USER MOD reduce.3.24.130724 H: found=0, std=0, add=1146, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 957 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 6 THR OG1 : rot 180:sc= -0.138 USER MOD Set 1.2: A 150 SER OG : rot -55:sc= 0 USER MOD Set 2.1: A 59 GLN :FLIP amide:sc= -0.0715 F(o=-0.95,f=-0.066) USER MOD Set 2.2: A 61 ASN : amide:sc= 0.00601 X(o=-0.066,f=-0.32) USER MOD Set 3.1: A 39 SER OG : rot -139:sc= -0.0629 USER MOD Set 3.2: A 68 GLN : amide:sc= 0 X(o=-0.063,f=-0.4) USER MOD Set 4.1: A 25 ASN : amide:sc= -0.431 X(o=-0.23,f=-0.4) USER MOD Set 4.2: A 31 SER OG : rot 180:sc= 0.197 USER MOD Single : A 4 LYS NZ :NH3+ 164:sc=-0.00972 (180deg=-0.172) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 TYR OH : rot 30:sc= -0.109 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 45:sc= 0.0959 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 169:sc= 0.0651 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ -173:sc= -0.0219 (180deg=-0.0918) USER MOD Single : A 20 MET CE :methyl 175:sc= -0.183 (180deg=-0.271) USER MOD Single : A 23 LYS NZ :NH3+ -155:sc= 1.25 (180deg=0.453) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0152) 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 42 THR OG1 : rot 62:sc= 0.621 USER MOD Single : A 47 MET CE :methyl 164:sc= -0.0159 (180deg=-0.269) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot -66:sc= 1.24 USER MOD Single : A 51 SER OG : rot 79:sc= 0.568 USER MOD Single : A 57 GLN : amide:sc= 0 K(o=0,f=-1.5) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 74 TYR OH : rot 173:sc= 0 USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 ASN : amide:sc= 0.474 X(o=0.47,f=0) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 180:sc= 0.0054 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0355) USER MOD Single : A 97 THR OG1 : rot -97:sc= 1.13 USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 102 MET CE :methyl 144:sc= -0.481 (180deg=-2.9!) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 ASN :FLIP amide:sc= 0 F(o=-0.74,f=0) USER MOD Single : A 105 TYR OH : rot -3:sc= 1.22 USER MOD Single : A 111 SER OG : rot -151:sc= 1.48 USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 170:sc= 0.271 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0.0566 USER MOD Single : A 119 ASN : amide:sc= -1.34 X(o=-1.3,f=-1.3) USER MOD Single : A 120 HIS :FLIP no HD1:sc= -0.055 F(o=-1.3,f=-0.055) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 TYR OH : rot 180:sc= 0 USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 HIS : no HE2:sc= -0.409 K(o=-0.41,f=-1.4) USER MOD Single : A 128 ASN : amide:sc= 1.02 K(o=1,f=0) USER MOD Single : A 135 ASN : amide:sc= 0.502 K(o=0.5,f=-0.34) USER MOD Single : A 144 SER OG : rot -38:sc= 0.434 USER MOD Single : A 148 LYS NZ :NH3+ -162:sc= 0.937 (180deg=0.76) USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 33 N LYS A 4 -3.664 -17.023 -1.171 1.00 31.04 N ATOM 34 CA LYS A 4 -2.535 -16.495 -0.410 1.00 11.40 C ATOM 35 C LYS A 4 -1.529 -15.843 -1.349 1.00 52.15 C ATOM 36 O LYS A 4 -0.345 -16.171 -1.335 1.00 11.11 O ATOM 37 CB LYS A 4 -1.954 -17.532 0.570 1.00 13.21 C ATOM 38 CG LYS A 4 -1.161 -18.747 0.047 1.00 54.14 C ATOM 39 CD LYS A 4 -1.865 -19.642 -0.987 1.00 3.30 C ATOM 40 CE LYS A 4 -1.588 -19.250 -2.442 1.00 72.23 C ATOM 41 NZ LYS A 4 -0.185 -19.505 -2.823 1.00 60.34 N ATOM 0 HA LYS A 4 -2.882 -15.699 0.248 1.00 11.40 H new ATOM 0 HB2 LYS A 4 -1.301 -16.994 1.258 1.00 13.21 H new ATOM 0 HB3 LYS A 4 -2.786 -17.920 1.158 1.00 13.21 H new ATOM 0 HG2 LYS A 4 -0.233 -18.383 -0.395 1.00 54.14 H new ATOM 0 HG3 LYS A 4 -0.886 -19.366 0.901 1.00 54.14 H new ATOM 0 HD2 LYS A 4 -1.550 -20.674 -0.833 1.00 3.30 H new ATOM 0 HD3 LYS A 4 -2.940 -19.607 -0.810 1.00 3.30 H new ATOM 0 HE2 LYS A 4 -2.251 -19.810 -3.101 1.00 72.23 H new ATOM 0 HE3 LYS A 4 -1.816 -18.194 -2.583 1.00 72.23 H new ATOM 0 HZ1 LYS A 4 -0.098 -19.489 -3.859 1.00 60.34 H new ATOM 0 HZ2 LYS A 4 0.425 -18.769 -2.413 1.00 60.34 H new ATOM 0 HZ3 LYS A 4 0.108 -20.437 -2.465 1.00 60.34 H new ATOM 51 N LYS A 5 -2.004 -15.002 -2.264 1.00 1.21 N ATOM 52 CA LYS A 5 -1.149 -14.145 -3.093 1.00 64.44 C ATOM 53 C LYS A 5 -0.688 -12.973 -2.257 1.00 75.13 C ATOM 54 O LYS A 5 -1.135 -12.789 -1.120 1.00 74.05 O ATOM 55 CB LYS A 5 -1.943 -13.673 -4.328 1.00 71.23 C ATOM 56 CG LYS A 5 -2.195 -14.853 -5.270 1.00 44.11 C ATOM 57 CD LYS A 5 -1.101 -15.045 -6.328 1.00 2.20 C ATOM 58 CE LYS A 5 -1.456 -14.335 -7.638 1.00 32.40 C ATOM 59 NZ LYS A 5 -2.426 -15.116 -8.428 1.00 74.02 N ATOM 0 H LYS A 5 -3.000 -14.892 -2.455 1.00 1.21 H new ATOM 0 HA LYS A 5 -0.275 -14.694 -3.443 1.00 64.44 H new ATOM 0 HB2 LYS A 5 -2.892 -13.237 -4.016 1.00 71.23 H new ATOM 0 HB3 LYS A 5 -1.390 -12.892 -4.850 1.00 71.23 H new ATOM 0 HG2 LYS A 5 -2.281 -15.765 -4.680 1.00 44.11 H new ATOM 0 HG3 LYS A 5 -3.151 -14.707 -5.772 1.00 44.11 H new ATOM 0 HD2 LYS A 5 -0.155 -14.659 -5.949 1.00 2.20 H new ATOM 0 HD3 LYS A 5 -0.959 -16.109 -6.517 1.00 2.20 H new ATOM 0 HE2 LYS A 5 -1.871 -13.351 -7.419 1.00 32.40 H new ATOM 0 HE3 LYS A 5 -0.551 -14.176 -8.224 1.00 32.40 H new ATOM 0 HZ1 LYS A 5 -2.646 -14.608 -9.309 1.00 74.02 H new ATOM 0 HZ2 LYS A 5 -2.019 -16.045 -8.657 1.00 74.02 H new ATOM 0 HZ3 LYS A 5 -3.298 -15.246 -7.877 1.00 74.02 H new ATOM 69 N THR A 6 0.125 -12.107 -2.841 1.00 63.23 N ATOM 70 CA THR A 6 0.513 -10.860 -2.201 1.00 63.35 C ATOM 71 C THR A 6 0.701 -9.811 -3.294 1.00 64.34 C ATOM 72 O THR A 6 1.594 -9.940 -4.134 1.00 14.34 O ATOM 73 CB THR A 6 1.756 -11.107 -1.339 1.00 51.25 C ATOM 74 OG1 THR A 6 1.605 -12.238 -0.499 1.00 14.24 O ATOM 75 CG2 THR A 6 2.069 -9.888 -0.472 1.00 60.32 C ATOM 0 H THR A 6 0.532 -12.247 -3.766 1.00 63.23 H new ATOM 0 HA THR A 6 -0.251 -10.481 -1.522 1.00 63.35 H new ATOM 0 HB THR A 6 2.579 -11.292 -2.029 1.00 51.25 H new ATOM 0 HG1 THR A 6 2.419 -12.362 0.032 1.00 14.24 H new ATOM 0 HG21 THR A 6 2.955 -10.088 0.130 1.00 60.32 H new ATOM 0 HG22 THR A 6 2.252 -9.024 -1.111 1.00 60.32 H new ATOM 0 HG23 THR A 6 1.223 -9.681 0.184 1.00 60.32 H new ATOM 83 N LEU A 7 -0.177 -8.805 -3.343 1.00 15.10 N ATOM 84 CA LEU A 7 -0.017 -7.657 -4.242 1.00 13.33 C ATOM 85 C LEU A 7 0.758 -6.551 -3.536 1.00 32.33 C ATOM 86 O LEU A 7 0.236 -5.925 -2.613 1.00 13.32 O ATOM 87 CB LEU A 7 -1.386 -7.172 -4.721 1.00 1.32 C ATOM 88 CG LEU A 7 -1.339 -5.982 -5.699 1.00 31.22 C ATOM 89 CD1 LEU A 7 -0.487 -6.255 -6.947 1.00 42.21 C ATOM 90 CD2 LEU A 7 -2.772 -5.669 -6.143 1.00 64.04 C ATOM 0 H LEU A 7 -1.015 -8.763 -2.764 1.00 15.10 H new ATOM 0 HA LEU A 7 0.554 -7.957 -5.121 1.00 13.33 H new ATOM 0 HB2 LEU A 7 -1.902 -8.002 -5.204 1.00 1.32 H new ATOM 0 HB3 LEU A 7 -1.981 -6.888 -3.853 1.00 1.32 H new ATOM 0 HG LEU A 7 -0.878 -5.145 -5.174 1.00 31.22 H new ATOM 0 HD11 LEU A 7 -0.496 -5.377 -7.593 1.00 42.21 H new ATOM 0 HD12 LEU A 7 0.538 -6.474 -6.647 1.00 42.21 H new ATOM 0 HD13 LEU A 7 -0.897 -7.108 -7.488 1.00 42.21 H new ATOM 0 HD21 LEU A 7 -2.763 -4.828 -6.837 1.00 64.04 H new ATOM 0 HD22 LEU A 7 -3.199 -6.542 -6.636 1.00 64.04 H new ATOM 0 HD23 LEU A 7 -3.375 -5.414 -5.272 1.00 64.04 H new ATOM 101 N ILE A 8 2.000 -6.318 -3.946 1.00 32.40 N ATOM 102 CA ILE A 8 2.747 -5.130 -3.567 1.00 52.21 C ATOM 103 C ILE A 8 2.359 -4.048 -4.583 1.00 22.51 C ATOM 104 O ILE A 8 2.340 -4.293 -5.794 1.00 75.52 O ATOM 105 CB ILE A 8 4.270 -5.403 -3.571 1.00 24.21 C ATOM 106 CG1 ILE A 8 4.669 -6.684 -2.796 1.00 51.54 C ATOM 107 CG2 ILE A 8 5.017 -4.184 -2.996 1.00 62.01 C ATOM 108 CD1 ILE A 8 6.094 -7.145 -3.130 1.00 52.45 C ATOM 0 H ILE A 8 2.517 -6.953 -4.554 1.00 32.40 H new ATOM 0 HA ILE A 8 2.508 -4.814 -2.552 1.00 52.21 H new ATOM 0 HB ILE A 8 4.557 -5.570 -4.609 1.00 24.21 H new ATOM 0 HG12 ILE A 8 4.591 -6.497 -1.725 1.00 51.54 H new ATOM 0 HG13 ILE A 8 3.966 -7.483 -3.032 1.00 51.54 H new ATOM 0 HG21 ILE A 8 6.089 -4.379 -3.000 1.00 62.01 H new ATOM 0 HG22 ILE A 8 4.806 -3.306 -3.607 1.00 62.01 H new ATOM 0 HG23 ILE A 8 4.685 -4.003 -1.974 1.00 62.01 H new ATOM 0 HD11 ILE A 8 6.327 -8.046 -2.562 1.00 52.45 H new ATOM 0 HD12 ILE A 8 6.167 -7.359 -4.196 1.00 52.45 H new ATOM 0 HD13 ILE A 8 6.802 -6.358 -2.869 1.00 52.45 H new ATOM 119 N LEU A 9 2.064 -2.841 -4.104 1.00 21.31 N ATOM 120 CA LEU A 9 1.908 -1.627 -4.900 1.00 75.42 C ATOM 121 C LEU A 9 2.828 -0.596 -4.264 1.00 35.30 C ATOM 122 O LEU A 9 2.935 -0.572 -3.039 1.00 41.44 O ATOM 123 CB LEU A 9 0.450 -1.138 -4.837 1.00 64.43 C ATOM 124 CG LEU A 9 -0.533 -2.064 -5.580 1.00 54.13 C ATOM 125 CD1 LEU A 9 -1.749 -2.386 -4.709 1.00 40.11 C ATOM 126 CD2 LEU A 9 -1.001 -1.454 -6.905 1.00 75.43 C ATOM 0 H LEU A 9 1.921 -2.676 -3.108 1.00 21.31 H new ATOM 0 HA LEU A 9 2.154 -1.798 -5.948 1.00 75.42 H new ATOM 0 HB2 LEU A 9 0.145 -1.057 -3.794 1.00 64.43 H new ATOM 0 HB3 LEU A 9 0.390 -0.137 -5.265 1.00 64.43 H new ATOM 0 HG LEU A 9 0.007 -2.985 -5.798 1.00 54.13 H new ATOM 0 HD11 LEU A 9 -2.426 -3.041 -5.257 1.00 40.11 H new ATOM 0 HD12 LEU A 9 -1.421 -2.885 -3.797 1.00 40.11 H new ATOM 0 HD13 LEU A 9 -2.267 -1.462 -4.451 1.00 40.11 H new ATOM 0 HD21 LEU A 9 -1.692 -2.139 -7.397 1.00 75.43 H new ATOM 0 HD22 LEU A 9 -1.504 -0.507 -6.712 1.00 75.43 H new ATOM 0 HD23 LEU A 9 -0.140 -1.282 -7.551 1.00 75.43 H new ATOM 137 N TYR A 10 3.489 0.277 -5.025 1.00 15.33 N ATOM 138 CA TYR A 10 4.263 1.353 -4.405 1.00 11.30 C ATOM 139 C TYR A 10 4.510 2.523 -5.364 1.00 51.13 C ATOM 140 O TYR A 10 4.232 2.413 -6.560 1.00 15.03 O ATOM 141 CB TYR A 10 5.585 0.811 -3.821 1.00 21.34 C ATOM 142 CG TYR A 10 6.722 0.622 -4.784 1.00 15.42 C ATOM 143 CD1 TYR A 10 6.526 0.292 -6.140 1.00 62.52 C ATOM 144 CD2 TYR A 10 7.991 0.955 -4.308 1.00 73.14 C ATOM 145 CE1 TYR A 10 7.564 0.470 -7.065 1.00 2.02 C ATOM 146 CE2 TYR A 10 8.985 1.256 -5.247 1.00 60.31 C ATOM 147 CZ TYR A 10 8.788 1.010 -6.624 1.00 13.12 C ATOM 148 OH TYR A 10 9.786 1.258 -7.513 1.00 62.22 O ATOM 0 H TYR A 10 3.506 0.263 -6.045 1.00 15.33 H new ATOM 0 HA TYR A 10 3.665 1.748 -3.584 1.00 11.30 H new ATOM 0 HB2 TYR A 10 5.914 1.492 -3.036 1.00 21.34 H new ATOM 0 HB3 TYR A 10 5.379 -0.148 -3.346 1.00 21.34 H new ATOM 0 HD1 TYR A 10 5.574 -0.099 -6.467 1.00 62.52 H new ATOM 0 HD2 TYR A 10 8.200 0.980 -3.249 1.00 73.14 H new ATOM 0 HE1 TYR A 10 7.427 0.197 -8.101 1.00 2.02 H new ATOM 0 HE2 TYR A 10 9.919 1.684 -4.913 1.00 60.31 H new ATOM 0 HH TYR A 10 9.399 1.473 -8.387 1.00 62.22 H new ATOM 157 N TYR A 11 5.062 3.630 -4.851 1.00 13.32 N ATOM 158 CA TYR A 11 5.360 4.838 -5.617 1.00 4.03 C ATOM 159 C TYR A 11 6.863 5.197 -5.524 1.00 42.01 C ATOM 160 O TYR A 11 7.352 5.579 -4.453 1.00 31.41 O ATOM 161 CB TYR A 11 4.468 5.997 -5.139 1.00 60.24 C ATOM 162 CG TYR A 11 4.839 7.344 -5.743 1.00 60.33 C ATOM 163 CD1 TYR A 11 5.230 7.459 -7.093 1.00 72.15 C ATOM 164 CD2 TYR A 11 4.827 8.494 -4.939 1.00 22.11 C ATOM 165 CE1 TYR A 11 5.634 8.696 -7.620 1.00 74.34 C ATOM 166 CE2 TYR A 11 5.232 9.735 -5.454 1.00 75.14 C ATOM 167 CZ TYR A 11 5.645 9.842 -6.798 1.00 40.14 C ATOM 168 OH TYR A 11 6.049 11.040 -7.286 1.00 12.13 O ATOM 0 H TYR A 11 5.319 3.708 -3.867 1.00 13.32 H new ATOM 0 HA TYR A 11 5.140 4.652 -6.668 1.00 4.03 H new ATOM 0 HB2 TYR A 11 3.431 5.771 -5.386 1.00 60.24 H new ATOM 0 HB3 TYR A 11 4.529 6.067 -4.053 1.00 60.24 H new ATOM 0 HD1 TYR A 11 5.219 6.586 -7.729 1.00 72.15 H new ATOM 0 HD2 TYR A 11 4.502 8.423 -3.911 1.00 22.11 H new ATOM 0 HE1 TYR A 11 5.936 8.770 -8.654 1.00 74.34 H new ATOM 0 HE2 TYR A 11 5.227 10.609 -4.820 1.00 75.14 H new ATOM 0 HH TYR A 11 5.990 11.717 -6.580 1.00 12.13 H new ATOM 177 N SER A 12 7.618 5.079 -6.622 1.00 33.21 N ATOM 178 CA SER A 12 8.988 5.586 -6.731 1.00 52.33 C ATOM 179 C SER A 12 8.984 7.109 -6.916 1.00 32.21 C ATOM 180 O SER A 12 8.820 7.614 -8.026 1.00 63.52 O ATOM 181 CB SER A 12 9.740 4.844 -7.843 1.00 1.31 C ATOM 182 OG SER A 12 9.045 4.850 -9.076 1.00 0.12 O ATOM 0 H SER A 12 7.288 4.621 -7.472 1.00 33.21 H new ATOM 0 HA SER A 12 9.526 5.390 -5.804 1.00 52.33 H new ATOM 0 HB2 SER A 12 10.719 5.303 -7.981 1.00 1.31 H new ATOM 0 HB3 SER A 12 9.912 