337 1.00 23.04 H new ATOM 1449 N GLN A 101 -9.996 0.155 -4.151 1.00 23.32 N ATOM 1450 CA GLN A 101 -10.033 -0.372 -5.509 1.00 54.44 C ATOM 1451 C GLN A 101 -9.708 -1.870 -5.506 1.00 23.43 C ATOM 1452 O GLN A 101 -10.245 -2.604 -6.339 1.00 73.44 O ATOM 1453 CB GLN A 101 -9.122 0.401 -6.468 1.00 30.33 C ATOM 1454 CG GLN A 101 -9.469 1.902 -6.480 1.00 72.11 C ATOM 1455 CD GLN A 101 -9.275 2.569 -7.838 1.00 71.30 C ATOM 1456 OE1 GLN A 101 -8.839 1.977 -8.819 1.00 5.24 O ATOM 1457 NE2 GLN A 101 -9.623 3.836 -7.940 1.00 50.40 N ATOM 0 H GLN A 101 -9.210 0.777 -3.964 1.00 23.32 H new ATOM 0 HA GLN A 101 -11.047 -0.237 -5.884 1.00 54.44 H new ATOM 0 HB2 GLN A 101 -8.082 0.268 -6.171 1.00 30.33 H new ATOM 0 HB3 GLN A 101 -9.221 -0.006 -7.474 1.00 30.33 H new ATOM 0 HG2 GLN A 101 -10.506 2.028 -6.169 1.00 72.11 H new ATOM 0 HG3 GLN A 101 -8.851 2.414 -5.743 1.00 72.11 H new ATOM 0 HE21 GLN A 101 -9.986 4.332 -7.126 1.00 50.40 H new ATOM 0 HE22 GLN A 101 -9.529 4.320 -8.833 1.00 50.40 H new ATOM 1464 N MET A 102 -8.898 -2.361 -4.555 1.00 10.52 N ATOM 1465 CA MET A 102 -8.494 -3.766 -4.444 1.00 65.24 C ATOM 1466 C MET A 102 -9.604 -4.676 -3.887 1.00 64.34 C ATOM 1467 O MET A 102 -9.298 -5.761 -3.402 1.00 74.34 O ATOM 1468 CB MET A 102 -7.219 -3.908 -3.588 1.00 2.11 C ATOM 1469 CG MET A 102 -6.033 -3.049 -4.045 1.00 13.42 C ATOM 1470 SD MET A 102 -4.676 -2.899 -2.840 1.00 71.41 S ATOM 1471 CE MET A 102 -4.370 -4.642 -2.456 1.00 52.24 C ATOM 0 H MET A 102 -8.497 -1.774 -3.824 1.00 10.52 H new ATOM 0 HA MET A 102 -8.289 -4.099 -5.461 1.00 65.24 H new ATOM 0 HB2 MET A 102 -7.461 -3.648 -2.557 1.00 2.11 H new ATOM 0 HB3 MET A 102 -6.913 -4.954 -3.590 1.00 2.11 H new ATOM 0 HG2 MET A 102 -5.634 -3.470 -4.968 1.00 13.42 H new ATOM 0 HG3 MET A 102 -6.399 -2.050 -4.283 1.00 13.42 H new ATOM 0 HE1 MET A 102 -3.316 -4.782 -2.215 1.00 52.24 H new ATOM 0 HE2 MET A 102 -4.980 -4.939 -1.603 1.00 52.24 H new ATOM 0 HE3 MET A 102 -4.629 -5.256 -3.319 1.00 52.24 H new ATOM 1479 N LYS A 103 -10.884 -4.286 -3.926 1.00 53.24 N ATOM 1480 CA LYS A 103 -11.991 -5.053 -3.338 1.00 42.11 C ATOM 1481 C LYS A 103 -12.057 -6.517 -3.777 1.00 63.11 C ATOM 1482 O LYS A 103 -12.600 -7.341 -3.041 1.00 11.51 O ATOM 1483 CB LYS A 103 -13.332 -4.372 -3.682 1.00 11.31 C ATOM 1484 CG LYS A 103 -13.782 -3.355 -2.632 1.00 72.34 C ATOM 1485 CD LYS A 103 -14.337 -4.044 -1.383 1.00 1.15 C ATOM 1486 CE LYS A 103 -14.651 -2.974 -0.342 1.00 70.04 C ATOM 1487 NZ LYS A 103 -14.976 -3.564 0.969 1.00 64.01 N ATOM 0 H LYS A 103 -11.184 -3.419 -4.372 1.00 53.24 H new ATOM 0 HA LYS A 103 -11.803 -5.061 -2.264 1.00 42.11 H new ATOM 0 HB2 LYS A 103 -13.241 -3.872 -4.646 1.00 11.31 H new ATOM 0 HB3 LYS A 103 -14.102 -5.136 -3.791 1.00 11.31 H new ATOM 0 HG2 LYS A 103 -12.940 -2.721 -2.355 1.00 72.34 H new ATOM 0 HG3 LYS A 103 -14.545 -2.704 -3.059 1.00 72.34 H new ATOM 0 HD2 LYS A 103 -15.236 -4.609 -1.629 1.00 1.15 H new ATOM 0 HD3 LYS A 103 -13.612 -4.756 -0.989 1.00 1.15 H new ATOM 0 HE2 LYS A 103 -13.796 -2.306 -0.238 1.00 70.04 H new ATOM 0 HE3 LYS A 103 -15.489 -2.368 -0.685 1.00 70.04 H new ATOM 0 HZ1 LYS A 103 -15.183 -2.805 1.649 1.00 64.01 H new ATOM 0 HZ2 LYS A 103 -15.807 -4.182 0.875 1.00 64.01 H new ATOM 0 HZ3 LYS A 103 -14.167 -4.122 1.309 1.00 64.01 H new ATOM 1497 N ASN A 104 -11.533 -6.850 -4.955 1.00 53.21 N ATOM 1498 CA ASN A 104 -11.561 -8.187 -5.532 1.00 65.13 C ATOM 1499 C ASN A 104 -10.142 -8.725 -5.657 1.00 14.45 C ATOM 1500 O ASN A 104 -9.803 -9.360 -6.652 1.00 50.31 O ATOM 1501 CB ASN A 104 -12.306 -8.175 -6.874 1.00 50.20 C ATOM 1502 CG ASN A 104 -13.755 -7.790 -6.675 1.00 4.41 C ATOM 1503 OD1 ASN A 104 -14.595 -8.612 -6.327 1.00 13.31 O ATOM 1504 ND2 ASN A 104 -14.090 -6.527 -6.864 1.00 72.00 N ATOM 0 H ASN A 104 -11.062 -6.171 -5.552 1.00 53.21 H new ATOM 0 HA ASN A 104 -12.109 -8.860 -4.873 1.00 65.13 H new ATOM 0 HB2 ASN A 104 -11.828 -7.472 -7.555 1.00 50.20 H new ATOM 0 HB3 ASN A 104 -12.246 -9.159 -7.338 1.00 50.20 H new ATOM 0 HD21 ASN A 104 -15.055 -6.228 -6.720 1.00 72.00 H new ATOM 0 HD22 ASN A 104 -13.384 -5.850 -7.154 1.00 72.00 H new ATOM 1510 N TYR A 105 -9.273 -8.413 -4.697 1.00 25.43 N ATOM 1511 CA TYR A 105 -7.983 -9.068 -4.590 1.00 13.41 C ATOM 1512 C TYR A 105 -8.215 -10.575 -4.353 1.00 73.13 C ATOM 1513 O TYR A 105 -9.159 -10.984 -3.668 1.00 5.54 O ATOM 1514 CB TYR A 105 -7.166 -8.362 -3.494 1.00 24.25 C ATOM 1515 CG TYR A 105 -7.485 -8.775 -2.072 1.00 70.44 C ATOM 1516 CD1 TYR A 105 -8.668 -8.342 -1.439 1.00 72.44 C ATOM 1517 CD2 TYR A 105 -6.598 -9.618 -1.381 1.00 44.35 C ATOM 1518 CE1 TYR A 105 -8.964 -8.756 -0.131 1.00 32.45 C ATOM 1519 CE2 TYR A 105 -6.880 -10.022 -0.069 1.00 1.52 C ATOM 1520 CZ TYR A 105 -8.070 -9.602 0.554 1.00 53.23 C ATOM 1521 OH TYR A 105 -8.362 -10.026 1.806 1.00 30.11 O ATOM 0 H TYR A 105 -9.446 -7.706 -3.982 1.00 25.43 H new ATOM 0 HA TYR A 105 -7.396 -8.991 -5.505 1.00 13.41 H new ATOM 0 HB2 TYR A 105 -6.108 -8.547 -3.678 1.00 24.25 H new ATOM 0 HB3 TYR A 105 -7.322 -7.287 -3.585 1.00 24.25 H new ATOM 0 HD1 TYR A 105 -9.350 -7.689 -1.963 1.00 72.44 H new ATOM 0 HD2 TYR A 105 -5.693 -9.957 -1.864 1.00 44.35 H new ATOM 0 HE1 TYR A 105 -9.874 -8.427 0.349 1.00 32.45 H new ATOM 0 HE2 TYR A 105 -6.185 -10.655 0.463 1.00 1.52 H new ATOM 0 HH TYR A 105 -8.254 -10.999 1.856 1.00 30.11 H new ATOM 1530 N ARG A 106 -7.370 -11.414 -4.947 1.00 65.11 N ATOM 1531 CA ARG A 106 -7.463 -12.877 -4.979 1.00 65.04 C ATOM 1532 C ARG A 106 -6.176 -13.505 -4.463 1.00 3.43 C ATOM 1533 O ARG A 106 -5.795 -14.601 -4.871 1.00 2.34 O ATOM 1534 CB ARG A 106 -7.780 -13.331 -6.416 1.00 3.22 C ATOM 1535 CG ARG A 106 -9.134 -12.827 -6.930 1.00 52.12 C ATOM 1536 CD ARG A 106 -10.325 -13.718 -6.567 1.00 13.40 C ATOM 1537 NE ARG A 106 -10.286 -14.241 -5.191 1.00 2.51 N ATOM 1538 CZ ARG A 106 -10.306 -15.535 -4.851 1.00 54.22 C ATOM 1539 NH1 ARG A 106 -10.737 -16.460 -5.704 1.00 43.45 N ATOM 1540 NH2 ARG A 106 -9.890 -15.898 -3.649 1.00 23.41 N ATOM 0 H ARG A 106 -6.551 -11.073 -5.450 1.00 65.11 H new ATOM 0 HA ARG A 106 -8.268 -13.209 -4.324 1.00 65.04 H new ATOM 0 HB2 ARG A 106 -6.993 -12.978 -7.082 1.00 3.22 H new ATOM 0 HB3 ARG A 106 -7.767 -14.420 -6.456 1.00 3.22 H new ATOM 0 HG2 ARG A 106 -9.310 -11.828 -6.532 1.00 52.12 H new ATOM 0 HG3 ARG A 106 -9.084 -12.734 -8.015 1.00 52.12 H new ATOM 0 HD2 ARG A 106 -11.245 -13.150 -6.702 1.00 13.40 H new ATOM 0 HD3 ARG A 106 -10.363 -14.557 -7.262 1.00 13.40 H new ATOM 0 HE ARG A 106 -10.240 -13.560 -4.433 1.00 2.51 H new ATOM 0 HH11 ARG A 106 -11.059 -16.187 -6.633 1.00 43.45 H new ATOM 0 HH12 ARG A 106 -10.746 -17.442 -5.429 1.00 43.45 H new ATOM 0 HH21 ARG A 106 -9.558 -15.194 -2.990 1.00 23.41 H new ATOM 0 HH22 ARG A 106 -9.902 -16.882 -3.381 1.00 23.41 H new ATOM 1551 N GLY A 107 -5.498 -12.794 -3.578 1.00 10.50 N ATOM 1552 CA GLY A 107 -4.157 -13.067 -3.138 1.00 64.14 C ATOM 1553 C GLY A 107 -4.010 -12.566 -1.716 1.00 25.33 C ATOM 1554 O GLY A 107 -5.007 -12.493 -0.992 1.00 4.53 O ATOM 0 H GLY A 107 -5.897 -11.970 -3.129 1.00 10.50 H new ATOM 0 HA2 GLY A 107 -3.952 -14.136 -3.187 1.00 64.14 H new ATOM 0 HA3 GLY A 107 -3.436 -12.574 -3.790 1.00 64.14 H new ATOM 1558 N GLU A 108 -2.794 -12.196 -1.326 1.00 12.51 N ATOM 1559 CA GLU A 108 -2.477 -11.632 -0.017 1.00 14.23 C ATOM 1560 C GLU A 108 -2.070 -10.166 -0.160 1.00 34.21 C ATOM 1561 O GLU A 108 -1.680 -9.751 -1.259 1.00 53.51 O ATOM 1562 CB GLU A 108 -1.333 -12.432 0.610 1.00 3.42 C ATOM 1563 CG GLU A 108 -1.790 -13.829 1.027 1.00 63.32 C ATOM 1564 CD GLU A 108 -0.709 -14.632 1.753 1.00 22.10 C ATOM 1565 OE1 GLU A 108 0.479 -14.569 1.361 1.00 45.31 O ATOM 1566 OE2 GLU A 108 -1.090 -15.358 2.699 1.00 4.31 O ATOM 0 H GLU A 108 -1.977 -12.283 -1.930 1.00 12.51 H new ATOM 0 HA GLU A 108 -3.357 -11.688 0.624 1.00 14.23 H new ATOM 0 HB2 GLU A 108 -0.512 -12.514 -0.102 1.00 3.42 H new ATOM 0 HB3 GLU A 108 -0.949 -11.899 1.480 1.00 3.42 H new ATOM 0 HG2 GLU A 108 -2.662 -13.739 1.675 1.00 63.32 H new ATOM 0 HG3 GLU A 108 -2.107 -14.379 0.141 1.00 63.32 H new ATOM 1571 N VAL A 109 -2.143 -9.384 0.924 1.00 31.43 N ATOM 1572 CA VAL A 109 -1.684 -7.996 0.913 1.00 13.32 C ATOM 1573 C VAL A 109 -0.543 -7.817 1.920 1.00 22.45 C ATOM 1574 O VAL A 109 -0.655 -8.165 3.105 1.00 1.13 O ATOM 1575 CB VAL A 109 -2.854 -7.020 1.155 1.00 61.44 C ATOM 1576 CG1 VAL A 109 -2.444 -5.603 0.729 1.00 4.42 C ATOM 1577 CG2 VAL A 109 -4.119 -7.395 0.356 1.00 23.33 C ATOM 0 H VAL A 109 -2.517 -9.693 1.821 1.00 31.43 H new ATOM 0 HA VAL A 109 -1.290 -7.756 -0.075 1.00 13.32 H new ATOM 0 HB VAL A 109 -3.083 -7.073 2.219 1.00 61.44 H new ATOM 0 HG11 VAL A 109 -3.273 -4.917 0.902 1.00 4.42 H new ATOM 0 HG12 VAL A 109 -1.581 -5.283 1.313 1.00 4.42 H new ATOM 0 HG13 VAL A 109 -2.186 -5.602 -0.330 1.00 4.42 H new ATOM 0 HG21 VAL A 109 -4.909 -6.674 0.566 1.00 23.33 H new ATOM 0 HG22 VAL A 109 -3.892 -7.385 -0.710 1.00 23.33 H new ATOM 0 HG23 VAL A 109 -4.451 -8.392 0.647 1.00 23.33 H new ATOM 1587 N ALA A 110 0.561 -7.234 1.451 1.00 61.23 N ATOM 1588 CA ALA A 110 1.665 -6.759 2.273 1.00 74.10 C ATOM 1589 C ALA A 110 2.045 -5.358 1.784 1.00 54.20 C ATOM 1590 O ALA A 110 1.743 -5.019 0.639 1.00 3.44 O ATOM 1591 CB ALA A 110 2.820 -7.757 2.173 1.00 33.31 C ATOM 0 H ALA A 110 0.712 -7.076 0.455 1.00 61.23 H new ATOM 0 HA ALA A 110 1.393 -6.688 3.326 1.00 74.10 H new ATOM 0 HB1 ALA A 110 3.653 -7.412 2.785 1.00 33.31 H new ATOM 0 HB2 ALA A 110 2.489 -8.733 2.528 1.00 33.31 H new ATOM 0 HB3 ALA A 110 3.142 -7.838 1.135 1.00 33.31 H new ATOM 1597 N SER A 111 2.690 -4.520 2.601 1.00 34.44 N ATOM 1598 CA SER A 111 2.854 -3.119 2.246 1.00 73.11 C ATOM 1599 C SER A 111 4.113 -2.588 2.924 1.00 4.14 C ATOM 1600 O SER A 111 4.176 -2.543 4.156 1.00 22.32 O ATOM 1601 CB SER A 111 1.557 -2.400 2.648 1.00 4.44 C ATOM 1602 OG SER A 111 1.638 -0.995 2.530 1.00 31.41 O ATOM 0 H SER A 111 3.099 -4.787 3.497 1.00 34.44 H new ATOM 0 HA SER A 111 3.002 -2.954 1.179 1.00 73.11 H new ATOM 0 HB2 SER A 111 0.740 -2.764 2.025 1.00 4.44 H new ATOM 0 HB3 SER A 111 1.311 -2.658 3.678 1.00 4.44 H new ATOM 0 HG SER A 111 0.864 -0.585 2.970 1.00 31.41 H new ATOM 1607 N PHE A 112 5.113 -2.229 2.115 1.00 54.21 N ATOM 1608 CA PHE A 112 6.498 -2.043 2.498 1.00 50.22 C ATOM 1609 C PHE A 112 6.942 -0.602 2.206 1.00 63.32 C ATOM 1610 O PHE A 112 6.813 -0.093 1.091 1.00 54.43 O ATOM 1611 CB PHE A 112 7.362 -3.125 1.809 1.00 30.33 C ATOM 1612 CG PHE A 112 7.725 -2.866 0.376 1.00 53.12 C ATOM 1613 CD1 PHE A 112 6.801 -3.161 -0.636 1.00 43.10 C ATOM 1614 CD2 PHE A 112 8.987 -2.332 0.063 1.00 51.41 C ATOM 1615 CE1 PHE A 112 7.154 -2.941 -1.970 1.00 43.13 C ATOM 1616 CE2 PHE A 112 9.335 -2.123 -1.278 1.00 70.23 C ATOM 1617 CZ PHE A 112 8.433 -2.474 -2.297 1.00 11.44 C ATOM 0 H PHE A 112 4.960 -2.053 1.122 1.00 54.21 H new ATOM 0 HA PHE A 112 6.627 -2.175 3.572 1.00 50.22 H new ATOM 0 HB2 PHE A 112 8.283 -3.244 2.380 1.00 30.33 H new ATOM 0 HB3 PHE A 112 6.829 -4.074 1.862 1.00 30.33 H new ATOM 0 HD1 PHE A 112 5.826 -3.554 -0.387 1.00 43.10 H new ATOM 0 HD2 PHE A 112 9.683 -2.085 0.851 1.00 51.41 H new ATOM 0 HE1 PHE A 112 6.436 -3.132 -2.754 1.00 43.13 H new ATOM 0 HE2 PHE A 112 