3.813 -7.533 1.00 1.31 H new ATOM 0 HG SER A 12 8.698 5.750 -9.252 1.00 0.12 H new ATOM 187 N TRP A 13 9.199 7.836 -5.819 1.00 21.40 N ATOM 188 CA TRP A 13 9.214 9.294 -5.776 1.00 71.24 C ATOM 189 C TRP A 13 10.124 9.887 -6.862 1.00 0.12 C ATOM 190 O TRP A 13 9.668 10.636 -7.726 1.00 54.44 O ATOM 191 CB TRP A 13 9.624 9.733 -4.377 1.00 40.33 C ATOM 192 CG TRP A 13 9.527 11.201 -4.115 1.00 55.02 C ATOM 193 CD1 TRP A 13 8.425 11.951 -4.323 1.00 53.14 C ATOM 194 CD2 TRP A 13 10.551 12.128 -3.638 1.00 73.11 C ATOM 195 NE1 TRP A 13 8.687 13.259 -3.999 1.00 74.24 N ATOM 196 CE2 TRP A 13 10.003 13.441 -3.636 1.00 2.21 C ATOM 197 CE3 TRP A 13 11.891 12.005 -3.215 1.00 20.34 C ATOM 198 CZ2 TRP A 13 10.766 14.568 -3.305 1.00 0.32 C ATOM 199 CZ3 TRP A 13 12.660 13.123 -2.845 1.00 53.35 C ATOM 200 CH2 TRP A 13 12.101 14.408 -2.906 1.00 41.05 C ATOM 0 H TRP A 13 9.373 7.410 -4.908 1.00 21.40 H new ATOM 0 HA TRP A 13 8.215 9.675 -5.990 1.00 71.24 H new ATOM 0 HB2 TRP A 13 9.001 9.209 -3.652 1.00 40.33 H new ATOM 0 HB3 TRP A 13 10.652 9.416 -4.201 1.00 40.33 H new ATOM 0 HD1 TRP A 13 7.480 11.579 -4.689 1.00 53.14 H new ATOM 0 HE1 TRP A 13 7.992 14.005 -4.024 1.00 74.24 H new ATOM 0 HE3 TRP A 13 12.340 11.023 -3.174 1.00 20.34 H new ATOM 0 HZ2 TRP A 13 10.329 15.554 -3.357 1.00 0.32 H new ATOM 0 HZ3 TRP A 13 13.680 12.992 -2.514 1.00 53.35 H new ATOM 0 HH2 TRP A 13 12.696 15.271 -2.647 1.00 41.05 H new ATOM 210 N SER A 14 11.405 9.513 -6.847 1.00 52.14 N ATOM 211 CA SER A 14 12.376 9.800 -7.898 1.00 51.45 C ATOM 212 C SER A 14 13.238 8.556 -8.164 1.00 3.44 C ATOM 213 O SER A 14 13.537 8.230 -9.318 1.00 42.44 O ATOM 214 CB SER A 14 13.194 11.037 -7.503 1.00 55.34 C ATOM 215 OG SER A 14 14.025 11.446 -8.566 1.00 73.42 O ATOM 0 H SER A 14 11.806 8.983 -6.073 1.00 52.14 H new ATOM 0 HA SER A 14 11.875 10.034 -8.838 1.00 51.45 H new ATOM 0 HB2 SER A 14 12.523 11.850 -7.226 1.00 55.34 H new ATOM 0 HB3 SER A 14 13.801 10.813 -6.626 1.00 55.34 H new ATOM 0 HG SER A 14 14.537 12.237 -8.295 1.00 73.42 H new ATOM 220 N GLY A 15 13.568 7.780 -7.128 1.00 4.23 N ATOM 221 CA GLY A 15 14.230 6.495 -7.302 1.00 42.22 C ATOM 222 C GLY A 15 14.724 5.838 -6.025 1.00 42.14 C ATOM 223 O GLY A 15 15.308 4.767 -6.110 1.00 62.42 O ATOM 0 H GLY A 15 13.384 8.026 -6.156 1.00 4.23 H new ATOM 0 HA2 GLY A 15 13.538 5.813 -7.797 1.00 42.22 H new ATOM 0 HA3 GLY A 15 15.079 6.631 -7.972 1.00 42.22 H new ATOM 227 N GLU A 16 14.493 6.406 -4.845 1.00 51.34 N ATOM 228 CA GLU A 16 14.943 5.788 -3.604 1.00 55.01 C ATOM 229 C GLU A 16 14.035 4.614 -3.296 1.00 55.04 C ATOM 230 O GLU A 16 14.521 3.498 -3.100 1.00 20.52 O ATOM 231 CB GLU A 16 14.868 6.767 -2.444 1.00 0.32 C ATOM 232 CG GLU A 16 15.884 7.906 -2.600 1.00 42.32 C ATOM 233 CD GLU A 16 16.053 8.699 -1.308 1.00 15.43 C ATOM 234 OE1 GLU A 16 16.727 8.193 -0.383 1.00 44.11 O ATOM 235 OE2 GLU A 16 15.526 9.834 -1.243 1.00 31.51 O ATOM 0 H GLU A 16 13.999 7.290 -4.723 1.00 51.34 H new ATOM 0 HA GLU A 16 15.978 5.470 -3.728 1.00 55.01 H new ATOM 0 HB2 GLU A 16 13.862 7.182 -2.382 1.00 0.32 H new ATOM 0 HB3 GLU A 16 15.053 6.239 -1.509 1.00 0.32 H new ATOM 0 HG2 GLU A 16 16.847 7.494 -2.902 1.00 42.32 H new ATOM 0 HG3 GLU A 16 15.560 8.575 -3.397 1.00 42.32 H new ATOM 240 N THR A 17 12.715 4.853 -3.287 1.00 71.43 N ATOM 241 CA THR A 17 11.708 3.885 -2.885 1.00 31.21 C ATOM 242 C THR A 17 11.952 2.537 -3.584 1.00 20.43 C ATOM 243 O THR A 17 11.836 1.508 -2.930 1.00 14.33 O ATOM 244 CB THR A 17 10.301 4.415 -3.200 1.00 42.11 C ATOM 245 OG1 THR A 17 10.138 5.800 -2.952 1.00 40.31 O ATOM 246 CG2 THR A 17 9.208 3.644 -2.433 1.00 12.10 C ATOM 0 H THR A 17 12.318 5.750 -3.568 1.00 71.43 H new ATOM 0 HA THR A 17 11.782 3.730 -1.809 1.00 31.21 H new ATOM 0 HB THR A 17 10.189 4.253 -4.272 1.00 42.11 H new ATOM 0 HG1 THR A 17 9.291 6.104 -3.340 1.00 40.31 H new ATOM 0 HG21 THR A 17 8.229 4.052 -2.686 1.00 12.10 H new ATOM 0 HG22 THR A 17 9.244 2.590 -2.709 1.00 12.10 H new ATOM 0 HG23 THR A 17 9.377 3.744 -1.361 1.00 12.10 H new ATOM 254 N LYS A 18 12.353 2.547 -4.870 1.00 54.21 N ATOM 255 CA LYS A 18 12.540 1.362 -5.720 1.00 15.23 C ATOM 256 C LYS A 18 13.394 0.285 -5.067 1.00 73.53 C ATOM 257 O LYS A 18 13.153 -0.899 -5.279 1.00 0.42 O ATOM 258 CB LYS A 18 13.058 1.774 -7.116 1.00 62.23 C ATOM 259 CG LYS A 18 14.588 1.887 -7.221 1.00 73.22 C ATOM 260 CD LYS A 18 15.063 2.707 -8.432 1.00 54.22 C ATOM 261 CE LYS A 18 16.545 3.073 -8.262 1.00 24.42 C ATOM 262 NZ LYS A 18 17.017 4.076 -9.240 1.00 32.43 N ATOM 0 H LYS A 18 12.563 3.416 -5.361 1.00 54.21 H new ATOM 0 HA LYS A 18 11.562 0.898 -5.852 1.00 15.23 H new ATOM 0 HB2 LYS A 18 12.709 1.046 -7.848 1.00 62.23 H new ATOM 0 HB3 LYS A 18 12.616 2.734 -7.385 1.00 62.23 H new ATOM 0 HG2 LYS A 18 14.974 2.344 -6.310 1.00 73.22 H new ATOM 0 HG3 LYS A 18 15.015 0.886 -7.281 1.00 73.22 H new ATOM 0 HD2 LYS A 18 14.923 2.134 -9.349 1.00 54.22 H new ATOM 0 HD3 LYS A 18 14.464 3.612 -8.528 1.00 54.22 H new ATOM 0 HE2 LYS A 18 16.704 3.456 -7.254 1.00 24.42 H new ATOM 0 HE3 LYS A 18 17.148 2.170 -8.358 1.00 24.42 H new ATOM 0 HZ1 LYS A 18 18.023 4.279 -9.071 1.00 32.43 H new ATOM 0 HZ2 LYS A 18 16.895 3.705 -10.204 1.00 32.43 H new ATOM 0 HZ3 LYS A 18 16.465 4.951 -9.134 1.00 32.43 H new ATOM 272 N LYS A 19 14.394 0.693 -4.290 1.00 55.12 N ATOM 273 CA LYS A 19 15.337 -0.209 -3.667 1.00 32.30 C ATOM 274 C LYS A 19 14.552 -1.105 -2.707 1.00 0.23 C ATOM 275 O LYS A 19 14.525 -2.328 -2.878 1.00 11.04 O ATOM 276 CB LYS A 19 16.430 0.668 -3.034 1.00 71.24 C ATOM 277 CG LYS A 19 17.784 -0.042 -2.970 1.00 21.55 C ATOM 278 CD LYS A 19 18.943 0.945 -2.756 1.00 11.25 C ATOM 279 CE LYS A 19 19.220 1.870 -3.954 1.00 2.43 C ATOM 280 NZ LYS A 19 19.450 1.149 -5.225 1.00 53.31 N ATOM 0 H LYS A 19 14.568 1.675 -4.077 1.00 55.12 H new ATOM 0 HA LYS A 19 15.846 -0.891 -4.348 1.00 32.30 H new ATOM 0 HB2 LYS A 19 16.532 1.588 -3.609 1.00 71.24 H new ATOM 0 HB3 LYS A 19 16.125 0.954 -2.027 1.00 71.24 H new ATOM 0 HG2 LYS A 19 17.773 -0.770 -2.159 1.00 21.55 H new ATOM 0 HG3 LYS A 19 17.946 -0.597 -3.894 1.00 21.55 H new ATOM 0 HD2 LYS A 19 18.725 1.558 -1.882 1.00 11.25 H new ATOM 0 HD3 LYS A 19 19.848 0.381 -2.532 1.00 11.25 H new ATOM 0 HE2 LYS A 19 18.376 2.549 -4.080 1.00 2.43 H new ATOM 0 HE3 LYS A 19 20.093 2.484 -3.733 1.00 2.43 H new ATOM 0 HZ1 LYS A 19 19.746 1.824 -5.959 1.00 53.31 H new ATOM 0 HZ2 LYS A 19 20.195 0.436 -5.090 1.00 53.31 H new ATOM 0 HZ3 LYS A 19 18.571 0.679 -5.521 1.00 53.31 H new ATOM 290 N MET A 20 13.819 -0.478 -1.784 1.00 20.53 N ATOM 291 CA MET A 20 12.852 -1.087 -0.879 1.00 24.14 C ATOM 292 C MET A 20 11.529 -1.339 -1.616 1.00 2.22 C ATOM 293 O MET A 20 10.455 -0.896 -1.212 1.00 24.12 O ATOM 294 CB MET A 20 12.669 -0.166 0.338 1.00 3.43 C ATOM 295 CG MET A 20 11.985 -0.884 1.493 1.00 75.11 C ATOM 296 SD MET A 20 12.870 -2.324 2.153 1.00 44.24 S ATOM 297 CE MET A 20 14.344 -1.501 2.811 1.00 40.10 C ATOM 0 H MET A 20 13.892 0.530 -1.643 1.00 20.53 H new ATOM 0 HA MET A 20 13.212 -2.054 -0.528 1.00 24.14 H new ATOM 0 HB2 MET A 20 13.641 0.203 0.664 1.00 3.43 H new ATOM 0 HB3 MET A 20 12.079 0.704 0.050 1.00 3.43 H new ATOM 0 HG2 MET A 20 11.834 -0.170 2.303 1.00 75.11 H new ATOM 0 HG3 MET A 20 10.997 -1.206 1.163 1.00 75.11 H new ATOM 0 HE1 MET A 20 14.963 -2.228 3.336 1.00 40.10 H new ATOM 0 HE2 MET A 20 14.914 -1.065 1.991 1.00 40.10 H new ATOM 0 HE3 MET A 20 14.043 -0.714 3.503 1.00 40.10 H new ATOM 305 N ALA A 21 11.613 -2.055 -2.724 1.00 64.52 N ATOM 306 CA ALA A 21 10.488 -2.574 -3.480 1.00 21.51 C ATOM 307 C ALA A 21 10.954 -3.935 -3.980 1.00 33.53 C ATOM 308 O ALA A 21 10.414 -4.965 -3.584 1.00 73.31 O ATOM 309 CB ALA A 21 10.126 -1.620 -4.614 1.00 73.54 C ATOM 0 H ALA A 21 12.511 -2.302 -3.140 1.00 64.52 H new ATOM 0 HA ALA A 21 9.579 -2.670 -2.887 1.00 21.51 H new ATOM 0 HB1 ALA A 21 9.281 -2.022 -5.172 1.00 73.54 H new ATOM 0 HB2 ALA A 21 9.858 -0.648 -4.200 1.00 73.54 H new ATOM 0 HB3 ALA A 21 10.981 -1.507 -5.281 1.00 73.54 H new ATOM 315 N GLU A 22 12.057 -3.934 -4.743 1.00 74.52 N ATOM 316 CA GLU A 22 12.692 -5.148 -5.251 1.00 60.55 C ATOM 317 C GLU A 22 13.021 -6.096 -4.095 1.00 72.12 C ATOM 318 O GLU A 22 12.764 -7.290 -4.186 1.00 52.12 O ATOM 319 CB GLU A 22 14.027 -4.836 -5.955 1.00 14.03 C ATOM 320 CG GLU A 22 14.025 -3.779 -7.060 1.00 24.20 C ATOM 321 CD GLU A 22 15.426 -3.588 -7.652 1.00 32.52 C ATOM 322 OE1 GLU A 22 16.458 -3.754 -6.952 1.00 74.55 O ATOM 323 OE2 GLU A 22 15.521 -3.243 -8.850 1.00 61.41 O ATOM 0 H GLU A 22 12.535 -3.078 -5.025 1.00 74.52 H new ATOM 0 HA GLU A 22 11.990 -5.598 -5.953 1.00 60.55 H new ATOM 0 HB2 GLU A 22 14.741 -4.522 -5.194 1.00 14.03 H new ATOM 0 HB3 GLU A 22 14.405 -5.765 -6.382 1.00 14.03 H new ATOM 0 HG2 GLU A 22 13.332 -4.075 -7.848 1.00 24.20 H new ATOM 0 HG3 GLU A 22 13.665 -2.831 -6.659 1.00 24.20 H new ATOM 328 N LYS A 23 13.614 -5.562 -3.016 1.00 24.50 N ATOM 329 CA LYS A 23 14.022 -6.322 -1.837 1.00 33.12 C ATOM 330 C LYS A 23 12.869 -7.169 -1.319 1.00 44.11 C ATOM 331 O LYS A 23 12.963 -8.390 -1.297 1.00 33.32 O ATOM 332 CB LYS A 23 14.597 -5.360 -0.783 1.00 62.20 C ATOM 333 CG LYS A 23 14.891 -6.077 0.541 1.00 62.40 C ATOM 334 CD LYS A 23 15.739 -5.215 1.478 1.00 13.25 C ATOM 335 CE LYS A 23 15.915 -5.987 2.785 1.00 51.42 C ATOM 336 NZ LYS A 23 16.776 -5.294 3.759 1.00 71.34 N ATOM 0 H LYS A 23 13.825 -4.567 -2.943 1.00 24.50 H new ATOM 0 HA LYS A 23 14.813 -7.025 -2.098 1.00 33.12 H new ATOM 0 HB2 LYS A 23 15.513 -4.909 -1.164 1.00 62.20 H new ATOM 0 HB3 LYS A 23 13.891 -4.548 -0.608 1.00 62.20 H new ATOM 0 HG2 LYS A 23 13.952 -6.332 1.032 1.00 62.40 H new ATOM 0 HG3 LYS A 23 15.410 -7.014 0.339 1.00 62.40 H new ATOM 0 HD2 LYS A 23 16.708 -4.999 1.028 1.00 13.25 H new ATOM 0 HD3 LYS A 23 15.253 -4.257 1.662 1.00 13.25 H new ATOM 0 HE2 LYS A 23 14.936 -6.158 3.233 1.00 51.42 H new ATOM 0 HE3 LYS A 23 16.341 -6.966 2.566 1.00 51.42 H new ATOM 0 HZ1 LYS A 23 17.199 -5.990 4.405 1.00 71.34 H new ATOM 0 HZ2 LYS A 23 17.531 -4.786 3.255 1.00 71.34 H new ATOM 0 HZ3 LYS A 23 16.207 -4.616 4.305 1.00 71.34 H new ATOM 346 N ILE A 24 11.775 -6.524 -0.944 1.00 4.33 N ATOM 347 CA ILE A 24 10.599 -7.162 -0.376 1.00 15.52 C ATOM 348 C ILE A 24 9.958 -8.083 -1.422 1.00 72.05 C ATOM 349 O ILE A 24 9.523 -9.170 -1.065 1.00 3.14 O ATOM 350 CB ILE A 24 9.667 -6.029 0.111 1.00 32.10 C ATOM 351 CG1 ILE A 24 10.328 -5.148 1.204 1.00 42.15 C ATOM 352 CG2 ILE A 24 8.335 -6.570 0.636 1.00 55.22 C ATOM 353 CD1 ILE A 24 9.791 -3.715 1.171 1.00 24.31 C ATOM 0 H ILE A 24 11.679 -5.512 -1.029 1.00 4.33 H new ATOM 0 HA ILE A 24 10.836 -7.803 0.473 1.00 15.52 H new ATOM 0 HB ILE A 24 9.477 -5.409 -0.765 1.00 32.10 H new ATOM 0 HG12 ILE A 24 10.143 -5.584 2.186 1.00 42.15 H new ATOM 0 HG13 ILE A 24 11.408 -5.136 1.059 1.00 42.15 H new ATOM 0 HG21 ILE A 24 7.711 -5.740 0.968 1.00 55.22 H new ATOM 0 HG22 ILE A 24 7.824 -7.113 -0.159 1.00 55.22 H new ATOM 0 HG23 ILE A 24 8.520 -7.242 1.474 1.00 55.22 H new ATOM 0 HD11 ILE A 24 10.276 -3.127 1.950 1.00 24.31 H new ATOM 0 HD12 ILE A 24 9.999 -3.271 0.198 1.00 24.31 H new ATOM 0 HD13 ILE A 24 8.715 -3.726 1.342 1.00 24.31 H new ATOM 364 N ASN A 25 9.961 -7.719 -2.708 1.00 60.45 N ATOM 365 CA ASN A 25 9.501 -8.597 -3.789 1.00 1.11 C ATOM 366 C ASN A 25 10.451 -9.777 -4.054 1.00 34.20 C ATOM 367 O ASN A 25 10.162 -10.635 -4.893 1.00 15.10 O ATOM 368 CB ASN A 25 9.277 -7.773 -5.059 1.00 64.14 C ATOM 369 CG ASN A 25 8.565 -8.540 -6.171 1.00 2.24 C ATOM 370 OD1 ASN A 25 8.926 -8.419 -7.336 1.00 23.44 O ATOM 371 ND2 ASN A 25 7.525 -9.306 -5.872 1.00 51.54 N ATOM 0 H ASN A 25 10.283 -6.806 -3.030 1.00 60.45 H new ATOM 0 HA ASN A 25 8.558 -9.041 -3.471 1.00 1.11 H new ATOM 0 HB2 ASN A 25 8.692 -6.888 -4.809 1.00 64.14 H new ATOM 0 HB3 ASN A 25 10.241 -7.424 -5.430 1.00 64.14 H new ATOM 0 HD21 ASN A 25 7.023 -9.796 -6.612 1.00 51.54 H new ATOM 0 HD22 ASN A 25 7.227 -9.405 -4.902 1.00 51.54 H new ATOM 377 N SER A 26 11.557 -9.854 -3.321 1.00 71.14 N ATOM 378 CA SER A 26 12.394 -11.026 -3.180 1.00 4.10 C ATOM 379 C SER A 26 12.057 -11.759 -1.877 1.00 74.10 C ATOM 380 O SER A 26 11.939 -12.985 -1.912 1.00 14.22 O ATOM 381 CB SER A 26 13.881 -10.635 -3.258 1.00 51.31 C ATOM 382 OG SER A 26 14.555 -11.310 -4.307 1.00 52.12 O ATOM 0 H SER A 26 11.905 -9.059 -2.786 1.00 71.14 H new ATOM 0 HA SER A 26 12.197 -11.713 -4.003 1.00 4.10 H new ATOM 0 HB2 SER A 26 13.965 -9.559 -3.407 1.00 51.31 H new ATOM 0 HB3 SER A 26 14.366 -10.864 -2.309 1.00 51.31 H new ATOM 0 HG SER A 26 15.495 -11.033 -4.324 1.00 52.12 H new ATOM 387 N GLU A 27 11.911 -11.057 -0.742 1.00 40.54 N ATOM 388 CA GLU A 27 11.717 -11.684 0.561 1.00 34.44 C ATOM 389 C GLU A 27 10.291 -12.173 0.860 1.00 4.52 C ATOM 390 O GLU A 27 10.113 -12.960 1.792 1.00 13.22 O ATOM 391 CB GLU A 27 12.338 -10.872 1.713 1.00 44.42 C ATOM 392 CG GLU A 27 12.180 -9.381 1.929 1.00 44.22 C ATOM 393 CD GLU A 27 12.894 -8.941 3.220 1.00 55.50 C ATOM 394 OE1 GLU A 27 12.749 -9.583 4.292 1.00 63.13 O ATOM 395 OE2 GLU A 27 13.624 -7.930 3.188 1.00 64.43 O ATOM 0 H GLU A 27 11.925 -10.038 -0.709 1.00 40.54 H new ATOM 0 HA GLU A 27 12.286 -12.611 0.489 1.00 34.44 H new ATOM 0 HB2 GLU A 27 11.985 -11.343 2.631 1.00 44.42 H new ATOM 0 HB3 GLU A 27 13.412 -11.050 1.656 1.00 44.42 H new ATOM 0 HG2 GLU A 27 12.591 -8.839 1.077 1.00 44.22 H new ATOM 0 HG3 GLU A 27 11.122 -9.127 1.988 1.00 44.22 H new ATOM 400 N ILE A 28 9.282 -11.769 0.089 1.00 60.42 N ATOM 401 CA ILE A 28 7.944 -12.359 0.093 1.00 53.44 C ATOM 402 C ILE A 28 7.993 -13.615 -0.805 1.00 62.42 C ATOM 403 O ILE A 28 8.963 -13.864 -1.526 1.00 35.14 O ATOM 404 CB ILE A 28 6.890 -11.277 -0.296 1.00 54.14 C ATOM 405 CG1 ILE A 28 6.895 -10.152 0.766 1.00 33.21 C ATOM 406 CG2 ILE A 28 5.445 -11.813 -0.373 1.00 42.22 C ATOM 407 CD1 ILE A 28 5.948 -8.980 0.479 1.00 22.12 C ATOM 0 H ILE A 28 9.376 -11.000 -0.575 1.00 60.42 H new ATOM 0 HA ILE A 28 7.623 -12.695 1.079 1.00 53.44 H new ATOM 0 HB ILE A 28 7.178 -10.926 -1.287 1.00 54.14 H new ATOM 0 HG12 ILE A 28 6.631 -10.584 1.731 1.00 33.21 H new ATOM 0 HG13 ILE A 28 7.910 -9.765 0.857 1.00 33.21 H new ATOM 0 HG21 ILE A 28 4.770 -11.002 -0.649 1.00 42.22 H new ATOM 0 HG22 ILE A 28 5.389 -12.602 -1.123 1.00 42.22 H new ATOM 0 HG23 ILE A 28 5.153 -12.213 0.598 1.00 42.22 H new ATOM 0 HD11 ILE A 28 6.025 -8.245 1.281 1.00 22.12 H new ATOM 0 HD12 ILE A 28 6.222 -8.514 -0.468 1.00 22.12 H new ATOM 0 HD13 ILE A 28 4.923 -9.346 0.420 1.00 22.12 H new ATOM 418 N LYS A 29 6.969 -14.460 -0.723 1.00 34.03 N ATOM 419 CA LYS A 29 6.636 -15.553 -1.644 1.00 12.54 C ATOM 420 C LYS A 29 6.573 -15.134 -3.120 1.00 23.10 C ATOM 421 O LYS A 29 7.098 -14.112 -3.535 1.00 3.34 O ATOM 422 CB LYS A 29 5.327 -16.230 -1.171 1.00 4.10 C ATOM 423 CG LYS A 29 5.424 -17.737 -0.902 1.00 20.02 C ATOM 424 CD LYS A 29 5.807 -18.703 -2.037 1.00 12.51 C ATOM 425 CE LYS A 29 7.270 -18.649 -2.513 1.00 72.25 C ATOM 426 NZ LYS A 29 8.264 -18.925 -1.452 1.00 43.14 N ATOM 0 H LYS A 29 6.299 -14.398 0.043 1.00 34.03 H new ATOM 0 HA LYS A 29 7.454 -16.272 -1.609 1.00 12.54 H new ATOM 0 HB2 LYS A 29 4.992 -15.736 -0.259 1.00 4.10 H new ATOM 0 HB3 LYS A 29 4.558 -16.062 -1.925 1.00 4.10 H new ATOM 0 HG2 LYS A 29 6.150 -17.876 -0.101 1.00 20.02 H new ATOM 0 HG3 LYS A 29 4.457 -18.059 -0.516 1.00 20.02 H new ATOM 0 HD2 LYS A 29 5.591 -19.720 -1.709 1.00 12.51 H new ATOM 0 HD3 LYS A 29 5.161 -18.500 -2.891 1.00 12.51 H new ATOM 0 HE2 LYS A 29 7.405 -19.371 -3.318 1.00 72.25 H new ATOM 0 HE3 LYS A 29 7.468 -17.663 -2.933 1.00 72.25 H new ATOM 0 HZ1 LYS A 29 9.220 -18.920 -1.862 1.00 43.14 H new ATOM 0 HZ2 LYS A 29 8.199 -18.193 -0.716 1.00 43.14 H new ATOM 0 HZ3 LYS A 29 8.073 -19.857 -1.031 1.00 43.14 H new ATOM 436 N ASP A 30 5.968 -15.984 -3.944 1.00 4.53 N ATOM 437 CA ASP A 30 5.610 -15.815 -5.343 1.00 4.51 C ATOM 438 C ASP A 30 4.557 -14.706 -5.459 1.00 15.20 C ATOM 439 O ASP A 30 3.390 -14.951 -5.761 1.00 1.31 O ATOM 440 CB ASP A 30 5.123 -17.163 -5.896 1.00 52.22 C ATOM 441 CG ASP A 30 4.952 -17.188 -7.420 1.00 63.03 C ATOM 442 OD1 ASP A 30 3.907 -16.773 -7.975 1.00 63.32 O ATOM 443 OD2 ASP A 30 5.839 -17.750 -8.093 1.00 31.23 O ATOM 0 H ASP A 30 5.688 -16.906 -3.609 1.00 4.53 H new ATOM 0 HA ASP A 30 6.469 -15.508 -5.940 1.00 4.51 H new ATOM 0 HB2 ASP A 30 5.832 -17.939 -5.608 1.00 52.22 H new ATOM 0 HB3 ASP A 30 4.170 -17.412 -5.430 1.00 52.22 H new ATOM 447 N SER A 31 4.964 -13.503 -5.084 1.00 20.11 N ATOM 448 CA SER A 31 4.148 -12.303 -4.989 1.00 20.24 C ATOM 449 C SER A 31 4.155 -11.519 -6.301 1.00 15.22 C ATOM 450 O SER A 31 4.821 -11.904 -7.269 1.00 4.42 O ATOM 451 CB SER A 31 4.617 -11.456 -3.801 1.00 23.34 C ATOM 452 OG SER A 31 5.844 -10.782 -4.010 1.00 20.44 O ATOM 0 H SER A 31 5.934 -13.328 -4.821 1.00 20.11 H new ATOM 0 HA SER A 31 3.111 -12.589 -4.812 1.00 20.24 H new ATOM 0 HB2 SER A 31 3.847 -10.720 -3.569 1.00 23.34 H new ATOM 0 HB3 SER A 31 4.715 -12.101 -2.927 1.00 23.34 H new ATOM 0 HG SER A 31 6.073 -10.264 -3.210 1.00 20.44 H new ATOM 457 N GLU A 32 3.433 -10.399 -6.326 1.00 1.10 N ATOM 458 CA GLU A 32 3.343 -9.496 -7.452 1.00 1.32 C ATOM 459 C GLU A 32 3.754 -8.101 -6.993 1.00 62.34 C ATOM 460 O GLU A 32 3.649 -7.762 -5.813 1.00 12.54 O ATOM 461 CB GLU A 32 1.905 -9.502 -7.963 1.00 75.04 C ATOM 462 CG GLU A 32 1.718 -9.093 -9.421 1.00 61.02 C ATOM 463 CD GLU A 32 1.949 -10.195 -10.465 1.00 75.23 C ATOM 464 OE1 GLU A 32 2.493 -11.278 -10.135 1.00 75.31 O ATOM 465 OE2 GLU A 32 1.510 -9.957 -11.616 1.00 62.31 O ATOM 0 H GLU A 32 2.877 -10.092 -5.528 1.00 1.10 H new ATOM 0 HA GLU A 32 4.005 -9.807 -8.260 1.00 1.32 H new ATOM 0 HB2 GLU A 32 1.496 -10.504 -7.831 1.00 75.04 H new ATOM 0 HB3 GLU A 32 1.314 -8.832 -7.338 1.00 75.04 H new ATOM 0 HG2 GLU A 32 0.704 -8.711 -9.543 1.00 61.02 H new ATOM 0 HG3 GLU A 32 2.397 -8.268 -9.636 1.00 61.02 H new ATOM 470 N LEU A 33 4.183 -7.297 -7.956 1.00 11.43 N ATOM 471 CA LEU A 33 4.789 -5.978 -7.769 1.00 51.12 C ATOM 472 C LEU A 33 4.292 -5.027 -8.858 1.00 72.42 C ATOM 473 O LEU A 33 4.861 -4.975 -9.949 1.00 35.50 O ATOM 474 CB LEU A 33 6.327 -6.116 -7.754 1.00 24.24 C ATOM 475 CG LEU A 33 7.107 -4.799 -7.529 1.00 35.52 C ATOM 476 CD1 LEU A 33 6.954 -4.271 -6.098 1.00 24.53 C ATOM 477 CD2 LEU A 33 8.608 -5.012 -7.756 1.00 32.21 C ATOM 0 H LEU A 33 4.116 -7.557 -8.940 1.00 11.43 H new ATOM 0 HA LEU A 33 4.493 -5.552 -6.810 1.00 51.12 H new ATOM 0 HB2 LEU A 33 6.604 -6.822 -6.971 1.00 24.24 H new ATOM 0 HB3 LEU A 33 6.646 -6.550 -8.702 1.00 24.24 H new ATOM 0 HG LEU A 33 6.691 -4.083 -8.238 1.00 35.52 H new ATOM 0 HD11 LEU A 33 7.519 -3.345 -5.989 1.00 24.53 H new ATOM 0 HD12 LEU A 33 5.901 -4.079 -5.892 1.00 24.53 H new ATOM 0 HD13 LEU A 33 7.333 -5.012 -5.394 1.00 24.53 H new ATOM 0 HD21 LEU A 33 9.137 -4.073 -7.593 1.00 32.21 H new ATOM 0 HD22 LEU A 33 8.978 -5.764 -7.059 1.00 32.21 H new ATOM 0 HD23 LEU A 33 8.777 -5.351 -8.778 1.00 32.21 H new ATOM 488 N LYS A 34 3.216 -4.290 -8.573 1.00 24.53 N ATOM 489 CA LYS A 34 2.808 -3.146 -9.390 1.00 3.41 C ATOM 490 C LYS A 34 3.603 -1.934 -8.938 1.00 23.23 C ATOM 491 O LYS A 34 4.092 -1.866 -7.807 1.00 60.32 O ATOM 492 CB LYS A 34 1.298 -2.859 -9.240 1.00 24.34 C ATOM 493 CG LYS A 34 0.449 -3.357 -10.417 1.00 11.32 C ATOM 494 CD LYS A 34 0.462 -2.434 -11.647 1.00 72.51 C ATOM 495 CE LYS A 34 -0.254 -3.130 -12.816 1.00 73.23 C ATOM 496 NZ LYS A 34 -0.724 -2.176 -13.845 1.00 21.43 N ATOM 0 H LYS A 34 2.607 -4.468 -7.775 1.00 24.53 H new ATOM 0 HA LYS A 34 3.001 -3.369 -10.439 1.00 3.41 H new ATOM 0 HB2 LYS A 34 0.939 -3.326 -8.323 1.00 24.34 H new ATOM 0 HB3 LYS A 34 1.152 -1.785 -9.129 1.00 24.34 H new ATOM 0 HG2 LYS A 34 0.806 -4.343 -10.714 1.00 11.32 H new ATOM 0 HG3 LYS A 34 -0.581 -3.479 -10.080 1.00 11.32 H new ATOM 0 HD2 LYS A 34 -0.032 -1.491 -11.413 1.00 72.51 H new ATOM 0 HD3 LYS A 34 1.488 -2.195 -11.925 1.00 72.51 H new ATOM 0 HE2 LYS A 34 0.424 -3.850 -13.276 1.00 73.23 H new ATOM 0 HE3 LYS A 34 -1.105 -3.693 -12.432 1.00 73.23 H new ATOM 0 HZ1 LYS A 34 -1.199 -2.697 -14.610 1.00 21.43 H new ATOM 0 HZ2 LYS A 34 -1.392 -1.504 -13.416 1.00 21.43 H new ATOM 0 HZ3 LYS A 34 0.089 -1.656 -14.233 1.00 21.43 H new ATOM 506 N GLU A 35 3.603 -0.904 -9.774 1.00 33.52 N ATOM 507 CA GLU A 35 4.003 0.430 -9.389 1.00 60.54 C ATOM 508 C GLU A 35 2.820 1.366 -9.612 1.00 75.55 C ATOM 509 O GLU A 35 1.856 1.016 -10.295 1.00 74.45 O ATOM 510 CB GLU A 35 5.261 0.828 -10.171 1.00 3.01 C ATOM 511 CG GLU A 35 4.956 1.628 -11.443 1.00 43.15 C ATOM 512 CD GLU A 35 6.217 1.919 -12.227 1.00 42.33 C ATOM 513 OE1 GLU A 35 7.003 2.783 -11.764 1.00 43.45 O ATOM 514 OE2 GLU A 35 6.380 1.298 -13.302 1.00 74.14 O ATOM 0 H GLU A 35 3.320 -0.980 -10.751 1.00 33.52 H new ATOM 0 HA GLU A 35 4.269 0.487 -8.333 1.00 60.54 H new ATOM 0 HB2 GLU A 35 5.910 1.419 -9.525 1.00 3.01 H new ATOM 0 HB3 GLU A 35 5.813 -0.072 -10.440 1.00 3.01 H new ATOM 0 HG2 GLU A 35 4.258 1.070 -12.067 1.00 43.15 H new ATOM 0 HG3 GLU A 35 4.467 2.565 -11.177 1.00 43.15 H new ATOM 519 N VAL A 36 2.929 2.577 -9.079 1.00 13.34 N ATOM 520 CA VAL A 36 1.954 3.646 -9.203 1.00 71.21 C ATOM 521 C VAL A 36 2.736 4.949 -9.450 1.00 41.13 C ATOM 522 O VAL A 36 3.929 5.023 -9.114 1.00 12.12 O ATOM 523 CB VAL A 36 1.132 3.691 -7.892 1.00 41.05 C ATOM 524 CG1 VAL A 36 -0.184 4.443 -8.099 1.00 53.21 C ATOM 525 CG2 VAL A 36 0.776 2.306 -7.307 1.00 55.35 C ATOM 0 H VAL A 36 3.739 2.850 -8.523 1.00 13.34 H new ATOM 0 HA VAL A 36 1.260 3.497 -10.030 1.00 71.21 H new ATOM 0 HB VAL A 36 1.788 4.199 -7.185 1.00 41.05 H new ATOM 0 HG11 VAL A 36 -0.744 4.461 -7.164 1.00 53.21 H new ATOM 0 HG12 VAL A 36 0.027 5.465 -8.416 1.00 53.21 H new ATOM 0 HG13 VAL A 36 -0.774 3.940 -8.865 1.00 53.21 H new ATOM 0 HG21 VAL A 36 0.201 2.435 -6.390 1.00 55.35 H new ATOM 0 HG22 VAL A 36 0.184 1.746 -8.031 1.00 55.35 H new ATOM 0 HG23 VAL A 36 1.692 1.758 -7.086 1.00 55.35 H new ATOM 535 N LYS A 37 2.116 5.991 -10.017 1.00 33.11 N ATOM 536 CA LYS A 37 2.603 7.361 -9.924 1.00 1.11 C ATOM 537 C LYS A 37 1.433 8.346 -9.919 1.00 60.35 C ATOM 538 O LYS A 37 0.320 7.970 -10.298 1.00 14.43 O ATOM 539 CB LYS A 37 3.630 7.651 -11.031 1.00 43.44 C ATOM 540 CG LYS A 37 3.119 7.943 -12.453 1.00 11.31 C ATOM 541 CD LYS A 37 3.029 6.725 -13.388 1.00 0.00 C ATOM 542 CE LYS A 37 2.784 7.274 -14.804 1.00 44.04 C ATOM 543 NZ LYS A 37 2.600 6.235 -15.832 1.00 55.35 N ATOM 0 H LYS A 37 1.255 5.900 -10.557 1.00 33.11 H new ATOM 0 HA LYS A 37 3.126 7.492 -8.977 1.00 1.11 H new ATOM 0 HB2 LYS A 37 4.228 8.505 -10.712 1.00 43.44 H new ATOM 0 HB3 LYS A 37 4.303 6.796 -11.090 1.00 43.44 H new ATOM 0 HG2 LYS A 37 2.130 8.396 -12.379 1.00 11.31 H new ATOM 0 HG3 LYS A 37 3.775 8.683 -12.911 1.00 11.31 H new ATOM 0 HD2 LYS A 37 3.949 6.141 -13.353 1.00 0.00 H new ATOM 0 HD3 LYS A 37 2.219 6.062 -13.084 1.00 0.00 H new ATOM 0 HE2 LYS A 37 1.900 7.912 -14.786 1.00 44.04 H new ATOM 0 HE3 LYS A 37 3.627 7.905 -15.088 1.00 44.04 H new ATOM 0 HZ1 LYS A 37 2.441 6.685 -16.756 1.00 55.35 H new ATOM 0 HZ2 LYS A 37 3.451 5.639 -15.879 1.00 55.35 H new ATOM 0 HZ3 LYS A 37 1.778 5.646 -15.587 1.00 55.35 H new ATOM 553 N VAL A 38 1.720 9.593 -9.547 1.00 71.34 N ATOM 554 CA VAL A 38 0.871 10.759 -9.745 1.00 14.21 C ATOM 555 C VAL A 38 1.332 11.439 -11.037 1.00 24.43 C ATOM 556 O VAL A 38 2.382 11.104 -11.595 1.00 23.14 O ATOM 557 CB VAL A 38 0.961 11.725 -8.534 1.00 71.24 C ATOM 558 CG1 VAL A 38 0.155 11.208 -7.331 1.00 64.35 C ATOM 559 CG2 VAL A 38 2.410 12.032 -8.105 1.00 1.31 C ATOM 0 H VAL A 38 2.595 9.825 -9.077 1.00 71.34 H new ATOM 0 HA VAL A 38 -0.175 10.464 -9.826 1.00 14.21 H new ATOM 0 HB VAL A 38 0.521 12.661 -8.879 1.00 71.24 H new ATOM 0 HG11 VAL A 38 0.244 11.912 -6.504 1.00 64.35 H new ATOM 0 HG12 VAL A 38 -0.893 11.108 -7.612 1.00 64.35 H new ATOM 0 HG13 VAL A 38 0.543 10.237 -7.024 1.00 64.35 H new ATOM 0 HG21 VAL A 38 2.401 12.713 -7.254 1.00 1.31 H new ATOM 0 HG22 VAL A 38 2.910 11.105 -7.823 1.00 1.31 H new ATOM 0 HG23 VAL A 38 2.945 12.495 -8.934 1.00 1.31 H new ATOM 569 N SER A 39 0.569 12.430 -11.480 1.00 62.31 N ATOM 570 CA SER A 39 0.862 13.306 -12.580 