10.294 -1.693 -1.528 1.00 70.23 H new ATOM 0 HZ PHE A 112 8.726 -2.384 -3.332 1.00 11.44 H new ATOM 1626 N PHE A 113 7.458 0.076 3.229 1.00 64.11 N ATOM 1627 CA PHE A 113 8.000 1.424 3.165 1.00 74.12 C ATOM 1628 C PHE A 113 9.521 1.373 3.334 1.00 14.53 C ATOM 1629 O PHE A 113 10.060 0.432 3.929 1.00 14.23 O ATOM 1630 CB PHE A 113 7.327 2.281 4.243 1.00 31.15 C ATOM 1631 CG PHE A 113 7.892 2.126 5.639 1.00 54.10 C ATOM 1632 CD1 PHE A 113 7.700 0.950 6.385 1.00 42.34 C ATOM 1633 CD2 PHE A 113 8.661 3.169 6.173 1.00 21.03 C ATOM 1634 CE1 PHE A 113 8.323 0.801 7.635 1.00 64.33 C ATOM 1635 CE2 PHE A 113 9.242 3.043 7.441 1.00 4.54 C ATOM 1636 CZ PHE A 113 9.102 1.848 8.157 1.00 23.14 C ATOM 0 H PHE A 113 7.510 -0.321 4.167 1.00 64.11 H new ATOM 0 HA PHE A 113 7.795 1.877 2.195 1.00 74.12 H new ATOM 0 HB2 PHE A 113 7.404 3.329 3.952 1.00 31.15 H new ATOM 0 HB3 PHE A 113 6.265 2.035 4.269 1.00 31.15 H new ATOM 0 HD1 PHE A 113 7.073 0.161 5.997 1.00 42.34 H new ATOM 0 HD2 PHE A 113 8.806 4.075 5.603 1.00 21.03 H new ATOM 0 HE1 PHE A 113 8.204 -0.116 8.194 1.00 64.33 H new ATOM 0 HE2 PHE A 113 9.797 3.866 7.866 1.00 4.54 H new ATOM 0 HZ PHE A 113 9.593 1.731 9.112 1.00 23.14 H new ATOM 1645 N THR A 114 10.207 2.407 2.858 1.00 52.30 N ATOM 1646 CA THR A 114 11.662 2.474 2.708 1.00 23.33 C ATOM 1647 C THR A 114 12.222 3.730 3.395 1.00 42.11 C ATOM 1648 O THR A 114 13.288 4.234 3.040 1.00 21.43 O ATOM 1649 CB THR A 114 11.974 2.398 1.198 1.00 71.04 C ATOM 1650 OG1 THR A 114 11.100 3.248 0.470 1.00 31.44 O ATOM 1651 CG2 THR A 114 11.792 0.967 0.683 1.00 25.24 C ATOM 0 H THR A 114 9.745 3.263 2.551 1.00 52.30 H new ATOM 0 HA THR A 114 12.156 1.639 3.204 1.00 23.33 H new ATOM 0 HB THR A 114 13.007 2.714 1.055 1.00 71.04 H new ATOM 0 HG1 THR A 114 11.310 3.192 -0.486 1.00 31.44 H new ATOM 0 HG21 THR A 114 12.016 0.933 -0.383 1.00 25.24 H new ATOM 0 HG22 THR A 114 12.468 0.299 1.218 1.00 25.24 H new ATOM 0 HG23 THR A 114 10.762 0.649 0.848 1.00 25.24 H new ATOM 1659 N SER A 115 11.485 4.255 4.376 1.00 12.51 N ATOM 1660 CA SER A 115 11.699 5.550 5.004 1.00 43.13 C ATOM 1661 C SER A 115 11.767 5.385 6.523 1.00 23.02 C ATOM 1662 O SER A 115 11.082 6.080 7.269 1.00 22.31 O ATOM 1663 CB SER A 115 10.558 6.476 4.577 1.00 14.54 C ATOM 1664 OG SER A 115 10.715 6.935 3.250 1.00 11.33 O ATOM 0 H SER A 115 10.685 3.760 4.770 1.00 12.51 H new ATOM 0 HA SER A 115 12.646 5.988 4.689 1.00 43.13 H new ATOM 0 HB2 SER A 115 9.609 5.947 4.667 1.00 14.54 H new ATOM 0 HB3 SER A 115 10.513 7.330 5.253 1.00 14.54 H new ATOM 0 HG SER A 115 9.966 7.521 3.016 1.00 11.33 H new ATOM 1669 N ALA A 116 12.560 4.435 7.010 1.00 73.41 N ATOM 1670 CA ALA A 116 12.652 4.146 8.442 1.00 11.21 C ATOM 1671 C ALA A 116 13.346 5.246 9.260 1.00 62.20 C ATOM 1672 O ALA A 116 13.342 5.158 10.489 1.00 52.52 O ATOM 1673 CB ALA A 116 13.352 2.802 8.647 1.00 32.23 C ATOM 0 H ALA A 116 13.155 3.845 6.428 1.00 73.41 H new ATOM 0 HA ALA A 116 11.630 4.104 8.818 1.00 11.21 H new ATOM 0 HB1 ALA A 116 13.421 2.586 9.713 1.00 32.23 H new ATOM 0 HB2 ALA A 116 12.781 2.015 8.154 1.00 32.23 H new ATOM 0 HB3 ALA A 116 14.354 2.845 8.220 1.00 32.23 H new ATOM 1679 N GLY A 117 13.944 6.259 8.627 1.00 31.15 N ATOM 1680 CA GLY A 117 14.946 7.121 9.247 1.00 72.30 C ATOM 1681 C GLY A 117 14.473 7.960 10.437 1.00 1.34 C ATOM 1682 O GLY A 117 15.322 8.505 11.154 1.00 5.24 O ATOM 0 H GLY A 117 13.741 6.504 7.658 1.00 31.15 H new ATOM 0 HA2 GLY A 117 15.778 6.498 9.576 1.00 72.30 H new ATOM 0 HA3 GLY A 117 15.336 7.796 8.485 1.00 72.30 H new ATOM 1686 N THR A 118 13.166 8.138 10.672 1.00 12.12 N ATOM 1687 CA THR A 118 12.688 8.729 11.926 1.00 13.45 C ATOM 1688 C THR A 118 11.291 8.238 12.365 1.00 2.23 C ATOM 1689 O THR A 118 10.698 8.830 13.272 1.00 13.54 O ATOM 1690 CB THR A 118 12.784 10.277 11.876 1.00 11.31 C ATOM 1691 OG1 THR A 118 13.742 10.764 10.946 1.00 21.14 O ATOM 1692 CG2 THR A 118 13.244 10.812 13.232 1.00 13.24 C ATOM 0 H THR A 118 12.428 7.883 10.016 1.00 12.12 H new ATOM 0 HA THR A 118 13.358 8.370 12.708 1.00 13.45 H new ATOM 0 HB THR A 118 11.787 10.610 11.587 1.00 11.31 H new ATOM 0 HG1 THR A 118 14.124 11.603 11.279 1.00 21.14 H new ATOM 0 HG21 THR A 118 13.310 11.899 13.191 1.00 13.24 H new ATOM 0 HG22 THR A 118 12.528 10.520 14.000 1.00 13.24 H new ATOM 0 HG23 THR A 118 14.223 10.398 13.473 1.00 13.24 H new ATOM 1700 N ASN A 119 10.726 7.197 11.739 1.00 73.44 N ATOM 1701 CA ASN A 119 9.369 6.705 12.001 1.00 23.22 C ATOM 1702 C ASN A 119 9.272 5.294 11.421 1.00 10.32 C ATOM 1703 O ASN A 119 9.571 5.096 10.246 1.00 3.53 O ATOM 1704 CB ASN A 119 8.364 7.653 11.325 1.00 53.32 C ATOM 1705 CG ASN A 119 6.986 7.573 11.940 1.00 70.14 C ATOM 1706 OD1 ASN A 119 6.058 7.091 11.312 1.00 41.41 O ATOM 1707 ND2 ASN A 119 6.805 8.062 13.158 1.00 31.04 N ATOM 0 H ASN A 119 11.212 6.662 11.020 1.00 73.44 H new ATOM 0 HA ASN A 119 9.146 6.674 13.068 1.00 23.22 H new ATOM 0 HB2 ASN A 119 8.731 8.677 11.397 1.00 53.32 H new ATOM 0 HB3 ASN A 119 8.299 7.411 10.264 1.00 53.32 H new ATOM 0 HD21 ASN A 119 5.879 8.039 13.584 1.00 31.04 H new ATOM 0 HD22 ASN A 119 7.592 8.461 13.669 1.00 31.04 H new ATOM 1713 N HIS A 120 8.918 4.301 12.241 1.00 31.42 N ATOM 1714 CA HIS A 120 8.759 2.909 11.817 1.00 41.13 C ATOM 1715 C HIS A 120 7.657 2.245 12.637 1.00 42.14 C ATOM 1716 O HIS A 120 6.621 1.886 12.077 1.00 11.32 O ATOM 1717 CB HIS A 120 10.092 2.150 11.931 1.00 23.35 C ATOM 1718 CG HIS A 120 9.996 0.643 11.831 1.00 10.23 C ATOM 1719 ND1 HIS A 120 10.714 -0.250 12.595 1.00 43.32 N ATOM 1720 CD2 HIS A 120 9.147 -0.088 11.041 1.00 