1.00 55.01 C ATOM 571 C SER A 39 2.105 14.154 -12.278 1.00 0.00 C ATOM 572 O SER A 39 2.703 14.085 -11.197 1.00 61.21 O ATOM 573 CB SER A 39 -0.387 14.177 -12.725 1.00 4.21 C ATOM 574 OG SER A 39 -1.180 13.776 -13.817 1.00 4.21 O ATOM 0 H SER A 39 -0.327 12.648 -11.044 1.00 62.31 H new ATOM 0 HA SER A 39 1.085 12.764 -13.499 1.00 55.01 H new ATOM 0 HB2 SER A 39 -0.976 14.124 -11.809 1.00 4.21 H new ATOM 0 HB3 SER A 39 -0.091 15.218 -12.853 1.00 4.21 H new ATOM 0 HG SER A 39 -1.516 14.568 -14.286 1.00 4.21 H new ATOM 579 N GLU A 40 2.517 14.977 -13.239 1.00 35.50 N ATOM 580 CA GLU A 40 3.455 16.068 -12.989 1.00 73.53 C ATOM 581 C GLU A 40 2.734 17.194 -12.248 1.00 63.35 C ATOM 582 O GLU A 40 1.504 17.188 -12.146 1.00 23.50 O ATOM 583 CB GLU A 40 4.043 16.543 -14.325 1.00 74.31 C ATOM 584 CG GLU A 40 5.191 15.611 -14.705 1.00 55.13 C ATOM 585 CD GLU A 40 5.586 15.739 -16.172 1.00 24.30 C ATOM 586 OE1 GLU A 40 4.963 15.036 -17.000 1.00 32.53 O ATOM 587 OE2 GLU A 40 6.541 16.492 -16.483 1.00 20.43 O ATOM 0 H GLU A 40 2.211 14.907 -14.210 1.00 35.50 H new ATOM 0 HA GLU A 40 4.280 15.731 -12.361 1.00 73.53 H new ATOM 0 HB2 GLU A 40 3.277 16.536 -15.100 1.00 74.31 H new ATOM 0 HB3 GLU A 40 4.400 17.569 -14.239 1.00 74.31 H new ATOM 0 HG2 GLU A 40 6.056 15.831 -14.079 1.00 55.13 H new ATOM 0 HG3 GLU A 40 4.902 14.581 -14.499 1.00 55.13 H new ATOM 592 N GLY A 41 3.504 18.148 -11.717 1.00 15.10 N ATOM 593 CA GLY A 41 3.023 19.396 -11.147 1.00 23.43 C ATOM 594 C GLY A 41 2.101 19.229 -9.940 1.00 24.43 C ATOM 595 O GLY A 41 1.582 20.226 -9.441 1.00 74.53 O ATOM 0 H GLY A 41 4.519 18.062 -11.674 1.00 15.10 H new ATOM 0 HA2 GLY A 41 3.881 20.000 -10.852 1.00 23.43 H new ATOM 0 HA3 GLY A 41 2.492 19.952 -11.919 1.00 23.43 H new ATOM 599 N THR A 42 1.865 18.013 -9.464 1.00 54.05 N ATOM 600 CA THR A 42 0.813 17.714 -8.511 1.00 64.32 C ATOM 601 C THR A 42 1.245 18.101 -7.093 1.00 54.41 C ATOM 602 O THR A 42 0.383 18.471 -6.296 1.00 34.52 O ATOM 603 CB THR A 42 0.437 16.235 -8.712 1.00 0.42 C ATOM 604 OG1 THR A 42 -0.108 16.102 -10.020 1.00 55.25 O ATOM 605 CG2 THR A 42 -0.576 15.660 -7.719 1.00 55.35 C ATOM 0 H THR A 42 2.411 17.195 -9.736 1.00 54.05 H new ATOM 0 HA THR A 42 -0.087 18.307 -8.674 1.00 64.32 H new ATOM 0 HB THR A 42 1.356 15.671 -8.552 1.00 0.42 H new ATOM 0 HG1 THR A 42 0.569 16.352 -10.683 1.00 55.25 H new ATOM 0 HG21 THR A 42 -0.765 14.613 -7.957 1.00 55.35 H new ATOM 0 HG22 THR A 42 -0.177 15.736 -6.707 1.00 55.35 H new ATOM 0 HG23 THR A 42 -1.508 16.221 -7.785 1.00 55.35 H new ATOM 613 N PHE A 43 2.551 18.110 -6.802 1.00 55.34 N ATOM 614 CA PHE A 43 3.112 18.646 -5.565 1.00 14.41 C ATOM 615 C PHE A 43 4.401 19.398 -5.871 1.00 43.15 C ATOM 616 O PHE A 43 4.709 19.666 -7.034 1.00 60.14 O ATOM 617 CB PHE A 43 3.323 17.527 -4.533 1.00 55.04 C ATOM 618 CG PHE A 43 2.050 16.781 -4.199 1.00 63.21 C ATOM 619 CD1 PHE A 43 1.039 17.468 -3.509 1.00 15.13 C ATOM 620 CD2 PHE A 43 1.833 15.461 -4.627 1.00 35.13 C ATOM 621 CE1 PHE A 43 -0.177 16.841 -3.199 1.00 61.15 C ATOM 622 CE2 PHE A 43 0.606 14.837 -4.337 1.00 12.20 C ATOM 623 CZ PHE A 43 -0.389 15.517 -3.611 1.00 51.45 C ATOM 0 H PHE A 43 3.258 17.737 -7.435 1.00 55.34 H new ATOM 0 HA PHE A 43 2.409 19.352 -5.123 1.00 14.41 H new ATOM 0 HB2 PHE A 43 4.061 16.822 -4.916 1.00 55.04 H new ATOM 0 HB3 PHE A 43 3.736 17.956 -3.620 1.00 55.04 H new ATOM 0 HD1 PHE A 43 1.200 18.494 -3.213 1.00 15.13 H new ATOM 0 HD2 PHE A 43 2.600 14.931 -5.173 1.00 35.13 H new ATOM 0 HE1 PHE A 43 -0.941 17.371 -2.650 1.00 61.15 H new ATOM 0 HE2 PHE A 43 0.426 13.827 -4.675 1.00 12.20 H new ATOM 0 HZ PHE A 43 -1.317 15.019 -3.371 1.00 51.45 H new ATOM 632 N ASP A 44 5.141 19.771 -4.830 1.00 31.50 N ATOM 633 CA ASP A 44 6.497 20.295 -4.913 1.00 15.24 C ATOM 634 C ASP A 44 7.227 19.750 -3.678 1.00 52.15 C ATOM 635 O ASP A 44 6.759 18.782 -3.070 1.00 24.32 O ATOM 636 CB ASP A 44 6.453 21.834 -4.990 1.00 62.15 C ATOM 637 CG ASP A 44 7.675 22.409 -5.715 1.00 71.11 C ATOM 638 OD1 ASP A 44 8.807 21.974 -5.407 1.00 21.13 O ATOM 639 OD2 ASP A 44 7.523 23.293 -6.585 1.00 40.22 O ATOM 0 H ASP A 44 4.798 19.714 -3.871 1.00 31.50 H new ATOM 0 HA ASP A 44 7.032 19.982 -5.810 1.00 15.24 H new ATOM 0 HB2 ASP A 44 5.545 22.145 -5.507 1.00 62.15 H new ATOM 0 HB3 ASP A 44 6.403 22.246 -3.982 1.00 62.15 H new ATOM 643 N ALA A 45 8.332 20.360 -3.261 1.00 1.03 N ATOM 644 CA ALA A 45 8.997 20.087 -1.994 1.00 74.43 C ATOM 645 C ALA A 45 9.453 21.365 -1.284 1.00 15.21 C ATOM 646 O ALA A 45 10.031 21.282 -0.196 1.00 73.32 O ATOM 647 CB ALA A 45 10.130 19.099 -2.242 1.00 15.23 C ATOM 0 H ALA A 45 8.802 21.078 -3.812 1.00 1.03 H new ATOM 0 HA ALA A 45 8.287 19.633 -1.303 1.00 74.43 H new ATOM 0 HB1 ALA A 45 10.638 18.884 -1.302 1.00 15.23 H new ATOM 0 HB2 ALA A 45 9.724 18.175 -2.654 1.00 15.23 H new ATOM 0 HB3 ALA A 45 10.840 19.529 -2.948 1.00 15.23 H new ATOM 653 N ASP A 46 9.146 22.532 -1.851 1.00 64.41 N ATOM 654 CA ASP A 46 9.438 23.823 -1.228 1.00 52.12 C ATOM 655 C ASP A 46 8.684 23.961 0.099 1.00 41.01 C ATOM 656 O ASP A 46 7.655 23.305 0.296 1.00 20.51 O ATOM 657 CB ASP A 46 9.072 24.974 -2.181 1.00 4.43 C ATOM 658 CG ASP A 46 10.287 25.799 -2.600 1.00 14.20 C ATOM 659 OD1 ASP A 46 11.228 25.223 -3.188 1.00 3.14 O ATOM 660 OD2 ASP A 46 10.282 27.028 -2.360 1.00 63.12 O ATOM 0 H ASP A 46 8.686 22.609 -2.758 1.00 64.41 H new ATOM 0 HA ASP A 46 10.507 23.874 -1.022 1.00 52.12 H new ATOM 0 HB2 ASP A 46 8.591 24.566 -3.070 1.00 4.43 H new ATOM 0 HB3 ASP A 46 8.345 25.625 -1.696 1.00 4.43 H new ATOM 664 N MET A 47 9.174 24.821 0.997 1.00 1.30 N ATOM 665 CA MET A 47 8.661 25.019 2.340 1.00 15.21 C ATOM 666 C MET A 47 7.259 25.607 2.220 1.00 2.32 C ATOM 667 O MET A 47 6.290 24.863 2.328 1.00 24.10 O ATOM 668 CB MET A 47 9.653 25.906 3.119 1.00 35.50 C ATOM 669 CG MET A 47 9.161 26.344 4.498 1.00 52.13 C ATOM 670 SD MET A 47 10.088 27.719 5.249 1.00 13.32 S ATOM 671 CE MET A 47 9.622 29.094 4.158 1.00 53.21 C ATOM 0 H MET A 47 9.973 25.420 0.791 1.00 1.30 H new ATOM 0 HA MET A 47 8.574 24.089 2.903 1.00 15.21 H new ATOM 0 HB2 MET A 47 10.591 25.364 3.237 1.00 35.50 H new ATOM 0 HB3 MET A 47 9.871 26.794 2.526 1.00 35.50 H new ATOM 0 HG2 MET A 47 8.113 26.634 4.417 1.00 52.13 H new ATOM 0 HG3 MET A 47 9.204 25.487 5.171 1.00 52.13 H new ATOM 0 HE1 MET A 47 9.870 30.040 4.639 1.00 53.21 H new ATOM 0 HE2 MET A 47 10.165 29.012 3.217 1.00 53.21 H new ATOM 0 HE3 MET A 47 8.550 29.056 3.963 1.00 53.21 H new ATOM 679 N TYR A 48 7.120 26.915 1.966 1.00 40.15 N ATOM 680 CA TYR A 48 5.802 27.554 1.976 1.00 1.13 C ATOM 681 C TYR A 48 4.908 27.010 0.864 1.00 23.12 C ATOM 682 O TYR A 48 3.686 27.090 0.962 1.00 40.14 O ATOM 683 CB TYR A 48 5.927 29.076 1.872 1.00 11.41 C ATOM 684 CG TYR A 48 6.577 29.579 0.602 1.00 74.21 C ATOM 685 CD1 TYR A 48 5.820 29.773 -0.568 1.00 12.44 C ATOM 686 CD2 TYR A 48 7.959 29.822 0.584 1.00 33.32 C ATOM 687 CE1 TYR A 48 6.451 30.172 -1.758 1.00 3.01 C ATOM 688 CE2 TYR A 48 8.596 30.227 -0.595 1.00 0.11 C ATOM 689 CZ TYR A 48 7.843 30.400 -1.776 1.00 20.22 C ATOM 690 OH TYR A 48 8.444 30.804 -2.923 1.00 60.24 O ATOM 0 H TYR A 48 7.895 27.543 1.754 1.00 40.15 H new ATOM 0 HA TYR A 48 5.332 27.314 2.930 1.00 1.13 H new ATOM 0 HB2 TYR A 48 4.932 29.513 1.951 1.00 11.41 H new ATOM 0 HB3 TYR A 48 6.502 29.437 2.724 1.00 11.41 H new ATOM 0 HD1 TYR A 48 4.752 29.615 -0.551 1.00 12.44 H new ATOM 0 HD2 TYR A 48 8.536 29.695 1.488 1.00 33.32 H new ATOM 0 HE1 TYR A 48 5.870 30.304 -2.659 1.00 3.01 H new ATOM 0 HE2 TYR A 48 9.661 30.407 -0.601 1.00 0.11 H new ATOM 0 HH TYR A 48 9.405 30.917 -2.767 1.00 60.24 H new ATOM 699 N LYS A 49 5.496 26.451 -0.198 1.00 41.03 N ATOM 700 CA LYS A 49 4.723 25.806 -1.244 1.00 54.31 C ATOM 701 C LYS A 49 4.010 24.589 -0.662 1.00 0.10 C ATOM 702 O LYS A 49 2.782 24.542 -0.727 1.00 14.12 O ATOM 703 CB LYS A 49 5.604 25.450 -2.457 1.00 64.54 C ATOM 704 CG LYS A 49 4.754 25.168 -3.704 1.00 62.33 C ATOM 705 CD LYS A 49 4.410 26.447 -4.489 1.00 23.43 C ATOM 706 CE LYS A 49 2.952 26.461 -4.962 1.00 2.12 C ATOM 707 NZ LYS A 49 2.023 26.858 -3.883 1.00 24.43 N ATOM 0 H LYS A 49 6.505 26.436 -0.349 1.00 41.03 H new ATOM 0 HA LYS A 49 3.968 26.498 -1.617 1.00 54.31 H new ATOM 0 HB2 LYS A 49 6.292 26.270 -2.662 1.00 64.54 H new ATOM 0 HB3 LYS A 49 6.211 24.575 -2.223 1.00 64.54 H new ATOM 0 HG2 LYS A 49 5.291 24.479 -4.356 1.00 62.33 H new ATOM 0 HG3 LYS A 49 3.831 24.671 -3.405 1.00 62.33 H new ATOM 0 HD2 LYS A 49 4.595 27.318 -3.860 1.00 23.43 H new ATOM 0 HD3 LYS A 49 5.071 26.531 -5.352 1.00 23.43 H new ATOM 0 HE2 LYS A 49 2.850 27.150 -5.800 1.00 2.12 H new ATOM 0 HE3 LYS A 49 2.680 25.471 -5.328 1.00 2.12 H new ATOM 0 HZ1 LYS A 49 1.048 26.854 -4.245 1.00 24.43 H new ATOM 0 HZ2 LYS A 49 2.101 26.186 -3.093 1.00 24.43 H new ATOM 0 HZ3 LYS A 49 2.265 27.813 -3.550 1.00 24.43 H new ATOM 717 N THR A 50 4.720 23.577 -0.151 1.00 51.44 N ATOM 718 CA THR A 50 4.049 22.371 0.290 1.00 41.01 C ATOM 719 C THR A 50 3.367 22.541 1.651 1.00 31.32 C ATOM 720 O THR A 50 2.431 21.790 1.925 1.00 44.33 O ATOM 721 CB THR A 50 5.023 21.200 0.207 1.00 4.31 C ATOM 722 OG1 THR A 50 6.082 21.241 1.145 1.00 13.22 O ATOM 723 CG2 THR A 50 5.626 21.112 -1.190 1.00 64.25 C ATOM 0 H THR A 50 5.734 23.576 -0.038 1.00 51.44 H new ATOM 0 HA THR A 50 3.219 22.149 -0.380 1.00 41.01 H new ATOM 0 HB THR A 50 4.422 20.322 0.444 1.00 4.31 H new ATOM 0 HG1 THR A 50 6.666 22.003 0.946 1.00 13.22 H new ATOM 0 HG21 THR A 50 6.319 20.272 -1.235 1.00 64.25 H new ATOM 0 HG22 THR A 50 4.831 20.966 -1.921 1.00 64.25 H new ATOM 0 HG23 THR A 50 6.160 22.035 -1.415 1.00 64.25 H new ATOM 731 N SER A 51 3.746 23.545 2.456 1.00 14.23 N ATOM 732 CA SER A 51 2.984 23.995 3.619 1.00 13.24 C ATOM 733 C SER A 51 1.605 24.554 3.241 1.00 71.15 C ATOM 734 O SER A 51 0.765 24.693 4.131 1.00 34.50 O ATOM 735 CB SER A 51 3.743 25.096 4.364 1.00 33.54 C ATOM 736 OG SER A 51 4.978 24.651 4.902 1.00 40.41 O ATOM 0 H SER A 51 4.606 24.073 2.310 1.00 14.23 H new ATOM 0 HA SER A 51 2.849 23.116 4.249 1.00 13.24 H new ATOM 0 HB2 SER A 51 3.928 25.927 3.683 1.00 33.54 H new ATOM 0 HB3 SER A 51 3.118 25.478 5.171 1.00 33.54 H new ATOM 0 HG SER A 51 5.653 24.624 4.192 1.00 40.41 H new ATOM 741 N ASP A 52 1.368 24.887 1.967 1.00 55.04 N ATOM 742 CA ASP A 52 0.075 25.342 1.462 1.00 22.53 C ATOM 743 C ASP A 52 -0.643 24.174 0.805 1.00 74.12 C ATOM 744 O ASP A 52 -1.743 23.826 1.220 1.00 1.01 O ATOM 745 CB ASP A 52 0.275 26.484 0.452 1.00 3.42 C ATOM 746 CG ASP A 52 -1.035 27.191 0.109 1.00 21.34 C ATOM 747 OD1 ASP A 52 -1.567 27.915 0.978 1.00 55.01 O ATOM 748 OD2 ASP A 52 -1.472 27.120 -1.063 1.00 15.30 O ATOM 0 H ASP A 52 2.088 24.845 1.246 1.00 55.04 H new ATOM 0 HA ASP A 52 -0.529 25.717 2.289 1.00 22.53 H new ATOM 0 HB2 ASP A 52 0.980 27.208 0.861 1.00 3.42 H new ATOM 0 HB3 ASP A 52 0.720 26.086 -0.460 1.00 3.42 H new ATOM 752 N ILE A 53 -0.008 23.545 -0.196 1.00 3.32 N ATOM 753 CA ILE A 53 -0.639 22.538 -1.045 1.00 22.22 C ATOM 754 C ILE A 53 -1.249 21.432 -0.193 1.00 24.52 C ATOM 755 O ILE A 53 -2.446 21.173 -0.314 1.00 12.33 O ATOM 756 CB ILE A 53 0.336 21.972 -2.113 1.00 12.30 C ATOM 757 CG1 ILE A 53 0.773 23.047 -3.134 1.00 23.31 C ATOM 758 CG2 ILE A 53 -0.333 20.794 -2.851 1.00 75.31 C ATOM 759 CD1 ILE A 53 2.007 22.621 -3.945 1.00 2.21 C ATOM 0 H ILE A 53 0.966 23.727 -0.436 1.00 3.32 H new ATOM 0 HA ILE A 53 -1.442 23.026 -1.597 1.00 22.22 H new ATOM 0 HB ILE A 53 1.232 21.631 -1.594 1.00 12.30 H new ATOM 0 HG12 ILE A 53 -0.052 23.253 -3.816 1.00 23.31 H new ATOM 0 HG13 ILE A 53 0.991 23.976 -2.608 1.00 23.31 H new ATOM 0 HG21 ILE A 53 0.352 20.398 -3.600 1.00 75.31 H new ATOM 0 HG22 ILE A 53 -0.581 20.010 -2.135 1.00 75.31 H new ATOM 0 HG23 ILE A 53 -1.244 21.141 -3.340 1.00 75.31 H new ATOM 0 HD11 ILE A 53 2.272 23.412 -4.647 1.00 2.21 H new ATOM 0 HD12 ILE A 53 2.843 22.441 -3.269 1.00 2.21 H new ATOM 0 HD13 ILE A 53 1.783 21.707 -4.495 1.00 2.21 H new ATOM 770 N ALA A 54 -0.439 20.755 0.632 1.00 55.04 N ATOM 771 CA ALA A 54 -0.965 19.619 1.369 1.00 3.14 C ATOM 772 C ALA A 54 -2.053 20.095 2.311 1.00 55.14 C ATOM 773 O ALA A 54 -3.112 19.492 2.335 1.00 15.34 O ATOM 774 CB ALA A 54 0.112 18.871 2.155 1.00 15.10 C ATOM 0 H ALA A 54 0.545 20.969 0.797 1.00 55.04 H new ATOM 0 HA ALA A 54 -1.369 18.916 0.641 1.00 3.14 H new ATOM 0 HB1 ALA A 54 -0.340 18.033 2.685 1.00 15.10 H new ATOM 0 HB2 ALA A 54 0.871 18.498 1.468 1.00 15.10 H new ATOM 0 HB3 ALA A 54 0.574 19.548 2.874 1.00 15.10 H new ATOM 780 N LEU A 55 -1.788 21.158 3.067 1.00 13.34 N ATOM 781 CA LEU A 55 -2.616 21.654 4.158 1.00 42.31 C ATOM 782 C LEU A 55 -4.061 21.824 3.697 1.00 71.43 C ATOM 783 O LEU A 55 -5.000 21.379 4.353 1.00 34.20 O ATOM 784 CB LEU A 55 -2.009 22.998 4.596 1.00 61.42 C ATOM 785 CG LEU A 55 -2.437 23.564 5.955 1.00 41.25 C ATOM 786 CD1 LEU A 55 -3.751 24.312 5.816 1.00 62.54 C ATOM 787 CD2 LEU A 55 -2.489 22.527 7.083 1.00 42.24 C ATOM 0 H LEU A 55 -0.950 21.722 2.927 1.00 13.34 H new ATOM 0 HA LEU A 55 -2.634 20.952 4.992 1.00 42.31 H new ATOM 0 HB2 LEU A 55 -0.924 22.889 4.604 1.00 61.42 H new ATOM 0 HB3 LEU A 55 -2.249 23.739 3.833 1.00 61.42 H new ATOM 0 HG LEU A 55 -1.656 24.260 6.260 1.00 41.25 H new ATOM 0 HD11 LEU A 55 -4.047 24.711 6.786 1.00 62.54 H new ATOM 0 HD12 LEU A 55 -3.630 25.132 5.109 1.00 62.54 H new ATOM 0 HD13 LEU A 55 -4.521 23.631 5.453 1.00 62.54 H new ATOM 0 HD21 LEU A 55 -2.800 23.011 8.008 1.00 42.24 H new ATOM 0 HD22 LEU A 55 -3.203 21.744 6.825 1.00 42.24 H new ATOM 0 HD23 LEU A 55 -1.501 22.087 7.218 1.00 42.24 H new ATOM 798 N ASP A 56 -4.213 22.460 2.545 1.00 55.14 N ATOM 799 CA ASP A 56 -5.462 22.866 1.920 1.00 0.02 C ATOM 800 C ASP A 56 -6.275 21.594 1.629 1.00 12.11 C ATOM 801 O ASP A 56 -7.434 21.460 2.021 1.00 2.33 O ATOM 802 CB ASP A 56 -4.990 23.637 0.669 1.00 1.13 C ATOM 803 CG ASP A 56 -5.875 24.694 0.041 1.00 53.41 C ATOM 804 OD1 ASP A 56 -6.700 25.326 0.732 1.00 62.53 O ATOM 805 OD2 ASP A 56 -5.601 25.034 -1.133 1.00 40.21 O ATOM 0 H ASP A 56 -3.406 22.725 1.981 1.00 55.14 H new ATOM 0 HA ASP A 56 -6.123 23.498 2.513 1.00 0.02 H new ATOM 0 HB2 ASP A 56 -4.045 24.118 0.924 1.00 1.13 H new ATOM 0 HB3 ASP A 56 -4.774 22.898 -0.102 1.00 1.13 H new ATOM 809 N GLN A 57 -5.630 20.595 1.022 1.00 73.32 N ATOM 810 CA GLN A 57 -6.211 19.301 0.659 1.00 2.12 C ATOM 811 C GLN A 57 -6.512 18.477 1.929 1.00 60.33 C ATOM 812 O GLN A 57 -7.603 17.928 2.078 1.00 3.24 O ATOM 813 CB GLN A 57 -5.256 18.584 -0.326 1.00 40.22 C ATOM 814 CG GLN A 57 -4.748 19.449 -1.514 1.00 35.33 C ATOM 815 CD GLN A 57 -5.364 19.164 -2.888 1.00 61.44 C ATOM 816 OE1 GLN A 57 -6.181 19.934 -3.385 1.00 33.21 O ATOM 817 NE2 GLN A 57 -4.904 18.139 -3.591 1.00 43.25 N ATOM 0 H GLN A 57 -4.647 20.669 0.759 1.00 73.32 H new ATOM 0 HA GLN A 57 -7.167 19.433 0.152 1.00 2.12 H new ATOM 0 HB2 GLN A 57 -4.393 18.221 0.232 1.00 40.22 H new ATOM 0 HB3 GLN A 57 -5.767 17.709 -0.728 1.00 40.22 H new ATOM 0 HG2 GLN A 57 -4.926 20.497 -1.272 1.00 35.33 H new ATOM 0 HG3 GLN A 57 -3.669 19.319 -1.592 1.00 35.33 H new ATOM 0 HE21 GLN A 57 -4.225 17.500 -3.177 1.00 43.25 H new ATOM 0 HE22 GLN A 57 -5.229 17.989 -4.546 1.00 43.25 H new ATOM 824 N ILE A 58 -5.567 18.417 2.872 1.00 52.01 N ATOM 825 CA ILE A 58 -5.620 17.692 4.141 1.00 54.44 C ATOM 826 C ILE A 58 -6.848 18.112 4.930 1.00 52.12 C ATOM 827 O ILE A 58 -7.612 17.254 5.369 1.00 61.55 O ATOM 828 CB ILE A 58 -4.327 17.941 4.960 1.00 61.45 C ATOM 829 CG1 ILE A 58 -3.147 17.138 4.372 1.00 24.14 C ATOM 830 CG2 ILE A 58 -4.516 17.630 6.459 1.00 11.01 C ATOM 831 CD1 ILE A 58 -1.789 17.590 4.936 1.00 15.34 C ATOM 0 H ILE A 58 -4.682 18.910 2.758 1.00 52.01 H new ATOM 0 HA ILE A 58 -5.690 16.624 3.935 1.00 54.44 H new ATOM 0 HB ILE A 58 -4.096 19.004 4.884 1.00 61.45 H new ATOM 0 HG12 ILE A 58 -3.291 16.079 4.584 1.00 24.14 H new ATOM 0 HG13 ILE A 58 -3.141 17.248 3.288 1.00 24.14 H new ATOM 0 HG21 ILE A 58 -3.583 17.820 6.990 1.00 11.01 H new ATOM 0 HG22 ILE A 58 -5.302 18.266 6.866 1.00 11.01 H new ATOM 0 HG23 ILE A 58 -4.797 16.584 6.581 1.00 11.01 H new ATOM 0 HD11 ILE A 58 -0.993 16.994 4.490 1.00 15.34 H new ATOM 0 HD12 ILE A 58 -1.629 18.642 4.701 1.00 15.34 H new ATOM 0 HD13 ILE A 58 -1.781 17.455 6.018 1.00 15.34 H new ATOM 842 N GLN A 59 -7.011 19.415 5.156 1.00 43.43 N ATOM 843 CA GLN A 59 -7.998 19.927 6.093 1.00 53.32 C ATOM 844 C GLN A 59 -9.436 19.720 5.594 1.00 34.50 C ATOM 845 O GLN A 59 -10.370 20.074 6.315 1.00 54.31 O ATOM 846 CB GLN A 59 -7.705 21.412 6.361 1.00 51.34 C ATOM 847 CG GLN A 59 -6.458 21.624 7.246 1.00 34.10 C ATOM 848 CD GLN A 59 -6.249 23.083 7.637 1.00 64.15 C ATOM 849 OE1 GLN A 59 -6.718 24.027 6.833 1.00 2.32 O flip ATOM 850 NE2 GLN A 59 -5.615 23.382 8.649 1.00 75.24 N flip ATOM 0 H GLN A 59 -6.462 20.140 4.694 1.00 43.43 H new ATOM 0 HA GLN A 59 -7.920 19.366 7.024 1.00 53.32 H new ATOM 0 HB2 GLN A 59 -7.563 21.927 5.411 1.00 51.34 H new ATOM 0 HB3 GLN A 59 -8.570 21.867 6.844 1.00 51.34 H new ATOM 0 HG2 GLN A 59 -6.553 21.021 8.149 1.00 34.10 H new ATOM 0 HG3 GLN A 59 -5.576 21.266 6.715 1.00 34.10 H new ATOM 0 HE21 GLN A 59 -5.258 22.649 9.262 1.00 75.24 H new ATOM 0 HE22 GLN A 59 -5.447 24.362 8.874 1.00 75.24 H new ATOM 857 N GLY A 60 -9.634 19.179 4.386 1.00 12.40 N ATOM 858 CA GLY A 60 -10.942 19.139 3.757 1.00 35.33 C ATOM 859 C GLY A 60 -11.373 20.539 3.324 1.00 22.13 C ATOM 860 O GLY A 60 -12.571 20.789 3.201 1.00 62.45 O ATOM 0 H GLY A 60 -8.891 18.761 3.827 1.00 12.40 H new ATOM 0 HA2 GLY A 60 -10.915 18.477 2.892 1.00 35.33 H new ATOM 0 HA3 GLY A 60 -11.673 18.726 4.452 1.00 35.33 H new ATOM 864 N ASN A 61 -10.417 21.460 3.132 1.00 15.13 N ATOM 865 CA ASN A 61 -10.680 22.738 2.483 1.00 15.21 C ATOM 866 C ASN A 61 -10.694 22.512 0.969 1.00 43.25 C ATOM 867 O ASN A 61 -11.484 23.141 0.267 1.00 0.32 O ATOM 868 CB ASN A 61 -9.622 23.806 2.819 1.00 63.45 C ATOM 869 CG ASN A 61 -9.440 24.169 4.297 1.00 53.01 C ATOM 870 OD1 ASN A 61 -10.110 23.684 5.209 1.00 32.51 O ATOM 871 ND2 ASN A 61 -8.464 25.010 4.580 1.00 2.02 N ATOM 0 H ASN A 61 -9.448 21.334 3.423 1.00 15.13 H new ATOM 0 HA ASN A 61 -11.639 23.108 2.847 1.00 15.21 H new ATOM 0 HB2 ASN A 61 -8.661 23.463 2.434 1.00 63.45 H new ATOM 0 HB3 ASN A 61 -9.876 24.716 2.276 1.00 63.45 H new ATOM 0 HD21 ASN A 61 -8.268 25.255 5.550 1.00 2.02 H new ATOM 0 HD22 ASN A 61 -7.906 25.415 3.828 1.00 2.02 H new ATOM 877 N LYS A 62 -9.834 21.620 0.456 1.00 2.33 N ATOM 878 CA LYS A 62 -9.721 21.271 -0.957 1.00 20.41 C ATOM 879 C LYS A 62 -10.027 19.800 -1.197 1.00 14.04 C ATOM 880 O LYS A 62 -10.421 19.058 -0.295 1.00 14.23 O ATOM 881 CB LYS A 62 -8.327 21.633 -1.515 1.00 15.42 C ATOM 882 CG LYS A 62 -8.045 23.119 -1.590 1.00 2.22 C ATOM 883 CD LYS A 62 -8.936 23.865 -2.597 1.00 42.34 C ATOM 884 CE LYS A 62 -8.114 24.481 -3.742 1.00 32.11 C ATOM 885 NZ LYS A 62 -8.699 24.174 -5.062 1.00 20.12 N ATOM 0 H LYS A 62 -9.176 21.106 1.041 1.00 2.33 H new ATOM 0 HA LYS A 62 -10.466 21.860 -1.493 1.00 20.41 H new ATOM 0 HB2 LYS A 62 -7.567 21.163 -0.891 1.00 15.42 H new ATOM 0 HB3 LYS A 62 -8.228 21.207 -2.513 1.00 15.42 H new ATOM 0 HG2 LYS A 62 -8.183 23.557 -0.601 1.00 2.22 H new ATOM 0 HG3 LYS A 62 -7.000 23.269 -1.862 1.00 2.22 H new ATOM 0 HD2 LYS A 62 -9.674 23.176 -3.009 1.00 42.34 H new ATOM 0 HD3 LYS A 62 -9.487 24.652 -2.081 1.00 42.34 H new ATOM 0 HE2 LYS A 62 -8.060 25.562 -3.611 1.00 32.11 H new ATOM 0 HE3 LYS A 62 -7.092 24.103 -3.700 1.00 32.11 H new ATOM 0 HZ1 LYS A 62 -8.118 24.606 -5.808 1.00 20.12 H new ATOM 0 HZ2 LYS A 62 -8.727 23.143 -5.198 1.00 20.12 H new ATOM 0 HZ3 LYS A 62 -9.665 24.556 -5.111 1.00 20.12 H new ATOM 895 N ASP A 63 -9.886 19.439 -2.463 1.00 72.44 N ATOM 896 CA ASP A 63 -10.048 18.122 -3.066 1.00 53.45 C ATOM 897 C ASP A 63 -8.750 17.303 -2.908 1.00 42.03 C ATOM 898 O ASP A 63 -8.033 17.470 -1.914 1.00 34.54 O ATOM 899 CB ASP A 63 -10.519 18.311 -4.517 1.00 54.15 C ATOM 900 CG ASP A 63 -11.255 17.077 -5.026 1.00 42.13 C ATOM 901 OD1 ASP A 63 -12.439 16.898 -4.670 1.00 53.41 O ATOM 902 OD2 ASP A 63 -10.644 16.315 -5.805 1.00 32.32 O ATOM 0 H ASP A 63 -9.629 20.131 -3.167 1.00 72.44 H new ATOM 0 HA ASP A 63 -10.814 17.535 -2.559 1.00 53.45 H new ATOM 0 HB2 ASP A 63 -11.175 19.179 -4.578 1.00 54.15 H new ATOM 0 HB3 ASP A 63 -9.660 18.514 -5.157 1.00 54.15 H new ATOM 906 N PHE A 64 -8.481 16.335 -3.790 1.00 40.14 N ATOM 907 CA PHE A 64 -7.424 15.336 -3.633 1.00 23.13 C ATOM 908 C PHE A 64 -6.647 15.100 -4.949 1.00 41.45 C ATOM 909 O PHE A 64 -7.093 15.579 -5.993 1.00 4.41 O ATOM 910 CB PHE A 64 -8.083 14.095 -3.011 1.00 44.13 C ATOM 911 CG PHE A 64 -9.236 13.432 -3.754 1.00 54.43 C ATOM 912 CD1 PHE A 64 -9.201 13.164 -5.142 1.00 31.33 C ATOM 913 CD2 PHE A 64 -10.351 13.008 -3.008 1.00 4.43 C ATOM 914 CE1 PHE A 64 -10.264 12.493 -5.765 1.00 44.05 C ATOM 915 CE2 PHE A 64 -11.409 12.332 -3.633 1.00 61.32 C ATOM 916 CZ PHE A 64 -11.370 12.079 -5.011 1.00 72.23 C ATOM 0 H PHE A 64 -9.008 16.223 -4.656 1.00 40.14 H new ATOM 0 HA PHE A 64 -6.635 15.673 -2.960 1.00 23.13 H new ATOM 0 HB2 PHE A 64 -7.306 13.344 -2.868 1.00 44.13 H new ATOM 0 HB3 PHE A 64 -8.444 14.373 -2.021 1.00 44.13 H new ATOM 0 HD1 PHE A 64 -8.349 13.478 -5.727 1.00 31.33 H new ATOM 0 HD2 PHE A 64 -10.392 13.204 -1.947 1.00 4.43 H new ATOM 0 HE1 PHE A 64 -10.230 12.295 -6.826 1.00 44.05 H new ATOM 0 HE2 PHE A 64 -12.257 12.005 -3.050 1.00 61.32 H new ATOM 0 HZ PHE A 64 -12.191 11.566 -5.491 1.00 72.23 H new ATOM 925 N PRO A 65 -5.467 14.440 -4.948 1.00 0.04 N ATOM 926 CA PRO A 65 -4.680 14.228 -6.168 1.00 32.23 C ATOM 927 C PRO A 65 -5.207 13.092 -7.065 1.00 24.24 C ATOM 928 O PRO A 65 -6.056 12.296 -6.652 1.00 73.35 O ATOM 929 CB PRO A 65 -3.262 13.916 -5.686 1.00 13.22 C ATOM 930 CG PRO A 65 -3.516 13.209 -4.359 1.00 72.13 C ATOM 931 CD PRO A 65 -4.712 13.970 -3.791 1.00 53.22 C ATOM 0 HA PRO A 65 -4.734 15.116 -6.797 1.00 32.23 H new ATOM 0 HB2 PRO A 65 -2.725 13.280 -6.389 1.00 13.22 H new ATOM 0 HB3 PRO A 65 -2.668 14.821 -5.557 1.00 13.22 H new ATOM 0 HG2 PRO A 65 -3.740 12.152 -4.501 1.00 72.13 H new ATOM 0 HG3 PRO A 65 -2.651 13.266 -3.699 1.00 72.13 H new ATOM 0 HD2 PRO A 65 -5.323 13.324 -3.161 1.00 53.22 H new ATOM 0 HD3 PRO A 65 -4.386 14.805 -3.171 1.00 53.22 H new ATOM 936 N GLU A 66 -4.619 12.975 -8.261 1.00 31.33 N ATOM 937 CA GLU A 66 -4.950 12.009 -9.315 1.00 61.54 C ATOM 938 C GLU A 66 -3.827 10.977 -9.489 1.00 75.42 C ATOM 939 O GLU A 66 -2.665 11.307 -9.241 1.00 20.43 O ATOM 940 CB GLU A 66 -5.217 12.758 -10.643 1.00 41.42 C ATOM 941 CG GLU A 66 -4.023 13.622 -11.122 1.00 52.33 C ATOM 942 CD GLU A 66 -4.003 14.003 -12.612 1.00 20.51 C ATOM 943 OE1 GLU A 66 -4.427 13.224 -13.494 1.00 34.23 O ATOM 944 OE2 GLU A 66 -3.421 15.059 -12.954 1.00 34.23 O ATOM 0 H GLU A 66 -3.853 13.590 -8.536 1.00 31.33 H new ATOM 0 HA GLU A 66 -5.851 11.469 -9.024 1.00 61.54 H new ATOM 0 HB2 GLU A 66 -5.461 12.031 -11.417 1.00 41.42 H new ATOM 0 HB3 GLU A 66 -6.091 13.398 -10.520 1.00 41.42 H new ATOM 0 HG2 GLU A 66 -4.010 14.541 -10.535 1.00 52.33 H new ATOM 0 HG3 GLU A 66 -3.102 13.086 -10.895 1.00 52.33 H new ATOM 949 N ILE A 67 -4.103 9.765 -10.001 1.00 20.31 N ATOM 950 CA ILE A 67 -3.093 8.699 -10.159 1.00 33.32 C ATOM 951 C ILE A 67 -3.167 7.996 -11.513 1.00 42.33 C ATOM 952 O ILE A 67 -4.229 7.859 -12.119 1.00 4.11 O ATOM 953 CB ILE A 67 -3.172 7.655 -9.024 1.00 55.15 C ATOM 954 CG1 ILE A 67 -4.521 6.895 -9.038 1.00 33.12 C ATOM 955 CG2 ILE A 67 -2.832 8.343 -7.693 1.00 13.11 C ATOM 956 CD1 ILE A 67 -4.605 5.727 -8.054 1.00 71.31 C ATOM 0 H ILE A 67 -5.034 9.495 -10.318 1.00 20.31 H new ATOM 0 HA ILE A 67 -2.131 9.208 -10.104 1.00 33.32 H new ATOM 0 HB ILE A 67 -2.430 6.871 -9.175 1.00 55.15 H new ATOM 0 HG12 ILE A 67 -5.322 7.600 -8.814 1.00 33.12 H new ATOM 0 HG13 ILE A 67 -4.700 6.518 -10.045 1.00 33.12 H new ATOM 0 HG21 ILE A 67 -2.885 7.615 -6.883 1.00 13.11 H new ATOM 0 HG22 ILE A 67 -1.825 8.757 -7.744 1.00 13.11 H new ATOM 0 HG23 ILE A 67 -3.545 9.146 -7.506 1.00 13.11 H new ATOM 0 HD11 ILE A 67 -5.584 5.254 -8.133 1.00 71.31 H new ATOM 0 HD12 ILE A 67 -3.830 4.998 -8.288 1.00 71.31 H new ATOM 0 HD13 ILE A 67 -4.461 6.096 -7.038 1.00 71.31 H new ATOM 967 N GLN A 68 -2.023 7.459 -11.930 1.00 43.15 N ATOM 968 CA GLN A 68 -1.790 6.846 -13.232 1.00 20.22 C ATOM 969 C GLN A 68 -1.736 5.342 -13.023 1.00 34.51 C ATOM 970 O GLN A 68 -0.679 4.704 -13.071 1.00 61.24 O ATOM 971 CB GLN A 68 -0.485 7.377 -13.826 1.00 52.45 C ATOM 972 CG GLN A 68 -0.443 8.900 -13.918 1.00 41.45 C ATOM 973 CD GLN A 68 -1.299 9.534 -15.010 1.00 20.24 C ATOM 974 OE1 GLN A 68 -1.663 8.900 -16.004 1.00 53.14 O ATOM 975 NE2 GLN A 68 -1.580 10.814 -14.858 1.00 13.10 N ATOM 0 H GLN A 68 -1.193 7.439 -11.338 1.00 43.15 H new ATOM 0 HA GLN A 68 -2.587 7.089 -13.934 1.00 20.22 H new ATOM 0 HB2 GLN A 68 0.351 7.033 -13.217 1.00 52.45 H new ATOM 0 HB3 GLN A 68 -0.348 6.955 -14.822 1.00 52.45 H new ATOM 0 HG2 GLN A 68 -0.755 9.310 -12.957 1.00 41.45 H new ATOM 0 HG3 GLN A 68 0.592 9.205 -14.074 1.00 41.45 H new ATOM 0 HE21 GLN A 68 -1.265 11.310 -14.024 1.00 13.10 H new ATOM 0 HE22 GLN A 68 -2.113 11.308 -15.574 1.00 13.10 H new ATOM 982 N LEU A 69 -2.891 4.808 -12.659 1.00 0.23 N ATOM 983 CA LEU A 69 -3.049 3.431 -12.205 1.00 60.34 C ATOM 984 C LEU A 69 -4.347 2.849 -12.745 1.00 53.21 C ATOM 985 O LEU A 69 -5.382 3.516 -12.738 1.00 64.42 O ATOM 986 CB LEU A 69 -2.991 3.449 -10.678 1.00 24.20 C ATOM 987 CG LEU A 69 -2.793 2.137 -9.903 1.00 22.42 C ATOM 988 CD1 LEU A 69 -4.033 1.259 -9.915 1.00 62.35 C ATOM 989 CD2 LEU A 69 -1.561 1.350 -10.368 1.00 40.33 C ATOM 0 H LEU A 69 -3.767 5.331 -12.670 1.00 0.23 H new ATOM 0 HA LEU A 69 -2.254 2.786 -12.580 1.00 60.34 H new ATOM 0 HB2 LEU A 69 -2.181 4.120 -10.392 1.00 24.20 H new ATOM 0 HB3 LEU A 69 -3.918 3.899 -10.323 1.00 24.20 H new ATOM 0 HG LEU A 69 -2.613 2.437 -8.871 1.00 22.42 H new ATOM 0 HD11 LEU A 69 -3.838 0.346 -9.353 1.00 62.35 H new ATOM 0 HD12 LEU A 69 -4.864 1.796 -9.457 1.00 62.35 H new ATOM 0 HD13 LEU A 69 -4.289 1.005 -10.944 1.00 62.35 H new ATOM 0 HD21 LEU A 69 -1.473 0.434 -9.784 1.00 40.33 H new ATOM 0 HD22 LEU A 69 -1.666 1.099 -11.424 1.00 40.33 H new ATOM 0 HD23 LEU A 69 -0.667 1.957 -10.227 1.00 40.33 H new ATOM 1000 N ASP A 70 -4.234 1.620 -13.232 1.00 32.51 N ATOM 1001 CA ASP A 70 -5.234 0.930 -14.054 1.00 53.33 C ATOM 1002 C ASP A 70 -6.236 0.125 -13.224 1.00 44.21 C ATOM 1003 O ASP A 70 -5.993 -0.162 -12.052 1.00 11.44 O ATOM 1004 CB ASP A 70 -4.552 -0.051 -15.008 1.00 44.14 C ATOM 1005 CG ASP A 70 -5.304 -0.165 -16.328 1.00 32.31 C ATOM 1006 OD1 ASP A 70 -5.481 0.836 -17.046 1.00 20.33 O ATOM 1007 OD2 ASP A 70 -5.710 -1.293 -16.666 1.00 44.15 O ATOM 0 H ASP A 70 -3.408 1.047 -13.060 1.00 32.51 H new ATOM 0 HA ASP A 70 -5.766 1.714 -14.593 1.00 53.33 H new ATOM 0 HB2 ASP A 70 -3.530 0.277 -15.198 1.00 44.14 H new ATOM 0 HB3 ASP A 70 -4.490 -1.033 -14.538 1.00 44.14 H new ATOM 1011 N ASN A 71 -7.309 -0.346 -13.858 1.00 52.35 N ATOM 1012 CA ASN A 71 -8.500 -0.846 -13.169 1.00 34.41 C ATOM 1013 C ASN A 71 -8.463 -2.357 -13.012 1.00 54.23 C ATOM 1014 O ASN A 71 -8.543 -3.088 -14.000 1.00 31.31 O ATOM 1015 CB ASN A 71 -9.781 -0.425 -13.910 1.00 61.25 C ATOM 1016 CG ASN A 71 -10.815 0.147 -12.963 1.00 32.44 C ATOM 1017 OD1 ASN A 71 -10.973 1.362 -12.896 1.00 1.21 O ATOM 1018 ND2 ASN A 71 -11.573 -0.665 -12.255 1.00 55.01 N ATOM 0 H ASN A 71 -7.378 -0.392 -14.875 1.00 52.35 H new ATOM 0 HA ASN A 71 -8.506 -0.401 -12.174 1.00 34.41 H new ATOM 0 HB2 ASN A 71 -9.534 0.316 -14.670 1.00 61.25 H new ATOM 0 HB3 ASN A 71 -10.201 -1.287 -14.429 1.00 61.25 H new ATOM 0 HD21 ASN A 71 -12.297 -0.285 -11.646 1.00 55.01 H new ATOM 0 HD22 ASN A 71 -11.436 -1.674 -12.316 1.00 55.01 H new ATOM 1024 N ILE A 72 -8.316 -2.843 -11.784 1.00 43.12 N ATOM 1025 CA ILE A 72 -8.020 -4.236 -11.477 1.00 14.14 C ATOM 1026 C ILE A 72 -8.848 -4.648 -10.261 1.00 20.14 C ATOM 1027 O ILE A 72 -8.949 -3.891 -9.292 1.00 51.51 O ATOM 1028 CB ILE A 72 -6.495 -4.383 -11.260 1.00 72.43 C ATOM 1029 CG1 ILE A 72 -5.738 -3.949 -12.544 1.00 72.41 C ATOM 1030 CG2 ILE A 72 -6.139 -5.823 -10.844 1.00 35.04 C ATOM 1031 CD1 ILE A 72 -4.228 -4.103 -12.475 1.00 63.53 C ATOM 0 H ILE A 72 -8.402 -2.261 -10.951 1.00 43.12 H new ATOM 0 HA ILE A 72 -8.291 -4.903 -12.295 1.00 14.14 H new ATOM 0 HB ILE A 72 -6.183 -3.729 -10.446 1.00 72.43 H new ATOM 0 HG12 ILE A 72 -6.111 -4.534 -13.384 1.00 72.41 H new ATOM 0 HG13 ILE A 72 -5.974 -2.905 -12.753 1.00 72.41 H new ATOM 0 HG21 ILE A 72 -5.062 -5.903 -10.697 1.00 35.04 H new ATOM 0 HG22 ILE A 72 -6.652 -6.071 -9.915 1.00 35.04 H new ATOM 0 HG23 ILE A 72 -6.451 -6.515 -11.626 1.00 35.04 H new ATOM 0 HD11 ILE A 72 -3.786 -3.776 -13.416 1.00 63.53 H new ATOM 0 HD12 ILE A 72 -3.837 -3.495 -11.659 1.00 63.53 H new ATOM 0 HD13 ILE A 72 -3.977 -5.149 -12.300 1.00 63.53 H new ATOM 1042 N ASP A 73 -9.429 -5.850 -10.313 1.00 40.31 N ATOM 1043 CA ASP A 73 -10.143 -6.455 -9.196 1.00 11.33 C ATOM 1044 C ASP A 73 -9.148 -6.960 -8.172 1.00 24.30 C ATOM 1045 O ASP A 73 -8.414 -7.923 -8.419 1.00 53.34 O ATOM 1046 CB ASP A 73 -11.030 -7.626 -9.625 1.00 24.10 C ATOM 1047 CG ASP A 73 -12.481 -7.201 -9.734 1.00 13.30 C ATOM 1048 OD1 ASP A 73 -13.099 -6.835 -8.708 1.00 40.21 O ATOM 1049 OD2 ASP A 73 -13.010 -7.212 -10.864 1.00 21.12 O ATOM 0 H ASP A 73 -9.414 -6.436 -11.148 1.00 40.31 H new ATOM 0 HA ASP A 73 -10.786 -5.681 -8.776 1.00 11.33 H new ATOM 0 HB2 ASP A 73 -10.688 -8.012 -10.585 1.00 24.10 H new ATOM 0 HB3 ASP A 73 -10.939 -8.438 -8.904 1.00 24.10 H new ATOM 1053 N TYR A 74 -9.141 -6.330 -7.006 1.00 23.20 N ATOM 1054 CA TYR A 74 -8.272 -6.703 -5.907 1.00 15.54 C ATOM 1055 C TYR A 74 -8.870 -7.817 -5.043 1.00 61.11 C ATOM 1056 O TYR A 74 -8.186 -8.316 -4.159 1.00 43.23 O ATOM 1057 CB TYR A 74 -7.939 -5.449 -5.100 1.00 75.35 C ATOM 1058 CG TYR A 74 -7.289 -4.368 -5.943 1.00 72.14 C ATOM 1059 CD1 TYR A 74 -6.106 -4.629 -6.663 1.00 2.23 C ATOM 1060 CD2 TYR A 74 -7.908 -3.115 -6.059 1.00 71.45 C ATOM 1061 CE1 TYR A 74 -5.565 -3.652 -7.516 1.00 4.51 C ATOM 1062 CE2 TYR A 74 -7.343 -2.109 -6.856 1.00 73.14 C ATOM 1063 CZ TYR A 74 -6.189 -2.387 -7.622 1.00 61.52 C ATOM 1064 OH TYR A 74 -5.711 -1.442 -8.476 1.00 72.32 O ATOM 0 H TYR A 74 -9.747 -5.537 -6.797 1.00 23.20 H new ATOM 0 HA TYR A 74 -7.349 -7.122 -6.307 1.00 15.54 H new ATOM 0 HB2 TYR A 74 -8.852 -5.056 -4.653 1.00 75.35 H new ATOM 0 HB3 TYR A 74 -7.272 -5.716 -4.280 1.00 75.35 H new ATOM 0 HD1 TYR A 74 -5.613 -5.584 -6.559 1.00 2.23 H new ATOM 0 HD2 TYR A 74 -8.829 -2.923 -5.529 1.00 71.45 H new ATOM 0 HE1 TYR A 74 -4.675 -3.866 -8.089 1.00 4.51 H new ATOM 0 HE2 TYR A 74 -7.788 -1.126 -6.884 1.00 73.14 H new ATOM 0 HH TYR A 74 -6.326 -0.679 -8.497 1.00 72.32 H new ATOM 1073 N ASN A 75 -10.098 -8.277 -5.302 1.00 12.30 N ATOM 1074 CA ASN A 75 -10.756 -9.336 -4.515 1.00 22.10 C ATOM 1075 C ASN A 75 -10.157 -10.744 -4.747 1.00 33.32 C ATOM 1076 O ASN A 75 -10.758 -11.764 -4.420 1.00 11.41 O ATOM 1077 CB ASN A 75 -12.269 -9.325 -4.787 1.00 64.25 C ATOM 1078 CG ASN A 75 -13.045 -9.712 -3.536 1.00 64.42 C ATOM 1079 OD1 ASN A 75 -13.383 -10.869 -3.312 1.00 41.31 O ATOM 1080 ND2 ASN A 75 -13.356 -8.742 -2.694 1.00 13.31 N ATOM 0 H ASN A 75 -10.671 -7.925 -6.069 1.00 12.30 H new ATOM 0 HA ASN A 75 -10.572 -9.111 -3.465 1.00 22.10 H new ATOM 0 HB2 ASN A 75 -12.576 -8.333 -5.119 1.00 64.25 H new ATOM 0 HB3 ASN A 75 -12.503 -10.018 -5.595 1.00 64.25 H new ATOM 0 HD21 ASN A 75 -13.883 -8.952 -1.846 1.00 13.31 H new ATOM 0 HD22 ASN A 75 -13.069 -7.783 -2.892 1.00 13.31 H new ATOM 1086 N ASN A 76 -8.985 -10.832 -5.379 1.00 3.42 N ATOM 1087 CA ASN A 76 -8.260 -12.047 -5.717 1.00 32.43 C ATOM 1088 C ASN A 76 -6.969 -12.157 -4.907 1.00 41.45 C ATOM 1089 O ASN A 76 -6.129 -13.012 -5.195 1.00 33.21 O ATOM 1090 CB ASN A 76 -7.940 -12.023 -7.214 1.00 12.10 C ATOM 1091 CG ASN A 76 -9.182 -11.868 -8.076 1.00 20.22 C ATOM 1092 OD1 ASN A 76 -9.973 -12.797 -8.228 1.00 34.30 O ATOM 1093 ND2 ASN A 76 -9.418 -10.677 -8.599 1.00 51.14 N ATOM 0 H ASN A 76 -8.488 -9.996 -5.687 1.00 3.42 H new ATOM 0 HA ASN A 76 -8.877 -12.913 -5.478 1.00 32.43 H new ATOM 0 HB2 ASN A 76 -7.254 -11.202 -7.422 1.00 12.10 H new ATOM 0 HB3 ASN A 76 -7.426 -12.945 -7.487 1.00 12.10 H new ATOM 0 HD21 ASN A 76 -10.268 -10.517 -9.139 1.00 51.14 H new ATOM 0 HD22 ASN A 76 -8.750 -9.918 -8.462 1.00 51.14 H new ATOM 1099 N TYR A 77 -6.775 -11.251 -3.951 1.00 55.41 N ATOM 1100 CA TYR A 77 -5.512 -10.974 -3.311 1.00 32.24 C ATOM 1101 C TYR A 77 -5.758 -11.044 -1.805 1.00 34.33 C ATOM 1102 O TYR A 77 -6.519 -10.245 -1.265 1.00 63.35 O ATOM 1103 CB TYR A 77 -5.006 -9.616 -3.826 1.00 74.34 C ATOM 1104 CG TYR A 77 -4.613 -9.636 -5.300 1.00 62.44 C ATOM 1105 CD1 TYR A 77 -3.310 -10.010 -5.673 1.00 12.20 C ATOM 1106 CD2 TYR A 77 -5.533 -9.275 -6.303 1.00 32.11 C ATOM 1107 CE1 TYR A 77 -2.894 -9.884 -7.012 1.00 32.41 C ATOM 1108 CE2 TYR A 77 -5.145 -9.197 -7.655 1.00 3.54 C ATOM 1109 CZ TYR A 77 -3.797 -9.447 -8.007 1.00 60.04 C ATOM 1110 OH TYR A 77 -3.324 -9.203 -9.263 1.00 43.44 O ATOM 0 H TYR A 77 -7.533 -10.670 -3.593 1.00 55.41 H new ATOM 0 HA TYR A 77 -4.725 -11.692 -3.542 1.00 32.24 H new ATOM 0 HB2 TYR A 77 -5.782 -8.866 -3.675 1.00 74.34 H new ATOM 0 HB3 TYR A 77 -4.145 -9.308 -3.232 1.00 74.34 H new ATOM 0 HD1 TYR A 77 -2.627 -10.395 -4.931 1.00 12.20 H new ATOM 0 HD2 TYR A 77 -6.555 -9.054 -6.031 1.00 32.11 H new ATOM 0 HE1 TYR A 77 -1.876 -10.123 -7.281 1.00 32.41 H new ATOM 0 HE2 TYR A 77 -5.870 -8.949 -8.416 1.00 3.54 H new ATOM 0 HH TYR A 77 -4.061 -8.910 -9.839 1.00 43.44 H new ATOM 1119 N ASP A 78 -5.167 -12.040 -1.144 1.00 72.34 N ATOM 1120 CA ASP A 78 -5.335 -12.318 0.289 1.00 73.14 C ATOM 1121 C ASP A 78 -4.799 -11.172 1.141 1.00 53.21 C ATOM 1122 O ASP A 78 -5.379 -10.811 2.164 1.00 4.32 O ATOM 1123 CB ASP A 78 -4.591 -13.610 0.662 1.00 23.11 C ATOM 1124 CG ASP A 78 -4.723 -13.921 2.156 1.00 43.53 C ATOM 1125 OD1 ASP A 78 -5.871 -14.185 2.592 1.00 4.40 O ATOM 1126 OD2 ASP A 78 -3.674 -13.924 2.845 1.00 3.13 O ATOM 0 H ASP A 78 -4.537 -12.698 -1.603 1.00 72.34 H new ATOM 0 HA ASP A 78 -6.401 -12.430 0.484 1.00 73.14 H new ATOM 0 HB2 ASP A 78 -4.988 -14.441 0.080 1.00 23.11 H new ATOM 0 HB3 ASP A 78 -3.537 -13.513 0.401 1.00 23.11 H new ATOM 1130 N LEU A 79 -3.696 -10.586 0.677 1.00 64.04 N ATOM 1131 CA LEU A 79 -2.954 -9.542 1.357 1.00 42.35 C ATOM 1132 C LEU A 79 -2.465 -8.533 0.330 1.00 75.13 C ATOM 1133 O LEU A 79 -2.065 -8.922 -0.777 1.00 4.41 O ATOM 1134 CB LEU A 79 -1.769 -10.166 2.113 1.00 61.34 C ATOM 1135 CG LEU A 79 -1.771 -9.800 3.603 1.00 31.12 C ATOM 1136 CD1 LEU A 79 -0.720 -10.661 4.298 1.00 1.12 C ATOM 1137 CD2 LEU A 79 -1.477 -8.316 3.869 1.00 55.35 C ATOM 0 H LEU A 79 -3.284 -10.841 -0.220 1.00 64.04 H new ATOM 0 HA LEU A 79 -3.594 -9.032 2.077 1.00 42.35 H new ATOM 0 HB2 LEU A 79 -1.804 -11.250 2.007 1.00 61.34 H new ATOM 0 HB3 LEU A 79 -0.836 -9.832 1.660 1.00 61.34 H new ATOM 0 HG LEU A 79 -2.772 -9.986 3.992 1.00 31.12 H new ATOM 0 HD11 LEU A 79 -0.699 -10.422 5.361 1.00 1.12 H new ATOM 0 HD12 LEU A 79 -0.968 -11.714 4.168 1.00 1.12 H new ATOM 0 HD13 LEU A 79 0.259 -10.463 3.862 1.00 1.12 H new ATOM 0 HD21 LEU A 79 -1.494 -8.128 4.943 1.00 55.35 H new ATOM 0 HD22 LEU A 79 -0.494 -8.063 3.472 1.00 55.35 H new ATOM 0 HD23 LEU A 79 -2.234 -7.702 3.381 1.00 55.35 H new ATOM 1148 N ILE A 80 -2.466 -7.255 0.686 1.00 64.25 N ATOM 1149 CA ILE A 80 -1.998 -6.178 -0.177 1.00 20.34 C ATOM 1150 C ILE A 80 -1.092 -5.281 0.672 1.00 52.31 C ATOM 1151 O ILE A 80 -1.382 -5.020 1.838 1.00 61.02 O ATOM 1152 CB ILE A 80 -3.202 -5.457 -0.839 1.00 72.32 C ATOM 1153 CG1 ILE A 80 -4.088 -6.451 -1.626 1.00 75.21 C ATOM 1154 CG2 ILE A 80 -2.721 -4.330 -1.771 1.00 53.21 C ATOM 1155 CD1 ILE A 80 -5.236 -5.815 -2.414 1.00 0.43 C ATOM 0 H ILE A 80 -2.797 -6.933 1.595 1.00 64.25 H new ATOM 0 HA ILE A 80 -1.407 -6.542 -1.018 1.00 20.34 H new ATOM 0 HB ILE A 80 -3.801 -5.021 -0.040 1.00 72.32 H new ATOM 0 HG12 ILE A 80 -3.456 -7.006 -2.319 1.00 75.21 H new ATOM 0 HG13 ILE A 80 -4.506 -7.174 -0.926 1.00 75.21 H new ATOM 0 HG21 ILE A 80 -3.583 -3.839 -2.223 1.00 53.21 H new ATOM 0 HG22 