45.23 C ATOM 1721 CE1 HIS A 120 10.303 -1.489 12.274 1.00 14.13 C ATOM 1722 NE2 HIS A 120 9.370 -1.439 11.312 1.00 65.23 N ATOM 0 H HIS A 120 8.731 4.445 13.233 1.00 31.42 H new ATOM 0 HA HIS A 120 8.465 2.883 10.768 1.00 41.13 H new ATOM 0 HB2 HIS A 120 10.761 2.506 11.148 1.00 23.35 H new ATOM 0 HB3 HIS A 120 10.554 2.404 12.885 1.00 23.35 H new ATOM 0 HD2 HIS A 120 8.433 0.310 10.335 1.00 45.23 H new ATOM 0 HE1 HIS A 120 10.672 -2.397 12.727 1.00 14.13 H new ATOM 0 HE2 HIS A 120 8.912 -2.234 10.865 1.00 65.23 H new ATOM 1729 N LYS A 121 7.847 2.105 13.958 1.00 2.53 N ATOM 1730 CA LYS A 121 6.841 1.491 14.835 1.00 71.31 C ATOM 1731 C LYS A 121 5.504 2.211 14.667 1.00 62.30 C ATOM 1732 O LYS A 121 4.469 1.553 14.605 1.00 64.11 O ATOM 1733 CB LYS A 121 7.330 1.470 16.297 1.00 5.43 C ATOM 1734 CG LYS A 121 6.760 0.333 17.172 1.00 14.54 C ATOM 1735 CD LYS A 121 5.311 0.496 17.670 1.00 71.11 C ATOM 1736 CE LYS A 121 4.839 -0.751 18.437 1.00 22.01 C ATOM 1737 NZ LYS A 121 4.516 -1.891 17.543 1.00 14.35 N ATOM 0 H LYS A 121 8.691 2.410 14.442 1.00 2.53 H new ATOM 0 HA LYS A 121 6.690 0.450 14.548 1.00 71.31 H new ATOM 0 HB2 LYS A 121 8.417 1.395 16.297 1.00 5.43 H new ATOM 0 HB3 LYS A 121 7.076 2.423 16.760 1.00 5.43 H new ATOM 0 HG2 LYS A 121 6.821 -0.595 16.604 1.00 14.54 H new ATOM 0 HG3 LYS A 121 7.407 0.218 18.042 1.00 14.54 H new ATOM 0 HD2 LYS A 121 5.243 1.371 18.317 1.00 71.11 H new ATOM 0 HD3 LYS A 121 4.651 0.675 16.821 1.00 71.11 H new ATOM 0 HE2 LYS A 121 5.615 -1.055 19.139 1.00 22.01 H new ATOM 0 HE3 LYS A 121 3.958 -0.497 19.026 1.00 22.01 H new ATOM 0 HZ1 LYS A 121 4.204 -2.702 18.114 1.00 14.35 H new ATOM 0 HZ2 LYS A 121 3.756 -1.615 16.889 1.00 14.35 H new ATOM 0 HZ3 LYS A 121 5.362 -2.156 16.999 1.00 14.35 H new ATOM 1747 N ALA A 122 5.540 3.541 14.512 1.00 25.24 N ATOM 1748 CA ALA A 122 4.368 4.347 14.247 1.00 4.33 C ATOM 1749 C ALA A 122 3.610 3.830 13.024 1.00 23.33 C ATOM 1750 O ALA A 122 2.463 3.410 13.138 1.00 3.22 O ATOM 1751 CB ALA A 122 4.885 5.758 14.030 1.00 12.25 C ATOM 0 H ALA A 122 6.402 4.083 14.570 1.00 25.24 H new ATOM 0 HA ALA A 122 3.657 4.310 15.072 1.00 4.33 H new ATOM 0 HB1 ALA A 122 4.048 6.425 13.823 1.00 12.25 H new ATOM 0 HB2 ALA A 122 5.406 6.096 14.926 1.00 12.25 H new ATOM 0 HB3 ALA A 122 5.573 5.767 13.185 1.00 12.25 H new ATOM 1757 N TYR A 123 4.272 3.833 11.868 1.00 12.15 N ATOM 1758 CA TYR A 123 3.727 3.474 10.569 1.00 62.43 C ATOM 1759 C TYR A 123 3.046 2.098 10.600 1.00 32.15 C ATOM 1760 O TYR A 123 1.921 1.964 10.131 1.00 74.04 O ATOM 1761 CB TYR A 123 4.874 3.542 9.555 1.00 1.34 C ATOM 1762 CG TYR A 123 4.466 3.358 8.111 1.00 50.54 C ATOM 1763 CD1 TYR A 123 3.982 4.447 7.355 1.00 70.01 C ATOM 1764 CD2 TYR A 123 4.614 2.093 7.510 1.00 34.44 C ATOM 1765 CE1 TYR A 123 3.684 4.283 5.991 1.00 52.42 C ATOM 1766 CE2 TYR A 123 4.307 1.925 6.152 1.00 21.04 C ATOM 1767 CZ TYR A 123 3.857 3.021 5.385 1.00 52.42 C ATOM 1768 OH TYR A 123 3.620 2.869 4.059 1.00 21.32 O ATOM 0 H TYR A 123 5.255 4.101 11.815 1.00 12.15 H new ATOM 0 HA TYR A 123 2.942 4.172 10.278 1.00 62.43 H new ATOM 0 HB2 TYR A 123 5.370 4.507 9.656 1.00 1.34 H new ATOM 0 HB3 TYR A 123 5.608 2.778 9.809 1.00 1.34 H new ATOM 0 HD1 TYR A 123 3.840 5.409 7.826 1.00 70.01 H new ATOM 0 HD2 TYR A 123 4.963 1.254 8.094 1.00 34.44 H new ATOM 0 HE1 TYR A 123 3.324 5.119 5.410 1.00 52.42 H new ATOM 0 HE2 TYR A 123 4.415 0.954 5.692 1.00 21.04 H new ATOM 0 HH TYR A 123 3.788 1.938 3.801 1.00 21.32 H new ATOM 1777 N VAL A 124 3.674 1.090 11.214 1.00 54.43 N ATOM 1778 CA VAL A 124 3.141 -0.273 11.342 1.00 54.11 C ATOM 1779 C VAL A 124 1.814 -0.318 12.131 1.00 41.30 C ATOM 1780 O VAL A 124 1.076 -1.303 12.062 1.00 54.23 O ATOM 1781 CB VAL A 124 4.220 -1.133 12.033 1.00 32.24 C ATOM 1782 CG1 VAL A 124 3.747 -2.563 12.324 1.00 44.32 C ATOM 1783 CG2 VAL A 124 5.510 -1.261 11.199 1.00 44.50 C ATOM 0 H VAL A 124 4.591 1.201 11.647 1.00 54.43 H new ATOM 0 HA VAL A 124 2.910 -0.662 10.350 1.00 54.11 H new ATOM 0 HB VAL A 124 4.419 -0.600 12.963 1.00 32.24 H new ATOM 0 HG11 VAL A 124 4.548 -3.119 12.810 1.00 44.32 H new ATOM 0 HG12 VAL A 124 2.877 -2.532 12.980 1.00 44.32 H new ATOM 0 HG13 VAL A 124 3.479 -3.055 11.389 1.00 44.32 H new ATOM 0 HG21 VAL A 124 6.231 -1.877 11.736 1.00 44.50 H new ATOM 0 HG22 VAL A 124 5.279 -1.726 10.241 1.00 44.50 H new ATOM 0 HG23 VAL A 124 5.933 -0.271 11.029 1.00 44.50 H new ATOM 1793 N SER A 125 1.489 0.693 12.922 1.00 74.02 N ATOM 1794 CA SER A 125 0.244 0.761 13.676 1.00 54.20 C ATOM 1795 C SER A 125 -0.721 1.689 12.926 1.00 44.30 C ATOM 1796 O SER A 125 -1.845 1.296 12.637 1.00 54.23 O ATOM 1797 CB SER A 125 0.616 1.197 15.100 1.00 5.41 C ATOM 1798 OG SER A 125 -0.207 0.616 16.093 1.00 3.32 O ATOM 0 H SER A 125 2.092 1.504 13.061 1.00 74.02 H new ATOM 0 HA SER A 125 -0.284 -0.189 13.765 1.00 54.20 H new ATOM 0 HB2 SER A 125 1.654 0.929 15.295 1.00 5.41 H new ATOM 0 HB3 SER A 125 0.548 2.283 15.170 1.00 5.41 H new ATOM 0 HG SER A 125 0.077 0.928 16.977 1.00 3.32 H new ATOM 1803 N HIS A 126 -0.259 2.866 12.503 1.00 65.04 N ATOM 1804 CA HIS A 126 -1.014 3.833 11.721 1.00 61.43 C ATOM 1805 C HIS A 126 -1.610 3.235 10.440 1.00 64.33 C ATOM 1806 O HIS A 126 -2.785 3.459 10.159 1.00 31.12 O ATOM 1807 CB HIS A 126 -0.077 4.987 11.358 1.00 30.31 C ATOM 1808 CG HIS A 126 0.416 5.863 12.486 1.00 14.11 C ATOM 1809 ND1 HIS A 126 -0.205 6.194 13.668 1.00 54.34 N ATOM 1810 CD2 HIS A 126 1.603 6.530 12.468 1.00 34.23 C ATOM 1811 CE1 HIS A 126 0.609 7.032 14.337 1.00 1.41 C ATOM 1812 NE2 HIS A 126 1.730 7.281 13.642 1.00 53.30 N ATOM 0 H HIS A 126 0.690 3.180 12.706 1.00 65.04 H new ATOM 0 HA HIS A 126 -1.855 4.173 12.326 1.00 61.43 H new ATOM 0 HB2 HIS A 126 0.793 4.568 10.852 1.00 30.31 H new ATOM 0 HB3 HIS A 126 -0.590 5.623 10.637 1.00 30.31 H new ATOM 0 HD2 HIS A 126 2.332 6.486 11.672 1.00 34.23 H new ATOM 0 HE1 HIS A 126 0.388 7.450 15.308 1.00 1.41 H new ATOM 0 HE2 HIS A 126 2.506 7.886 13.911 1.00 53.30 H new ATOM 1819 N PHE A 127 -0.819 2.502 9.648 1.00 3.23 N ATOM 1820 CA PHE A 127 -1.289 1.885 8.410 1.00 1.23 C ATOM 1821 C PHE A 127 -2.421 0.907 8.703 1.00 44.22 C ATOM 1822 O PHE A 127 -3.423 0.928 7.992 1.00 25.24 O ATOM 1823 CB PHE A 127 -0.124 1.193 7.683 1.00 61.24 C ATOM 1824 CG PHE A 127 -0.532 0.354 6.481 1.00 42.51 C ATOM 1825 CD1 PHE A 127 -1.278 0.909 5.422 1.00 54.43 C ATOM 1826 CD2 PHE A 127 -0.179 -1.006 6.431 1.00 5.45 C ATOM 1827 CE1 PHE A 127 -1.624 0.115 4.314 1.00 12.54 C ATOM 1828 CE2 PHE A 127 -0.548 -1.806 5.338 1.00 3.55 C ATOM 1829 CZ PHE A 127 -1.251 -1.237 4.265 1.00 41.34 C ATOM 0 H PHE A 127 0.164 2.322 9.850 1.00 3.23 H new ATOM 0 HA PHE A 127 -1.680 2.661 7.752 1.00 1.23 H new ATOM 0 HB2 PHE A 127 0.584 1.954 7.354 1.00 61.24 H new ATOM 0 HB3 PHE A 127 0.401 0.554 8.393 1.00 61.24 H new ATOM 0 HD1 PHE A 127 -1.584 1.944 5.461 1.00 54.43 H new ATOM 0 HD2 PHE A 127 0.383 -1.441 7.244 1.00 5.45 H new ATOM 0 HE1 PHE A 127 -2.180 0.548 3.496 1.00 12.54 H new ATOM 0 HE2 PHE A 127 -0.292 -2.855 5.323 1.00 3.55 H new ATOM 0 HZ PHE A 127 -1.504 -1.838 3.404 1.00 41.34 H new ATOM 1838 N ASN A 128 -2.297 0.118 9.779 1.00 50.22 N ATOM 1839 CA ASN A 128 -3.316 -0.855 10.155 1.00 73.41 C ATOM 1840 C ASN A 128 -4.672 -0.178 10.343 1.00 54.20 C ATOM 1841 O ASN A 128 -5.675 -0.739 9.914 1.00 13.41 O ATOM 1842 CB ASN A 128 -2.910 -1.671 11.404 1.00 72.13 C ATOM 1843 CG ASN A 128 -2.016 -2.866 11.092 1.00 2.42 C ATOM 1844 OD1 ASN A 128 -1.952 -3.364 9.975 1.00 45.40 O ATOM 1845 ND2 ASN A 128 -1.211 -3.325 12.029 1.00 30.32 N ATOM 0 H ASN A 128 -1.492 0.140 10.405 1.00 50.22 H new ATOM 0 HA ASN A 128 -3.406 -1.566 9.334 1.00 73.41 H new ATOM 0 HB2 ASN A 128 -2.393 -1.014 12.104 1.00 72.13 H new ATOM 0 HB3 ASN A 128 -3.811 -2.024 11.905 1.00 72.13 H new ATOM 0 HD21 ASN A 128 -0.556 -4.077 11.815 1.00 30.32 H new ATOM 0 HD22 ASN A 128 -1.243 -2.928 12.968 1.00 30.32 H new ATOM 1851 N GLU A 129 -4.718 1.028 10.917 1.00 64.21 N ATOM 1852 CA GLU A 129 -5.959 1.776 11.113 1.00 51.31 C ATOM 1853 C GLU A 129 -6.592 2.272 9.818 1.00 12.11 C ATOM 1854 O GLU A 129 -7.788 2.570 9.760 1.00 52.42 O ATOM 1855 CB GLU A 129 -5.701 3.029 11.951 1.00 12.35 C ATOM 1856 CG GLU A 129 -5.003 2.830 13.296 1.00 4.22 C ATOM 1857 CD GLU A 129 -5.545 1.694 14.168 1.00 54.53 C ATOM 1858 OE1 GLU A 129 -6.748 1.347 14.068 1.00 41.53 O ATOM 1859 OE2 GLU A 129 -4.741 1.167 14.964 1.00 32.04 O ATOM 0 H GLU A 129 -3.889 1.514 11.260 1.00 64.21 H new ATOM 0 HA GLU A 129 -6.631 1.069 11.599 1.00 51.31 H new ATOM 0 HB2 GLU A 129 -5.101 3.717 11.356 1.00 12.35 H new ATOM 0 HB3 GLU A 129 -6.658 3.517 12.134 1.00 12.35 H new ATOM 0 HG2 GLU A 129 -3.945 2.647 13.111 1.00 4.22 H new ATOM 0 HG3 GLU A 129 -5.072 3.760 13.860 1.00 4.22 H new ATOM 1864 N TRP A 130 -5.770 2.457 8.797 1.00 4.23 N ATOM 1865 CA TRP A 130 -6.180 2.965 7.504 1.00 13.31 C ATOM 1866 C TRP A 130 -6.469 1.838 6.521 1.00 32.02 C ATOM 1867 O TRP A 130 -7.060 2.115 5.477 1.00 22.01 O ATOM 1868 CB TRP A 130 -5.129 3.954 6.995 1.00 74.10 C ATOM 1869 CG TRP A 130 -5.066 5.271 7.720 1.00 62.43 C ATOM 1870 CD1 TRP A 130 -5.748 5.627 8.836 1.00 22.35 C ATOM 1871 CD2 TRP A 130 -4.277 6.440 7.369 1.00 13.53 C ATOM 1872 NE1 TRP A 130 -5.484 6.942 9.152 1.00 41.22 N ATOM 1873 CE2 TRP A 130 -4.554 7.485 8.300 1.00 64.32 C ATOM 1874 CE3 TRP A 130 -3.366 6.726 6.336 1.00 42.34 C ATOM 1875 CZ2 TRP A 130 -3.975 8.756 8.202 1.00 41.30 C ATOM 1876 CZ3 TRP A 130 -2.756 7.986 6.248 1.00 14.23 C ATOM 1877 CH2 TRP A 130 -3.065 9.008 7.166 1.00 14.33 C ATOM 0 H TRP A 130 -4.772 2.251 8.850 1.00 4.23 H new ATOM 0 HA TRP A 130 -7.123 3.502 7.607 1.00 13.31 H new ATOM 0 HB2 TRP A 130 -4.150 3.479 7.057 1.00 74.10 H new ATOM 0 HB3 TRP A 130 -5.322 4.150 5.940 1.00 74.10 H new ATOM 0 HD1 TRP A 130 -6.403 4.975 9.396 1.00 22.35 H new ATOM 0 HE1 TRP A 130 -5.924 7.448 9.921 1.00 41.22 H new ATOM 0 HE3 TRP A 130 -3.134 5.968 5.603 1.00 42.34 H new ATOM 0 HZ2 TRP A 130 -4.225 9.530 8.913 1.00 41.30 H new ATOM 0 HZ3 TRP A 130 -2.038 8.175 5.464 1.00 14.23 H new ATOM 0 HH2 TRP A 130 -2.604 9.980 7.072 1.00 14.33 H new ATOM 1887 N ALA A 131 -6.158 0.585 6.864 1.00 11.45 N ATOM 1888 CA ALA A 131 -6.223 -0.537 5.929 1.00 2.33 C ATOM 1889 C ALA A 131 -7.149 -1.665 6.377 1.00 65.31 C ATOM 1890 O ALA A 131 -7.378 -2.592 5.600 1.00 23.13 O ATOM 1891 CB ALA A 131 -4.807 -1.040 5.664 1.00 62.24 C ATOM 0 H ALA A 131 -5.853 0.321 7.801 1.00 11.45 H new ATOM 0 HA ALA A 131 -6.669 -0.170 5.004 1.00 2.33 H new ATOM 0 HB1 ALA A 131 -4.843 -1.878 4.967 1.00 62.24 H new ATOM 0 HB2 ALA A 131 -4.210 -0.236 5.234 1.00 62.24 H new ATOM 0 HB3 ALA A 131 -4.356 -1.366 6.601 1.00 62.24 H new ATOM 1897 N ASP A 132 -7.704 -1.519 7.580 1.00 43.21 N ATOM 1898 CA ASP A 132 -8.472 -2.390 8.474 1.00 54.12 C ATOM 1899 C ASP A 132 -9.666 -3.133 7.844 1.00 33.41 C ATOM 1900 O ASP A 132 -10.816 -3.013 8.278 1.00 23.34 O ATOM 1901 CB ASP A 132 -8.912 -1.491 9.639 1.00 71.13 C ATOM 1902 CG ASP A 132 -8.999 -2.189 10.992 1.00 32.01 C ATOM 1903 OD1 ASP A 132 -7.988 -2.805 11.412 1.00 50.52 O ATOM 1904 OD2 ASP A 132 -9.992 -1.972 11.717 1.00 13.55 O ATOM 0 H ASP A 132 -7.603 -0.610 8.032 1.00 43.21 H new ATOM 0 HA ASP A 132 -7.834 -3.218 8.783 1.00 54.12 H new ATOM 0 HB2 ASP A 132 -8.213 -0.659 9.720 1.00 71.13 H new ATOM 0 HB3 ASP A 132 -9.888 -1.066 9.402 1.00 71.13 H new ATOM 1908 N GLY A 133 -9.409 -3.898 6.792 1.00 50.21 N ATOM 1909 CA GLY A 133 -10.339 -4.845 6.202 1.00 44.23 C ATOM 1910 C GLY A 133 -9.565 -5.890 5.412 1.00 13.52 C ATOM 1911 O GLY A 133 -9.666 -7.084 5.698 1.00 12.44 O ATOM 0 H GLY A 133 -8.511 -3.873 6.309 1.00 50.21 H new ATOM 0 HA2 GLY A 133 -10.929 -5.326 6.982 1.00 44.23 H new ATOM 0 HA3 GLY A 133 -11.039 -4.325 5.549 1.00 44.23 H new ATOM 1915 N LEU A 134 -8.744 -5.437 4.462 1.00 63.24 N ATOM 1916 CA LEU A 134 -7.966 -6.273 3.546 1.00 12.55 C ATOM 1917 C LEU A 134 -7.055 -7.201 4.352 1.00 74.04 C ATOM 1918 O LEU A 134 -6.496 -6.759 5.358 1.00 71.10 O ATOM 1919 CB LEU A 134 -7.083 -5.380 2.651 1.00 70.02 C ATOM 1920 CG LEU A 134 -7.756 -4.525 1.559 1.00 45.52 C ATOM 1921 CD1 LEU A 134 -8.221 -5.360 0.350 1.00 53.51 C ATOM 1922 CD2 LEU A 134 -8.888 -3.627 2.060 1.00 22.03 C ATOM 0 H LEU A 134 -8.598 -4.440 4.304 1.00 63.24 H new ATOM 0 HA LEU A 134 -8.650 -6.857 2.931 1.00 12.55 H new ATOM 0 HB2 LEU A 134 -6.528 -4.705 3.303 1.00 70.02 H new ATOM 0 HB3 LEU A 134 -6.352 -6.024 2.162 1.00 70.02 H new ATOM 0 HG LEU A 134 -6.961 -3.856 1.229 1.00 45.52 H new ATOM 0 HD11 LEU A 134 -8.687 -4.706 -0.387 1.00 53.51 H new ATOM 0 HD12 LEU A 134 -7.362 -5.859 -0.100 1.00 53.51 H new ATOM 0 HD13 LEU A 134 -8.943 -6.107 0.680 1.00 53.51 H new ATOM 0 HD21 LEU A 134 -9.302 -3.063 1.224 1.00 22.03 H new ATOM 0 HD22 LEU A 134 -9.670 -4.242 2.506 1.00 22.03 H new ATOM 0 HD23 LEU A 134 -8.500 -2.935 2.808 1.00 22.03 H new ATOM 1933 N ASN A 135 -6.879 -8.449 3.907 1.00 13.23 N ATOM 1934 CA ASN A 135 -6.030 -9.441 4.568 1.00 33.05 C ATOM 1935 C ASN A 135 -4.574 -9.004 4.560 1.00 13.21 C ATOM 1936 O ASN A 135 -3.913 -9.066 3.518 1.00 64.32 O ATOM 1937 CB ASN A 135 -6.088 -10.799 3.873 1.00 12.12 C ATOM 1938 CG ASN A 135 -5.140 -11.784 4.549 1.00 11.41 C ATOM 1939 OD1 ASN A 135 -5.267 -12.080 5.734 1.00 63.15 O ATOM 1940 ND2 ASN A 135 -4.172 -12.298 3.821 1.00 72.24 N ATOM 0 H ASN A 135 -7.331 -8.803 3.063 1.00 13.23 H new ATOM 0 HA ASN A 135 -6.409 -9.526 5.586 1.00 33.05 H new ATOM 0 HB2 ASN A 135 -7.106 -11.186 3.902 1.00 12.12 H new ATOM 0 HB3 ASN A 135 -5.819 -10.689 2.822 1.00 12.12 H new ATOM 0 HD21 ASN A 135 -3.512 -12.954 4.240 1.00 72.24 H new ATOM 0 HD22 ASN A 135 -4.081 -12.041 2.838 1.00 72.24 H new ATOM 1946 N VAL A 136 -4.075 -8.599 5.721 1.00 12.31 N ATOM 1947 CA VAL A 136 -2.693 -8.204 5.880 1.00 13.54 C ATOM 1948 C VAL A 136 -1.930 -9.406 6.403 1.00 14.54 C ATOM 1949 O VAL A 136 -2.356 -10.034 7.377 1.00 71.21 O ATOM 1950 CB VAL A 136 -2.613 -7.006 6.846 1.00 73.31 C ATOM 1951 CG1 VAL A 136 -1.170 -6.577 7.168 1.00 44.24 C ATOM 1952 CG2 VAL A 136 -3.372 -5.799 6.280 1.00 44.14 C ATOM 0 H VAL A 136 -4.624 -8.537 6.578 1.00 12.31 H new ATOM 0 HA VAL A 136 -2.253 -7.888 4.934 1.00 13.54 H new ATOM 0 HB VAL A 136 -3.074 -7.346 7.774 1.00 73.31 H new ATOM 0 HG11 VAL A 136 -1.187 -5.729 7.853 1.00 44.24 H new ATOM 0 HG12 VAL A 136 -0.638 -7.408 7.632 1.00 44.24 H new ATOM 0 HG13 VAL A 136 -0.662 -6.290 6.247 1.00 44.24 H new ATOM 0 HG21 VAL A 136 -3.302 -4.965 6.978 1.00 44.14 H new ATOM 0 HG22 VAL A 136 -2.935 -5.510 5.324 1.00 44.14 H new ATOM 0 HG23 VAL A 136 -4.419 -6.063 6.134 1.00 44.14 H new ATOM 1962 N ILE A 137 -0.781 -9.681 5.794 1.00 31.34 N ATOM 1963 CA ILE A 137 0.174 -10.682 6.272 1.00 61.42 C ATOM 1964 C ILE A 137 1.591 -10.119 6.427 1.00 14.42 C ATOM 1965 O ILE A 137 2.478 -10.837 6.889 1.00 74.21 O ATOM 1966 CB ILE A 137 0.116 -11.956 5.398 1.00 41.41 C ATOM 1967 CG1 ILE A 137 0.320 -11.737 3.886 1.00 10.34 C ATOM 1968 CG2 ILE A 137 -1.239 -12.656 5.591 1.00 12.34 C ATOM 1969 CD1 ILE A 137 1.745 -11.368 3.477 1.00 54.22 C ATOM 0 H ILE A 137 -0.480 -9.209 4.941 1.00 31.34 H new ATOM 0 HA ILE A 137 -0.125 -10.971 7.279 1.00 61.42 H new ATOM 0 HB ILE A 137 0.957 -12.559 5.741 1.00 41.41 H new ATOM 0 HG12 ILE A 137 0.030 -12.646 3.359 1.00 10.34 H new ATOM 0 HG13 ILE A 137 -0.354 -10.948 3.554 1.00 10.34 H new ATOM 0 HG21 ILE A 137 -1.276 -13.553 4.973 1.00 12.34 H new ATOM 0 HG22 ILE A 137 -1.360 -12.931 6.639 1.00 12.34 H new ATOM 0 HG23 ILE A 137 -2.043 -11.980 5.298 1.00 12.34 H new ATOM 0 HD11 ILE A 137 1.790 -11.234 2.396 1.00 54.22 H new ATOM 0 HD12 ILE A 137 2.036 -10.441 3.970 1.00 54.22 H new ATOM 0 HD13 ILE A 137 2.426 -12.166 3.773 1.00 54.22 H new ATOM 1980 N GLY A 138 1.839 -8.854 6.069 1.00 13.10 N ATOM 1981 CA GLY A 138 3.198 -8.341 6.024 1.00 63.32 C ATOM 1982 C GLY A 138 3.287 -6.838 6.105 1.00 23.11 C ATOM 1983 O GLY A 138 2.904 -6.160 5.151 1.00 43.12 O ATOM 0 H GLY A 138 1.120 -8.179 5.810 1.00 13.10 H new ATOM 0 HA2 GLY A 138 3.767 -8.774 6.847 1.00 63.32 H new ATOM 0 HA3 GLY A 138 3.671 -8.674 5.100 1.00 63.32 H new ATOM 1987 N VAL A 139 3.861 -6.330 7.191 1.00 44.44 N ATOM 1988 CA VAL A 139 4.293 -4.946 7.301 1.00 53.14 C ATOM 1989 C VAL A 139 5.613 -4.948 8.064 1.00 23.12 C ATOM 1990 O VAL A 139 5.722 -5.450 9.188 1.00 3.41 O ATOM 1991 CB VAL A 139 3.232 -4.036 7.957 1.00 64.42 C ATOM 1992 CG1 VAL A 139 3.660 -2.563 7.847 1.00 41.33 C ATOM 1993 CG2 VAL A 139 1.848 -4.162 7.308 1.00 22.24 C ATOM 0 H VAL A 139 4.041 -6.879 8.031 1.00 44.44 H new ATOM 0 HA VAL A 139 4.432 -4.520 6.307 1.00 53.14 H new ATOM 0 HB VAL A 139 3.161 -4.359 8.995 1.00 64.42 H new ATOM 0 HG11 VAL A 139 2.905 -1.929 8.312 1.00 41.33 H new ATOM 0 HG12 VAL A 139 4.615 -2.423 8.354 1.00 41.33 H new ATOM 0 HG13 VAL A 139 3.764 -2.292 6.796 1.00 41.33 H new ATOM 0 HG21 VAL A 139 1.147 -3.498 7.814 1.00 22.24 H new ATOM 0 HG22 VAL A 139 1.913 -3.887 6.255 1.00 22.24 H new ATOM 0 HG23 VAL A 139 1.499 -5.191 7.393 1.00 22.24 H new ATOM 2003 N ALA A 140 6.636 -4.414 7.417 1.00 31.35 N ATOM 2004 CA ALA A 140 8.006 -4.286 7.895 1.00 21.14 C ATOM 2005 C ALA A 140 8.611 -2.997 7.317 1.00 70.24 C ATOM 2006 O ALA A 140 7.894 -2.144 6.790 1.00 63.32 O ATOM 2007 CB ALA A 140 8.780 -5.535 7.451 1.00 2.45 C ATOM 0 H ALA A 140 6.525 -4.031 6.478 1.00 31.35 H new ATOM 0 HA ALA A 140 8.053 -4.217 8.982 1.00 21.14 H new ATOM 0 HB1 ALA A 140 9.812 -5.466 7.796 1.00 2.45 H new ATOM 0 HB2 ALA A 140 8.313 -6.423 7.878 1.00 2.45 H new ATOM 0 HB3 ALA A 140 8.765 -5.605 6.363 1.00 2.45 H new ATOM 2013 N ARG A 141 9.929 -2.813 7.400 1.00 1.15 N ATOM 2014 CA ARG A 141 10.662 -1.768 6.700 1.00 74.00 C ATOM 2015 C ARG A 141 11.635 -2.417 5.706 1.00 53.11 C ATOM 2016 O ARG A 141 12.046 -3.569 5.914 1.00 42.53 O ATOM 2017 CB ARG A 141 11.356 -0.874 7.718 1.00 52.32 C ATOM 2018 CG ARG A 141 12.487 -1.591 8.442 1.00 73.22 C ATOM 2019 CD ARG A 141 12.990 -0.776 9.623 1.00 21.23 C ATOM 2020 NE ARG A 141 14.068 -1.490 10.307 1.00 24.04 N ATOM 2021 CZ ARG A 141 13.962 -2.628 11.003 1.00 11.11 C ATOM 2022 NH1 ARG A 141 12.779 -3.192 11.224 1.00 11.21 N ATOM 2023 NH2 ARG A 141 15.058 -3.191 11.480 1.00 25.33 N ATOM 0 H ARG A 141 10.529 -3.406 7.973 1.00 1.15 H new ATOM 0 HA ARG A 141 9.989 -1.133 6.124 1.00 74.00 H new ATOM 0 HB2 ARG A 141 11.752 0.007 7.214 1.00 52.32 H new ATOM 0 HB3 ARG A 141 10.626 -0.523 8.447 1.00 52.32 H new ATOM 0 HG2 ARG A 141 12.140 -2.564 8.790 1.00 73.22 H new ATOM 0 HG3 ARG A 141 13.307 -1.775 7.748 1.00 73.22 H new ATOM 0 HD2 ARG A 141 13.348 0.194 9.279 1.00 21.23 H new ATOM 0 HD3 ARG A 141 12.172 -0.586 10.318 1.00 21.23 H new ATOM 0 HE ARG A 141 14.999 -1.077 10.247 1.00 24.04 H new ATOM 0 HH11 ARG A 141 11.931 -2.757 10.861 1.00 11.21 H new ATOM 0 HH12 ARG A 141 12.719 -4.060 11.757 1.00 11.21 H new ATOM 0 HH21 ARG A 141 15.967 -2.758 11.316 1.00 25.33 H new ATOM 0 HH22 ARG A 141 14.995 -4.059 12.013 1.00 25.33 H new ATOM 2034 N ASP A 142 12.071 -1.630 4.720 1.00 12.11 N ATOM 2035 CA ASP A 142 13.113 -1.969 3.745 1.00 13.32 C ATOM 2036 C ASP A 142 12.797 -3.275 3.003 1.00 50.14 C ATOM 2037 O ASP A 142 11.633 -3.656 2.867 1.00 21.24 O ATOM 2038 CB ASP A 142 14.517 -1.941 4.404 1.00 61.03 C ATOM 2039 CG ASP A 142 14.794 -0.772 5.362 1.00 52.14 C ATOM 2040 OD1 ASP A 142 14.347 0.370 5.093 1.00 71.32 O ATOM 2041 OD2 ASP A 142 15.437 -1.011 6.414 1.00 3.54 O ATOM 0 H ASP A 142 11.690 -0.695 4.572 1.00 12.11 H new ATOM 0 HA ASP A 142 13.127 -1.201 2.971 1.00 13.32 H new ATOM 0 HB2 ASP A 142 14.657 -2.873 4.951 1.00 61.03 H new ATOM 0 HB3 ASP A 142 15.266 -1.920 3.613 1.00 61.03 H new ATOM 2045 N ASP A 143 13.816 -3.931 2.449 1.00 21.32 N ATOM 2046 CA ASP A 143 13.743 -5.257 1.840 1.00 74.03 C ATOM 2047 C ASP A 143 14.501 -6.237 2.735 1.00 41.45 C ATOM 2048 O ASP A 143 15.693 -6.488 2.561 1.00 61.21 O ATOM 2049 CB ASP A 143 14.242 -5.306 0.380 1.00 54.31 C ATOM 2050 CG ASP A 143 15.435 -4.420 0.083 1.00 12.45 C ATOM 2051 OD1 ASP A 143 16.562 -4.721 0.517 1.00 14.52 O ATOM 2052 OD2 ASP A 143 15.224 -3.352 -0.548 1.00 25.43 O ATOM 0 H ASP A 143 14.755 -3.535 2.411 1.00 21.32 H new ATOM 0 HA ASP A 143 12.693 -5.541 1.772 1.00 74.03 H new ATOM 0 HB2 ASP A 143 14.503 -6.336 0.135 1.00 54.31 H new ATOM 0 HB3 ASP A 143 13.422 -5.019 -0.279 1.00 54.31 H new ATOM 2056 N SER A 144 13.809 -6.753 3.745 1.00 44.31 N ATOM 2057 CA SER A 144 14.330 -7.727 4.693 1.00 65.31 C ATOM 2058 C SER A 144 13.351 -8.892 4.894 1.00 31.03 C ATOM 2059 O SER A 144 13.758 -9.959 5.361 1.00 22.41 O ATOM 2060 CB SER A 144 14.622 -6.999 6.012 1.00 74.45 C ATOM 2061 OG SER A 144 15.884 -7.363 6.541 1.00 22.00 O ATOM 0 H SER A 144 12.840 -6.496 3.931 1.00 44.31 H new ATOM 0 HA SER A 144 15.249 -8.166 4.306 1.00 65.31 H new ATOM 0 HB2 SER A 144 14.593 -5.922 5.848 1.00 74.45 H new ATOM 0 HB3 SER A 144 13.842 -7.232 6.737 1.00 74.45 H new ATOM 0 HG SER A 144 16.039 -6.880 7.380 1.00 22.00 H new ATOM 2066 N GLU A 145 12.071 -8.713 4.549 1.00 31.02 N ATOM 2067 CA GLU A 145 11.023 -9.711 4.734 1.00 44.33 C ATOM 2068 C GLU A 145 10.355 -10.024 3.386 1.00 41.54 C ATOM 2069 O GLU A 145 9.251 -10.551 3.339 1.00 33.23 O ATOM 2070 CB GLU A 145 10.047 -9.293 5.861 1.00 23.43 C ATOM 2071 CG GLU A 145 10.791 -8.757 7.103 1.00 4.53 C ATOM 2072 CD GLU A 145 10.002 -8.706 8.415 1.00 71.42 C ATOM 2073 OE1 GLU A 145 8.756 -8.812 8.427 1.00 21.32 O ATOM 2074 OE2 GLU A 145 10.661 -8.563 9.477 1.00 74.34 O ATOM 0 H GLU A 145 11.732 -7.850 4.124 1.00 31.02 H new ATOM 0 HA GLU A 145 11.457 -10.649 5.079 1.00 44.33 H new ATOM 0 HB2 GLU A 145 9.368 -8.527 5.487 1.00 23.43 H new ATOM 0 HB3 GLU A 145 9.435 -10.149 6.146 1.00 23.43 H new ATOM 0 HG2 GLU A 145 11.674 -9.375 7.262 1.00 4.53 H new ATOM 0 HG3 GLU A 145 11.143 -7.750 6.879 1.00 4.53 H new ATOM 2079 N VAL A 146 11.000 -9.720 2.259 1.00 3.40 N ATOM 2080 CA VAL A 146 10.399 -9.898 0.937 1.00 34.04 C ATOM 2081 C VAL A 146 10.195 -11.383 0.647 1.00 62.32 C ATOM 2082 O VAL A 146 9.193 -11.759 0.031 1.00 25.13 O ATOM 2083 CB VAL A 146 11.265 -9.196 -0.127 1.00 52.54 C ATOM 2084 CG1 VAL A 146 10.658 -9.287 -1.532 1.00 71.35 C ATOM 2085 CG2 VAL A 146 11.451 -7.705 0.203 1.00 52.22 C ATOM 0 H VAL A 146 11.948 -9.346 2.237 1.00 3.40 H new ATOM 0 HA VAL A 146 9.413 -9.433 0.910 1.00 34.04 H new ATOM 0 HB VAL A 146 12.223 -9.716 -0.114 1.00 52.54 H new ATOM 0 HG11 VAL A 146 11.308 -8.777 -2.243 1.00 71.35 H new ATOM 0 HG12 VAL A 146 10.559 -10.334 -1.818 1.00 71.35 H new ATOM 0 HG13 VAL A 146 9.675 -8.815 -1.535 1.00 71.35 H new ATOM 0 HG21 VAL A 146 12.066 -7.236 -0.565 1.00 52.22 H new ATOM 0 HG22 VAL A 146 10.478 -7.216 0.237 1.00 52.22 H new ATOM 0 HG23 VAL A 146 11.941 -7.605 1.171 1.00 52.22 H new ATOM 2095 N ASP A 147 11.101 -12.239 1.133 1.00 14.32 N ATOM 2096 CA ASP A 147 11.026 -13.675 0.901 1.00 4.32 C ATOM 2097 C ASP A 147 9.738 -14.245 1.503 1.00 34.02 C ATOM 2098 O ASP A 147 9.086 -15.088 0.885 1.00 33.33 O ATOM 2099 CB ASP A 147 12.209 -14.429 1.520 1.00 43.13 C ATOM 2100 CG ASP A 147 13.599 -14.023 1.060 1.00 52.13 C ATOM 2101 OD1 ASP A 147 14.107 -14.598 0.076 1.00 52.21 O ATOM 2102 OD2 ASP A 147 14.223 -13.181 1.758 1.00 70.04 O ATOM 0 H ASP A 147 11.902 -11.951 1.695 1.00 14.32 H new ATOM 0 HA ASP A 147 11.046 -13.813 -0.180 1.00 4.32 H new ATOM 0 HB2 ASP A 147 12.161 -14.307 2.602 1.00 43.13 H new ATOM 0 HB3 ASP A 147 12.080 -15.491 1.313 1.00 43.13 H new ATOM 2106 N LYS A 148 9.346 -13.822 2.716 1.00 3.20 N ATOM 2107 CA LYS A 148 8.144 -14.371 3.356 1.00 25.34 C ATOM 2108 C LYS A 148 6.892 -13.984 2.576 1.00 23.11 C ATOM 2109 O LYS A 148 5.898 -14.689 2.714 1.00 30.01 O ATOM 2110 CB LYS A 148 8.010 -13.998 4.850 1.00 5.30 C ATOM 2111 CG LYS A 148 8.013 -12.491 5.086 1.00 32.24 C ATOM 2112 CD LYS A 148 7.290 -11.994 6.331 1.00 74.42 C ATOM 2113 CE LYS A 148 8.063 -12.257 7.621 1.00 13.53 C ATOM 2114 NZ LYS A 148 7.648 -11.311 8.675 1.00 53.41 N ATOM 0 H LYS A 148 9.835 -13.114 3.264 1.00 3.20 H new ATOM 0 HA LYS A 148 8.255 -15.455 3.332 1.00 25.34 H new ATOM 0 HB2 LYS A 148 7.086 -14.421 5.244 1.00 5.30 H new ATOM 0 HB3 LYS A 148 8.830 -14.450 5.408 1.00 5.30 H new ATOM 0 HG2 LYS A 148 9.049 -12.156 5.137 1.00 32.24 H new ATOM 0 HG3 LYS A 148 7.565 -12.009 4.217 1.00 32.24 H new ATOM 0 HD2 LYS A 148 7.109 -10.923 6.235 1.00 74.42 H new ATOM 0 HD3 LYS A 148 6.315 -12.477 6.394 1.00 74.42 H new ATOM 0 HE2 LYS A 148 7.889 -13.280 7.954 1.00 13.53 H new ATOM 0 HE3 LYS A 148 9.133 -12.159 7.437 1.00 13.53 H new ATOM 0 HZ1 LYS A 148 8.134 -11.547 9.564 1.00 53.41 H new ATOM 0 HZ2 LYS A 148 7.898 -10.342 8.390 1.00 53.41 H new ATOM 0 HZ3 LYS A 148 6.619 -11.376 8.815 1.00 53.41 H new ATOM 2124 N TRP A 149 6.906 -12.926 1.767 1.00 25.02 N ATOM 2125 CA TRP A 149 5.785 -12.561 0.904 1.00 65.01 C ATOM 2126 C TRP A 149 5.958 -13.180 -0.486 1.00 64.14 C ATOM 2127 O TRP A 149 5.554 -12.575 -1.475 1.00 51.35 O ATOM 2128 CB TRP A 149 5.667 -11.030 0.850 1.00 52.12 C ATOM 2129 CG TRP A 149 5.743 -10.324 2.165 1.00 25.32 C ATOM 2130 CD1 TRP A 149 5.176 -10.728 3.323 1.00 33.01 C ATOM 2131 CD2 TRP A 149 6.519 -9.135 2.487 1.00 32.00 C ATOM 2132 NE1 TRP A 149 5.584 -9.895 4.342 1.00 22.01 N ATOM 2133 CE2 TRP A 149 6.403 -8.889 3.884 1.00 5.24 C ATOM 2134 CE3 TRP A 149 7.333 -8.257 1.740 1.00 3.12 C ATOM 2135 CZ2 TRP A 149 7.071 -7.836 4.516 1.00 25.32 C ATOM 2136 CZ3 TRP A 149 8.035 -7.212 2.367 1.00 34.33 C ATOM 2137 CH2 TRP A 149 7.913 -7.012 3.753 1.00 30.01 C ATOM 0 H TRP A 149 7.702 -12.293 1.692 1.00 25.02 H new ATOM 0 HA TRP A 149 4.855 -12.957 1.312 1.00 65.01 H new ATOM 0 HB2 TRP A 149 6.459 -10.646 0.207 1.00 52.12 H new ATOM 0 HB3 TRP A 149 4.719 -10.774 0.376 1.00 52.12 H new ATOM 0 HD1 TRP A 149 4.509 -11.570 3.433 1.00 33.01 H new ATOM 0 HE1 TRP A 149 5.312 -10.010 5.318 1.00 22.01 H new ATOM 0 HE3 TRP A 149 7.418 -8.389 0.672 1.00 3.12 H new ATOM 0 HZ2 TRP A 149 6.941 -7.660 5.574 1.00 25.32 H new ATOM 0 HZ3 TRP A 149 8.669 -6.562 1.782 1.00 34.33 H new ATOM 0 HH2 TRP A 149 8.470 -6.221 4.233 1.00 30.01 H new ATOM 2147 N SER A 150 6.641 -14.319 -0.617 1.00 23.11 N ATOM 2148 CA SER A 150 6.800 -14.997 -1.902 1.00 4.40 C ATOM 2149 C SER A 150 6.953 -16.518 -1.731 1.00 73.02 C ATOM 2150 O SER A 150 6.493 -17.286 -2.581 1.00 2.10 O ATOM 2151 CB SER A 150 7.988 -14.344 -2.634 1.00 64.25 C ATOM 2152 OG SER A 150 8.173 -14.837 -3.948 1.00 10.50 O ATOM 0 H SER A 150 7.097 -14.794 0.162 1.00 23.11 H new ATOM 0 HA SER A 150 5.903 -14.878 -2.509 1.00 4.40 H new ATOM 0 HB2 SER A 150 7.832 -13.266 -2.676 1.00 64.25 H new ATOM 0 HB3 SER A 150 8.898 -14.512 -2.058 1.00 64.25 H new ATOM 0 HG SER A 150 8.938 -14.386 -4.362 1.00 10.50 H new ATOM 2157 N LYS A 151 7.590 -16.980 -0.656 1.00 1.41 N ATOM 2158 CA LYS A 151 7.712 -18.392 -0.321 1.00 2.13 C ATOM 2159 C LYS A 151 6.365 -18.918 0.157 1.00 53.32 C ATOM 2160 O LYS A 151 5.923 -19.997 -0.306 1.00 23.00 O ATOM 2161 CB LYS A 151 8.776 -18.574 0.772 1.00 14.11 C ATOM 2162 CG LYS A 151 10.193 -18.107 0.405 1.00 30.00 C ATOM 2163 CD LYS A 151 10.918 -18.981 -0.621 1.00 50.32 C ATOM 2164 CE LYS A 151 12.311 -18.393 -0.886 1.00 42.35 C ATOM 2165 NZ LYS A 151 13.244 -18.585 0.245 1.00 31.02 N ATOM 0 H LYS A 151 8.045 -16.366 0.020 1.00 1.41 H new ATOM 0 HA LYS A 151 8.018 -18.953 -1.204 1.00 2.13 H new ATOM 0 HB2 LYS A 151 8.454 -18.032 1.661 1.00 14.11 H new ATOM 0 HB3 LYS A 151 8.819 -19.630 1.040 1.00 14.11 H new ATOM 0 HG2 LYS A 151 10.135 -17.090 0.017 1.00 30.00 H new ATOM 0 HG3 LYS A 151 10.793 -18.067 1.314 1.00 30.00 H new ATOM 0 HD2 LYS A 151 11.005 -20.002 -0.250 1.00 50.32 H new ATOM 0 HD3 LYS A 151 10.346 -19.026 -1.548 1.00 50.32 H new ATOM 0 HE2 LYS A 151 12.731 -18.856 -1.779 1.00 42.35 H new ATOM 0 HE3 LYS A 151 12.216 -17.327 -1.094 1.00 42.35 H new ATOM 0 HZ1 LYS A 151 14.200 -18.292 -0.040 1.00 31.02 H new ATOM 0 HZ2 LYS A 151 12.932 -18.010 1.054 1.00 31.02 H new ATOM 0 HZ3 LYS A 151 13.257 -19.588 0.518 1.00 31.02 H new