ILE A 80 -2.149 -3.602 -1.196 1.00 53.21 H new ATOM 0 HG23 ILE A 80 -2.090 -4.750 -2.554 1.00 53.21 H new ATOM 0 HD11 ILE A 80 -5.798 -6.593 -2.931 1.00 0.43 H new ATOM 0 HD12 ILE A 80 -5.897 -5.284 -1.729 1.00 0.43 H new ATOM 0 HD13 ILE A 80 -4.832 -5.114 -3.144 1.00 0.43 H new ATOM 1166 N LEU A 81 0.030 -4.819 0.123 1.00 55.15 N ATOM 1167 CA LEU A 81 0.937 -3.898 0.799 1.00 72.15 C ATOM 1168 C LEU A 81 1.103 -2.679 -0.097 1.00 51.12 C ATOM 1169 O LEU A 81 1.148 -2.839 -1.320 1.00 40.55 O ATOM 1170 CB LEU A 81 2.326 -4.527 1.010 1.00 4.12 C ATOM 1171 CG LEU A 81 2.417 -5.640 2.068 1.00 24.43 C ATOM 1172 CD1 LEU A 81 1.857 -6.988 1.600 1.00 40.24 C ATOM 1173 CD2 LEU A 81 3.897 -5.833 2.419 1.00 13.50 C ATOM 0 H LEU A 81 0.337 -5.078 -0.815 1.00 55.15 H new ATOM 0 HA LEU A 81 0.522 -3.643 1.774 1.00 72.15 H new ATOM 0 HB2 LEU A 81 2.666 -4.932 0.057 1.00 4.12 H new ATOM 0 HB3 LEU A 81 3.022 -3.735 1.286 1.00 4.12 H new ATOM 0 HG LEU A 81 1.814 -5.326 2.920 1.00 24.43 H new ATOM 0 HD11 LEU A 81 1.957 -7.721 2.400 1.00 40.24 H new ATOM 0 HD12 LEU A 81 0.804 -6.874 1.341 1.00 40.24 H new ATOM 0 HD13 LEU A 81 2.411 -7.328 0.725 1.00 40.24 H new ATOM 0 HD21 LEU A 81 3.994 -6.618 3.169 1.00 13.50 H new ATOM 0 HD22 LEU A 81 4.449 -6.117 1.523 1.00 13.50 H new ATOM 0 HD23 LEU A 81 4.302 -4.901 2.815 1.00 13.50 H new ATOM 1184 N ILE A 82 1.221 -1.478 0.484 1.00 71.44 N ATOM 1185 CA ILE A 82 1.291 -0.249 -0.296 1.00 20.31 C ATOM 1186 C ILE A 82 2.452 0.633 0.188 1.00 13.00 C ATOM 1187 O ILE A 82 2.450 1.046 1.349 1.00 55.33 O ATOM 1188 CB ILE A 82 -0.074 0.475 -0.326 1.00 32.24 C ATOM 1189 CG1 ILE A 82 -1.229 -0.385 -0.916 1.00 63.41 C ATOM 1190 CG2 ILE A 82 0.076 1.719 -1.220 1.00 60.15 C ATOM 1191 CD1 ILE A 82 -2.024 -1.168 0.134 1.00 40.15 C ATOM 0 H ILE A 82 1.270 -1.338 1.493 1.00 71.44 H new ATOM 0 HA ILE A 82 1.510 -0.498 -1.334 1.00 20.31 H new ATOM 0 HB ILE A 82 -0.336 0.709 0.706 1.00 32.24 H new ATOM 0 HG12 ILE A 82 -1.911 0.267 -1.461 1.00 63.41 H new ATOM 0 HG13 ILE A 82 -0.813 -1.087 -1.639 1.00 63.41 H new ATOM 0 HG21 ILE A 82 -0.873 2.253 -1.262 1.00 60.15 H new ATOM 0 HG22 ILE A 82 0.843 2.374 -0.807 1.00 60.15 H new ATOM 0 HG23 ILE A 82 0.364 1.412 -2.225 1.00 60.15 H new ATOM 0 HD11 ILE A 82 -2.810 -1.741 -0.358 1.00 40.15 H new ATOM 0 HD12 ILE A 82 -1.356 -1.848 0.664 1.00 40.15 H new ATOM 0 HD13 ILE A 82 -2.472 -0.473 0.844 1.00 40.15 H new ATOM 1202 N GLY A 83 3.392 0.975 -0.704 1.00 61.52 N ATOM 1203 CA GLY A 83 4.578 1.823 -0.504 1.00 55.44 C ATOM 1204 C GLY A 83 4.403 3.288 -0.933 1.00 11.42 C ATOM 1205 O GLY A 83 3.762 3.558 -1.950 1.00 43.11 O ATOM 0 H GLY A 83 3.339 0.638 -1.665 1.00 61.52 H new ATOM 0 HA2 GLY A 83 4.851 1.798 0.551 1.00 55.44 H new ATOM 0 HA3 GLY A 83 5.412 1.394 -1.059 1.00 55.44 H new ATOM 1209 N SER A 84 5.023 4.248 -0.230 1.00 0.41 N ATOM 1210 CA SER A 84 4.988 5.680 -0.581 1.00 15.43 C ATOM 1211 C SER A 84 6.228 6.452 -0.046 1.00 12.20 C ATOM 1212 O SER A 84 6.910 5.944 0.852 1.00 44.31 O ATOM 1213 CB SER A 84 3.656 6.254 -0.055 1.00 72.32 C ATOM 1214 OG SER A 84 3.431 5.968 1.313 1.00 61.14 O ATOM 0 H SER A 84 5.570 4.052 0.608 1.00 0.41 H new ATOM 0 HA SER A 84 5.038 5.800 -1.663 1.00 15.43 H new ATOM 0 HB2 SER A 84 3.650 7.334 -0.200 1.00 72.32 H new ATOM 0 HB3 SER A 84 2.834 5.849 -0.645 1.00 72.32 H new ATOM 0 HG SER A 84 2.576 6.356 1.592 1.00 61.14 H new ATOM 1219 N PRO A 85 6.544 7.662 -0.567 1.00 60.55 N ATOM 1220 CA PRO A 85 7.483 8.617 0.050 1.00 73.25 C ATOM 1221 C PRO A 85 6.790 9.271 1.254 1.00 42.41 C ATOM 1222 O PRO A 85 5.560 9.404 1.228 1.00 75.31 O ATOM 1223 CB PRO A 85 7.739 9.701 -1.020 1.00 11.14 C ATOM 1224 CG PRO A 85 6.489 9.667 -1.891 1.00 72.15 C ATOM 1225 CD PRO A 85 5.935 8.253 -1.751 1.00 52.43 C ATOM 0 HA PRO A 85 8.405 8.137 0.377 1.00 73.25 H new ATOM 0 HB2 PRO A 85 7.883 10.682 -0.567 1.00 11.14 H new ATOM 0 HB3 PRO A 85 8.635 9.484 -1.601 1.00 11.14 H new ATOM 0 HG2 PRO A 85 5.761 10.408 -1.562 1.00 72.15 H new ATOM 0 HG3 PRO A 85 6.728 9.894 -2.930 1.00 72.15 H new ATOM 0 HD2 PRO A 85 4.849 8.274 -1.654 1.00 52.43 H new ATOM 0 HD3 PRO A 85 6.165 7.661 -2.637 1.00 52.43 H new ATOM 1230 N VAL A 86 7.508 9.739 2.281 1.00 32.33 N ATOM 1231 CA VAL A 86 6.911 10.574 3.324 1.00 0.02 C ATOM 1232 C VAL A 86 7.000 12.024 2.764 1.00 54.31 C ATOM 1233 O VAL A 86 7.472 12.232 1.640 1.00 20.42 O ATOM 1234 CB VAL A 86 7.624 10.323 4.671 1.00 62.11 C ATOM 1235 CG1 VAL A 86 7.863 8.839 4.837 1.00 64.45 C ATOM 1236 CG2 VAL A 86 8.551 11.343 5.320 1.00 31.30 C ATOM 0 H VAL A 86 8.502 9.553 2.410 1.00 32.33 H new ATOM 0 HA VAL A 86 5.868 10.351 3.549 1.00 0.02 H new ATOM 0 HB VAL A 86 6.928 10.664 5.438 1.00 62.11 H new ATOM 0 HG11 VAL A 86 8.366 8.655 5.786 1.00 64.45 H new ATOM 0 HG12 VAL A 86 6.908 8.313 4.825 1.00 64.45 H new ATOM 0 HG13 VAL A 86 8.487 8.477 4.020 1.00 64.45 H new ATOM 0 HG21 VAL A 86 8.933 10.942 6.259 1.00 31.30 H new ATOM 0 HG22 VAL A 86 9.385 11.555 4.650 1.00 31.30 H new ATOM 0 HG23 VAL A 86 8.000 12.263 5.515 1.00 31.30 H new ATOM 1246 N TRP A 87 6.596 13.051 3.503 1.00 60.44 N ATOM 1247 CA TRP A 87 6.863 14.465 3.193 1.00 35.51 C ATOM 1248 C TRP A 87 7.401 15.091 4.489 1.00 44.02 C ATOM 1249 O TRP A 87 7.852 14.369 5.385 1.00 13.01 O ATOM 1250 CB TRP A 87 5.603 15.137 2.614 1.00 23.10 C ATOM 1251 CG TRP A 87 5.672 16.155 1.504 1.00 53.15 C ATOM 1252 CD1 TRP A 87 6.750 16.686 0.864 1.00 54.04 C ATOM 1253 CD2 TRP A 87 4.512 16.753 0.860 1.00 40.03 C ATOM 1254 NE1 TRP A 87 6.317 17.545 -0.146 1.00 31.21 N ATOM 1255 CE2 TRP A 87 4.957 17.580 -0.203 1.00 32.40 C ATOM 1256 CE3 TRP A 87 3.118 16.660 1.047 1.00 20.12 C ATOM 1257 CZ2 TRP A 87 4.094 18.269 -1.046 1.00 74.55 C ATOM 1258 CZ3 TRP A 87 2.231 17.351 0.200 1.00 21.40 C ATOM 1259 CH2 TRP A 87 2.716 18.194 -0.810 1.00 62.35 C ATOM 0 H TRP A 87 6.058 12.927 4.361 1.00 60.44 H new ATOM 0 HA TRP A 87 7.611 14.600 2.411 1.00 35.51 H new ATOM 0 HB2 TRP A 87 4.954 14.335 2.263 1.00 23.10 H new ATOM 0 HB3 TRP A 87 5.093 15.618 3.449 1.00 23.10 H new ATOM 0 HD1 TRP A 87 7.782 16.475 1.102 1.00 54.04 H new ATOM 0 HE1 TRP A 87 6.936 18.075 -0.759 1.00 31.21 H new ATOM 0 HE3 TRP A 87 2.726 16.052 1.849 1.00 20.12 H new ATOM 0 HZ2 TRP A 87 4.479 18.852 -1.869 1.00 74.55 H new ATOM 0 HZ3 TRP A 87 1.166 17.231 0.330 1.00 21.40 H new ATOM 0 HH2 TRP A 87 2.031 18.782 -1.402 1.00 62.35 H new ATOM 1269 N SER A 88 7.425 16.411 4.621 1.00 11.41 N ATOM 1270 CA SER A 88 7.886 17.126 5.815 1.00 11.00 C ATOM 1271 C SER A 88 7.185 16.751 7.147 1.00 4.14 C ATOM 1272 O SER A 88 7.520 17.357 8.173 1.00 12.13 O ATOM 1273 CB SER A 88 7.776 18.631 5.541 1.00 2.24 C ATOM 1274 OG SER A 88 8.401 18.939 4.310 1.00 73.53 O ATOM 0 H SER A 88 7.115 17.038 3.879 1.00 11.41 H new ATOM 0 HA SER A 88 8.918 16.816 5.980 1.00 11.00 H new ATOM 0 HB2 SER A 88 6.728 18.929 5.512 1.00 2.24 H new ATOM 0 HB3 SER A 88 8.245 19.193 6.349 1.00 2.24 H new ATOM 0 HG SER A 88 8.327 19.901 4.137 1.00 73.53 H new ATOM 1279 N GLY A 89 6.279 15.764 7.193 1.00 31.33 N ATOM 1280 CA GLY A 89 5.679 15.227 8.404 1.00 60.34 C ATOM 1281 C GLY A 89 4.575 14.202 8.163 1.00 54.23 C ATOM 1282 O GLY A 89 4.290 13.389 9.038 1.00 71.44 O ATOM 0 H GLY A 89 5.936 15.305 6.349 1.00 31.33 H new ATOM 0 HA2 GLY A 89 6.460 14.765 9.007 1.00 60.34 H new ATOM 0 HA3 GLY A 89 5.270 16.052 8.988 1.00 60.34 H new ATOM 1286 N TYR A 90 3.967 14.212 6.983 1.00 51.02 N ATOM 1287 CA TYR A 90 2.808 13.413 6.597 1.00 55.32 C ATOM 1288 C TYR A 90 2.939 13.114 5.101 1.00 62.22 C ATOM 1289 O TYR A 90 3.805 13.708 4.466 1.00 74.25 O ATOM 1290 CB TYR A 90 1.528 14.192 6.941 1.00 53.31 C ATOM 1291 CG TYR A 90 1.594 15.689 6.731 1.00 0.03 C ATOM 1292 CD1 TYR A 90 1.535 16.218 5.434 1.00 11.21 C ATOM 1293 CD2 TYR A 90 1.767 16.547 7.834 1.00 20.41 C ATOM 1294 CE1 TYR A 90 1.687 17.599 5.237 1.00 13.41 C ATOM 1295 CE2 TYR A 90 1.908 17.934 7.644 1.00 75.22 C ATOM 1296 CZ TYR A 90 1.878 18.464 6.336 1.00 31.31 C ATOM 1297 OH TYR A 90 2.096 19.782 6.099 1.00 72.22 O ATOM 0 H TYR A 90 4.288 14.813 6.224 1.00 51.02 H new ATOM 0 HA TYR A 90 2.756 12.467 7.136 1.00 55.32 H new ATOM 0 HB2 TYR A 90 0.710 13.795 6.339 1.00 53.31 H new ATOM 0 HB3 TYR A 90 1.278 14.001 7.985 1.00 53.31 H new ATOM 0 HD1 TYR A 90 1.373 15.565 4.589 1.00 11.21 H new ATOM 0 HD2 TYR A 90 1.792 16.138 8.833 1.00 20.41 H new ATOM 0 HE1 TYR A 90 1.658 18.003 4.236 1.00 13.41 H new ATOM 0 HE2 TYR A 90 2.038 18.589 8.493 1.00 75.22 H new ATOM 0 HH TYR A 90 2.209 20.253 6.951 1.00 72.22 H new ATOM 1306 N PRO A 91 2.187 12.170 4.514 1.00 33.14 N ATOM 1307 CA PRO A 91 2.330 11.884 3.091 1.00 75.53 C ATOM 1308 C PRO A 91 1.746 12.999 2.211 1.00 23.10 C ATOM 1309 O PRO A 91 0.824 13.707 2.616 1.00 22.42 O ATOM 1310 CB PRO A 91 1.609 10.554 2.884 1.00 71.55 C ATOM 1311 CG PRO A 91 0.559 10.515 3.994 1.00 12.34 C ATOM 1312 CD PRO A 91 1.213 11.283 5.142 1.00 53.32 C ATOM 0 HA PRO A 91 3.378 11.828 2.796 1.00 75.53 H new ATOM 0 HB2 PRO A 91 1.147 10.501 1.898 1.00 71.55 H new ATOM 0 HB3 PRO A 91 2.298 9.713 2.959 1.00 71.55 H new ATOM 0 HG2 PRO A 91 -0.373 10.984 3.679 1.00 12.34 H new ATOM 0 HG3 PRO A 91 0.320 9.491 4.283 1.00 12.34 H new ATOM 0 HD2 PRO A 91 0.473 11.850 5.706 1.00 53.32 H new ATOM 0 HD3 PRO A 91 1.697 10.603 5.843 1.00 53.32 H new ATOM 1317 N ALA A 92 2.217 13.083 0.965 1.00 24.20 N ATOM 1318 CA ALA A 92 1.690 13.874 -0.154 1.00 71.35 C ATOM 1319 C ALA A 92 0.448 13.205 -0.760 1.00 60.44 C ATOM 1320 O ALA A 92 0.363 13.003 -1.971 1.00 1.43 O ATOM 1321 CB ALA A 92 2.808 14.007 -1.199 1.00 33.40 C ATOM 0 H ALA A 92 3.046 12.557 0.688 1.00 24.20 H new ATOM 0 HA ALA A 92 1.381 14.860 0.193 1.00 71.35 H new ATOM 0 HB1 ALA A 92 2.447 14.591 -2.046 1.00 33.40 H new ATOM 0 HB2 ALA A 92 3.666 14.508 -0.752 1.00 33.40 H new ATOM 0 HB3 ALA A 92 3.105 13.016 -1.542 1.00 33.40 H new ATOM 1327 N THR A 93 -0.378 12.639 0.118 1.00 41.35 N ATOM 1328 CA THR A 93 -1.664 12.004 -0.129 1.00 1.44 C ATOM 1329 C THR A 93 -1.663 11.109 -1.398 1.00 20.50 C ATOM 1330 O THR A 93 -2.633 11.142 -2.151 1.00 75.42 O ATOM 1331 CB THR A 93 -2.757 13.107 -0.094 1.00 64.15 C ATOM 1332 OG1 THR A 93 -2.528 14.151 -1.019 1.00 13.43 O ATOM 1333 CG2 THR A 93 -2.835 13.805 1.272 1.00 23.23 C ATOM 0 H THR A 93 -0.139 12.613 1.109 1.00 41.35 H new ATOM 0 HA THR A 93 -1.892 11.286 0.659 1.00 1.44 H new ATOM 0 HB THR A 93 -3.672 12.565 -0.332 1.00 64.15 H new ATOM 0 HG1 THR A 93 -3.248 14.812 -0.951 1.00 13.43 H new ATOM 0 HG21 THR A 93 -3.613 14.568 1.247 1.00 23.23 H new ATOM 0 HG22 THR A 93 -3.071 13.071 2.043 1.00 23.23 H new ATOM 0 HG23 THR A 93 -1.876 14.272 1.497 1.00 23.23 H new ATOM 1341 N PRO A 94 -0.714 10.165 -1.594 1.00 51.34 N ATOM 1342 CA PRO A 94 -0.596 9.491 -2.890 1.00 0.33 C ATOM 1343 C PRO A 94 -1.611 8.366 -3.023 1.00 43.44 C ATOM 1344 O PRO A 94 -2.165 8.119 -4.092 1.00 40.33 O ATOM 1345 CB PRO A 94 0.844 8.960 -2.935 1.00 75.33 C ATOM 1346 CG PRO A 94 1.234 8.775 -1.477 1.00 31.13 C ATOM 1347 CD PRO A 94 0.472 9.900 -0.790 1.00 0.04 C ATOM 0 HA PRO A 94 -0.801 10.167 -3.720 1.00 0.33 H new ATOM 0 HB2 PRO A 94 0.902 8.019 -3.483 1.00 75.33 H new ATOM 0 HB3 PRO A 94 1.509 9.663 -3.437 1.00 75.33 H new ATOM 0 HG2 PRO A 94 0.941 7.796 -1.099 1.00 31.13 H new ATOM 0 HG3 PRO A 94 2.310 8.864 -1.330 1.00 31.13 H new ATOM 0 HD2 PRO A 94 0.194 9.614 0.224 1.00 0.04 H new ATOM 0 HD3 PRO A 94 1.092 10.793 -0.711 1.00 0.04 H new ATOM 1352 N ILE A 95 -1.872 7.666 -1.923 1.00 74.41 N ATOM 1353 CA ILE A 95 -2.715 6.484 -1.925 1.00 33.10 C ATOM 1354 C ILE A 95 -4.205 6.900 -1.846 1.00 0.03 C ATOM 1355 O ILE A 95 -5.084 6.061 -2.028 1.00 0.00 O ATOM 1356 CB ILE A 95 -2.202 5.507 -0.830 1.00 53.44 C ATOM 1357 CG1 ILE A 95 -0.643 5.383 -0.752 1.00 20.11 C ATOM 1358 CG2 ILE A 95 -2.816 4.111 -0.995 1.00 71.24 C ATOM 1359 CD1 ILE A 95 0.160 5.152 -2.050 1.00 14.24 C ATOM 0 H ILE A 95 -1.501 7.907 -1.004 1.00 74.41 H new ATOM 0 HA ILE A 95 -2.652 5.924 -2.858 1.00 33.10 H new ATOM 0 HB ILE A 95 -2.529 5.952 0.110 1.00 53.44 H new ATOM 0 HG12 ILE A 95 -0.264 6.294 -0.290 1.00 20.11 H new ATOM 0 HG13 ILE A 95 -0.413 4.562 -0.073 1.00 20.11 H new ATOM 0 HG21 ILE A 95 -2.437 3.452 -0.214 1.00 71.24 H new ATOM 0 HG22 ILE A 95 -3.901 4.179 -0.917 1.00 71.24 H new ATOM 0 HG23 ILE A 95 -2.547 3.708 -1.972 1.00 71.24 H new ATOM 0 HD11 ILE A 95 1.222 5.090 -1.814 1.00 14.24 H new ATOM 0 HD12 ILE A 95 -0.163 4.221 -2.517 1.00 14.24 H new ATOM 0 HD13 ILE A 95 -0.012 5.981 -2.737 1.00 14.24 H new ATOM 1370 N LYS A 96 -4.505 8.198 -1.648 1.00 41.05 N ATOM 1371 CA LYS A 96 -5.850 8.733 -1.455 1.00 72.15 C ATOM 1372 C LYS A 96 -6.742 8.411 -2.653 1.00 12.03 C ATOM 1373 O LYS A 96 -7.904 8.076 -2.456 1.00 40.12 O ATOM 1374 CB LYS A 96 -5.757 10.239 -1.143 1.00 31.10 C ATOM 1375 CG LYS A 96 -7.101 10.932 -0.876 1.00 55.35 C ATOM 1376 CD LYS A 96 -7.845 10.366 0.343 1.00 13.21 C ATOM 1377 CE LYS A 96 -8.994 11.263 0.823 1.00 15.12 C ATOM 1378 NZ LYS A 96 -8.534 12.529 1.436 1.00 73.24 N ATOM 0 H LYS A 96 -3.786 8.921 -1.618 1.00 41.05 H new ATOM 0 HA LYS A 96 -6.326 8.253 -0.600 1.00 72.15 H new ATOM 0 HB2 LYS A 96 -5.116 10.375 -0.272 1.00 31.10 H new ATOM 0 HB3 LYS A 96 -5.268 10.738 -1.980 1.00 31.10 H new ATOM 0 HG2 LYS A 96 -6.929 11.998 -0.725 1.00 55.35 H new ATOM 0 HG3 LYS A 96 -7.734 10.833 -1.758 1.00 55.35 H new ATOM 0 HD2 LYS A 96 -8.242 9.382 0.093 1.00 13.21 H new ATOM 0 HD3 LYS A 96 -7.137 10.226 1.160 1.00 13.21 H new ATOM 0 HE2 LYS A 96 -9.644 11.492 -0.022 1.00 15.12 H new ATOM 0 HE3 LYS A 96 -9.595 10.714 1.548 1.00 15.12 H new ATOM 0 HZ1 LYS A 96 -9.347 13.033 1.844 1.00 73.24 H new ATOM 0 HZ2 LYS A 96 -7.844 12.321 2.186 1.00 73.24 H new ATOM 0 HZ3 LYS A 96 -8.087 13.124 0.710 1.00 73.24 H new ATOM 1388 N THR A 97 -6.213 8.448 -3.872 1.00 54.21 N ATOM 1389 CA THR A 97 -7.014 8.153 -5.054 1.00 61.14 C ATOM 1390 C THR A 97 -7.271 6.646 -5.173 1.00 41.34 C ATOM 1391 O THR A 97 -8.398 6.236 -5.445 1.00 0.11 O ATOM 1392 CB THR A 97 -6.275 8.688 -6.296 1.00 20.50 C ATOM 1393 OG1 THR A 97 -5.369 9.734 -5.990 1.00 75.43 O ATOM 1394 CG2 THR A 97 -7.236 9.149 -7.389 1.00 40.14 C ATOM 0 H THR A 97 -5.238 8.678 -4.066 1.00 54.21 H new ATOM 0 HA THR A 97 -7.985 8.641 -4.972 1.00 61.14 H new ATOM 0 HB THR A 97 -5.700 7.841 -6.670 1.00 20.50 H new ATOM 0 HG1 THR A 97 -5.796 10.598 -6.166 1.00 75.43 H new ATOM 0 HG21 THR A 97 -6.667 9.517 -8.243 1.00 40.14 H new ATOM 0 HG22 THR A 97 -7.859 8.312 -7.702 1.00 40.14 H new ATOM 0 HG23 THR A 97 -7.869 9.948 -7.003 1.00 40.14 H new ATOM 1402 N LEU A 98 -6.241 5.808 -4.972 1.00 61.31 N ATOM 1403 CA LEU A 98 -6.361 4.370 -5.217 1.00 40.23 C ATOM 1404 C LEU A 98 -7.358 3.743 -4.258 1.00 1.14 C ATOM 1405 O LEU A 98 -8.179 2.941 -4.686 1.00 42.31 O ATOM 1406 CB LEU A 98 -5.007 3.644 -5.110 1.00 31.43 C ATOM 1407 CG LEU A 98 -5.121 2.136 -5.436 1.00 11.21 C ATOM 1408 CD1 LEU A 98 -5.652 1.894 -6.853 1.00 53.42 C ATOM 1409 CD2 LEU A 98 -3.747 1.467 -5.310 1.00 14.14 C ATOM 0 H LEU A 98 -5.322 6.104 -4.642 1.00 61.31 H new ATOM 0 HA LEU A 98 -6.720 4.254 -6.240 1.00 40.23 H new ATOM 0 HB2 LEU A 98 -4.294 4.108 -5.792 1.00 31.43 H new ATOM 0 HB3 LEU A 98 -4.610 3.766 -4.102 1.00 31.43 H new ATOM 0 HG LEU A 98 -5.825 1.706 -4.723 1.00 11.21 H new ATOM 0 HD11 LEU A 98 -5.716 0.822 -7.039 1.00 53.42 H new ATOM 0 HD12 LEU A 98 -6.642 2.339 -6.952 1.00 53.42 H new ATOM 0 HD13 LEU A 98 -4.976 2.349 -7.577 1.00 53.42 H new ATOM 0 HD21 LEU A 98 -3.837 0.406 -5.541 1.00 14.14 H new ATOM 0 HD22 LEU A 98 -3.050 1.933 -6.007 1.00 14.14 H new ATOM 0 HD23 LEU A 98 -3.376 1.587 -4.292 1.00 14.14 H new ATOM 1420 N LEU A 99 -7.278 4.107 -2.977 1.00 41.15 N ATOM 1421 CA LEU A 99 -8.143 3.581 -1.927 1.00 52.35 C ATOM 1422 C LEU A 99 -9.608 3.717 -2.316 1.00 1.20 C ATOM 1423 O LEU A 99 -10.388 2.803 -2.060 1.00 73.15 O ATOM 1424 CB LEU A 99 -7.756 4.224 -0.584 1.00 15.44 C ATOM 1425 CG LEU A 99 -8.459 5.540 -0.229 1.00 43.34 C ATOM 1426 CD1 LEU A 99 -9.854 5.272 0.354 1.00 74.31 C ATOM 1427 CD2 LEU A 99 -7.581 6.277 0.776 1.00 24.13 C ATOM 0 H LEU A 99 -6.598 4.787 -2.637 1.00 41.15 H new ATOM 0 HA LEU A 99 -7.997 2.508 -1.800 1.00 52.35 H new ATOM 0 HB2 LEU A 99 -7.957 3.504 0.210 1.00 15.44 H new ATOM 0 HB3 LEU A 99 -6.681 4.402 -0.588 1.00 15.44 H new ATOM 0 HG LEU A 99 -8.598 6.148 -1.123 1.00 43.34 H new ATOM 0 HD11 LEU A 99 -10.334 6.219 0.599 1.00 74.31 H new ATOM 0 HD12 LEU A 99 -10.458 4.737 -0.379 1.00 74.31 H new ATOM 0 HD13 LEU A 99 -9.761 4.669 1.257 1.00 74.31 H new ATOM 0 HD21 LEU A 99 -8.054 7.220 1.050 1.00 24.13 H new ATOM 0 HD22 LEU A 99 -7.454 5.663 1.667 1.00 24.13 H new ATOM 0 HD23 LEU A 99 -6.606 6.476 0.330 1.00 24.13 H new ATOM 1438 N ASP A 100 -9.983 4.822 -2.960 1.00 72.41 N ATOM 1439 CA ASP A 100 -11.377 5.070 -3.300 1.00 34.41 C ATOM 1440 C ASP A 100 -11.904 4.015 -4.280 1.00 12.32 C ATOM 1441 O ASP A 100 -13.054 3.588 -4.155 1.00 75.53 O ATOM 1442 CB ASP A 100 -11.561 6.490 -3.836 1.00 31.11 C ATOM 1443 CG ASP A 100 -13.009 6.905 -3.596 1.00 31.51 C ATOM 1444 OD1 ASP A 100 -13.343 7.231 -2.432 1.00 34.42 O ATOM 1445 OD2 ASP A 100 -13.846 6.860 -4.521 1.00 73.43 O ATOM 0 H ASP A 100 -9.339 5.556 -3.255 1.00 72.41 H new ATOM 0 HA ASP A 100 -11.971 4.985 -2.390 1.00 34.41 H new ATOM 0 HB2 ASP A 100 -10.880 7.177 -3.334 1.00 31.11 H new ATOM 0 HB3 ASP A 100 -11.326 6.529 -4.900 1.00 31.11 H new ATOM 1449 N GLN A 101 -11.027 3.546 -5.180 1.00 71.21 N ATOM 1450 CA GLN A 101 -11.249 2.520 -6.203 1.00 34.54 C ATOM 1451 C GLN A 101 -11.122 1.082 -5.648 1.00 41.22 C ATOM 1452 O GLN A 101 -11.269 0.125 -6.414 1.00 13.43 O ATOM 1453 CB GLN A 101 -10.223 2.702 -7.346 1.00 73.35 C ATOM 1454 CG GLN A 101 -10.217 4.087 -8.020 1.00 22.53 C ATOM 1455 CD GLN A 101 -9.144 4.209 -9.110 1.00 54.43 C ATOM 1456 OE1 GLN A 101 -8.790 3.259 -9.802 1.00 43.41 O ATOM 1457 NE2 GLN A 101 -8.588 5.392 -9.309 1.00 32.20 N ATOM 0 H GLN A 101 -10.072 3.903 -5.212 1.00 71.21 H new ATOM 0 HA GLN A 101 -12.269 2.648 -6.565 1.00 34.54 H new ATOM 0 HB2 GLN A 101 -9.226 2.506 -6.950 1.00 73.35 H new ATOM 0 HB3 GLN A 101 -10.417 1.948 -8.108 1.00 73.35 H new ATOM 0 HG2 GLN A 101 -11.197 4.278 -8.457 1.00 22.53 H new ATOM 0 HG3 GLN A 101 -10.050 4.854 -7.264 1.00 22.53 H new ATOM 0 HE21 GLN A 101 -8.872 6.191 -8.742 1.00 32.20 H new ATOM 0 HE22 GLN A 101 -7.875 5.506 -10.030 1.00 32.20 H new ATOM 1464 N MET A 102 -10.796 0.890 -4.362 1.00 40.42 N ATOM 1465 CA MET A 102 -10.593 -0.434 -3.755 1.00 55.53 C ATOM 1466 C MET A 102 -11.197 -0.556 -2.350 1.00 44.24 C ATOM 1467 O MET A 102 -10.875 -1.482 -1.607 1.00 15.43 O ATOM 1468 CB MET A 102 -9.103 -0.830 -3.781 1.00 4.12 C ATOM 1469 CG MET A 102 -8.160 0.038 -2.950 1.00 44.05 C ATOM 1470 SD MET A 102 -6.649 -0.768 -2.329 1.00 71.05 S ATOM 1471 CE MET A 102 -5.892 -1.413 -3.839 1.00 15.12 C ATOM 0 H MET A 102 -10.664 1.659 -3.705 1.00 40.42 H new ATOM 0 HA MET A 102 -11.142 -1.147 -4.370 1.00 55.53 H new ATOM 0 HB2 MET A 102 -9.016 -1.860 -3.434 1.00 4.12 H new ATOM 0 HB3 MET A 102 -8.762 -0.813 -4.816 1.00 4.12 H new ATOM 0 HG2 MET A 102 -7.865 0.896 -3.554 1.00 44.05 H new ATOM 0 HG3 MET A 102 -8.716 0.425 -2.096 1.00 44.05 H new ATOM 0 HE1 MET A 102 -4.807 -1.336 -3.764 1.00 15.12 H new ATOM 0 HE2 MET A 102 -6.173 -2.458 -3.969 1.00 15.12 H new ATOM 0 HE3 MET A 102 -6.239 -0.835 -4.695 1.00 15.12 H new ATOM 1479 N LYS A 103 -12.070 0.368 -1.950 1.00 55.13 N ATOM 1480 CA LYS A 103 -12.624 0.431 -0.605 1.00 64.23 C ATOM 1481 C LYS A 103 -13.412 -0.820 -0.207 1.00 53.43 C ATOM 1482 O LYS A 103 -13.434 -1.197 0.959 1.00 33.23 O ATOM 1483 CB LYS A 103 -13.420 1.740 -0.511 1.00 4.31 C ATOM 1484 CG LYS A 103 -14.181 1.947 0.799 1.00 62.11 C ATOM 1485 CD LYS A 103 -13.342 2.068 2.079 1.00 54.32 C ATOM 1486 CE LYS A 103 -12.386 3.268 2.084 1.00 34.11 C ATOM 1487 NZ LYS A 103 -13.067 4.572 1.983 1.00 64.32 N ATOM 0 H LYS A 103 -12.416 1.105 -2.565 1.00 55.13 H new ATOM 0 HA LYS A 103 -11.823 0.440 0.134 1.00 64.23 H new ATOM 0 HB2 LYS A 103 -12.733 2.575 -0.649 1.00 4.31 H new ATOM 0 HB3 LYS A 103 -14.132 1.773 -1.335 1.00 4.31 H new ATOM 0 HG2 LYS A 103 -14.784 2.850 0.702 1.00 62.11 H new ATOM 0 HG3 LYS A 103 -14.873 1.114 0.925 1.00 62.11 H new ATOM 0 HD2 LYS A 103 -14.012 2.146 2.935 1.00 54.32 H new ATOM 0 HD3 LYS A 103 -12.763 1.154 2.210 1.00 54.32 H new ATOM 0 HE2 LYS A 103 -11.796 3.247 3.000 1.00 34.11 H new ATOM 0 HE3 LYS A 103 -11.688 3.168 1.253 1.00 34.11 H new ATOM 0 HZ1 LYS A 103 -12.360 5.335 1.992 1.00 64.32 H new ATOM 0 HZ2 LYS A 103 -13.609 4.613 1.096 1.00 64.32 H new ATOM 0 HZ3 LYS A 103 -13.713 4.689 2.789 1.00 64.32 H new ATOM 1497 N ASN A 104 -14.011 -1.508 -1.169 1.00 72.33 N ATOM 1498 CA ASN A 104 -14.782 -2.731 -1.022 1.00 42.42 C ATOM 1499 C ASN A 104 -13.918 -3.989 -0.882 1.00 55.32 C ATOM 1500 O ASN A 104 -14.411 -5.112 -1.023 1.00 61.31 O ATOM 1501 CB ASN A 104 -15.666 -2.833 -2.268 1.00 3.34 C ATOM 1502 CG ASN A 104 -16.835 -1.861 -2.305 1.00 24.40 C ATOM 1503 OD1 ASN A 104 -17.377 -1.483 -1.166 1.00 13.54 O flip ATOM 1504 ND2 ASN A 104 -17.257 -1.425 -3.372 1.00 12.14 N flip ATOM 0 H ASN A 104 -13.967 -1.203 -2.141 1.00 72.33 H new ATOM 0 HA ASN A 104 -15.361 -2.680 -0.100 1.00 42.42 H new ATOM 0 HB2 ASN A 104 -15.047 -2.667 -3.150 1.00 3.34 H new ATOM 0 HB3 ASN A 104 -16.055 -3.849 -2.338 1.00 3.34 H new ATOM 0 HD21 ASN A 104 -16.831 -1.724 -4.249 1.00 12.14 H new ATOM 0 HD22 ASN A 104 -18.034 -0.764 -3.381 1.00 12.14 H new ATOM 1510 N TYR A 105 -12.620 -3.832 -0.675 1.00 34.31 N ATOM 1511 CA TYR A 105 -11.678 -4.935 -0.517 1.00 73.05 C ATOM 1512 C TYR A 105 -11.947 -5.703 0.784 1.00 55.42 C ATOM 1513 O TYR A 105 -12.353 -5.109 1.781 1.00 52.23 O ATOM 1514 CB TYR A 105 -10.256 -4.356 -0.529 1.00 33.22 C ATOM 1515 CG TYR A 105 -9.171 -5.370 -0.250 1.00 43.43 C ATOM 1516 CD1 TYR A 105 -8.823 -6.303 -1.241 1.00 3.11 C ATOM 1517 CD2 TYR A 105 -8.552 -5.419 1.012 1.00 24.14 C ATOM 1518 CE1 TYR A 105 -7.869 -7.292 -0.968 1.00 71.43 C ATOM 1519 CE2 TYR A 105 -7.587 -6.402 1.284 1.00 61.32 C ATOM 1520 CZ TYR A 105 -7.246 -7.347 0.296 1.00 31.11 C ATOM 1521 OH TYR A 105 -6.329 -8.307 0.570 1.00 4.14 O ATOM 0 H TYR A 105 -12.180 -2.914 -0.610 1.00 34.31 H new ATOM 0 HA TYR A 105 -11.796 -5.644 -1.337 1.00 73.05 H new ATOM 0 HB2 TYR A 105 -10.070 -3.900 -1.501 1.00 33.22 H new ATOM 0 HB3 TYR A 105 -10.194 -3.560 0.213 1.00 33.22 H new ATOM 0 HD1 TYR A 105 -9.291 -6.258 -2.213 1.00 3.11 H new ATOM 0 HD2 TYR A 105 -8.819 -4.700 1.772 1.00 24.14 H new ATOM 0 HE1 TYR A 105 -7.610 -8.014 -1.728 1.00 71.43 H new ATOM 0 HE2 TYR A 105 -7.106 -6.434 2.251 1.00 61.32 H new ATOM 0 HH TYR A 105 -6.249 -8.911 -0.197 1.00 4.14 H new ATOM 1530 N ARG A 106 -11.676 -7.014 0.794 1.00 63.31 N ATOM 1531 CA ARG A 106 -11.570 -7.870 1.970 1.00 71.32 C ATOM 1532 C ARG A 106 -10.328 -8.749 1.808 1.00 41.45 C ATOM 1533 O ARG A 106 -9.911 -9.015 0.678 1.00 21.24 O ATOM 1534 CB ARG A 106 -12.805 -8.771 2.056 1.00 24.41 C ATOM 1535 CG ARG A 106 -14.139 -8.030 1.925 1.00 35.01 C ATOM 1536 CD ARG A 106 -14.488 -7.116 3.106 1.00 31.31 C ATOM 1537 NE ARG A 106 -14.804 -7.845 4.338 1.00 15.54 N ATOM 1538 CZ ARG A 106 -15.621 -7.431 5.312 1.00 32.10 C ATOM 1539 NH1 ARG A 106 -16.130 -6.200 5.313 1.00 12.50 N ATOM 1540 NH2 ARG A 106 -15.923 -8.276 6.291 1.00 1.41 N ATOM 0 H ARG A 106 -11.517 -7.530 -0.071 1.00 63.31 H new ATOM 0 HA ARG A 106 -11.499 -7.263 2.872 1.00 71.32 H new ATOM 0 HB2 ARG A 106 -12.744 -9.526 1.272 1.00 24.41 H new ATOM 0 HB3 ARG A 106 -12.789 -9.299 3.009 1.00 24.41 H new ATOM 0 HG2 ARG A 106 -14.117 -7.431 1.015 1.00 35.01 H new ATOM 0 HG3 ARG A 106 -14.936 -8.764 1.805 1.00 35.01 H new ATOM 0 HD2 ARG A 106 -13.650 -6.445 3.295 1.00 31.31 H new ATOM 0 HD3 ARG A 106 -15.340 -6.493 2.833 1.00 31.31 H new ATOM 0 HE ARG A 106 -14.359 -8.754 4.464 1.00 15.54 H new ATOM 0 HH11 ARG A 106 -15.898 -5.552 4.560 1.00 12.50 H new ATOM 0 HH12 ARG A 106 -16.751 -5.906 6.066 1.00 12.50 H new ATOM 0 HH21 ARG A 106 -15.534 -9.219 6.289 1.00 1.41 H new ATOM 0 HH22 ARG A 106 -16.544 -7.982 7.045 1.00 1.41 H new ATOM 1551 N GLY A 107 -9.781 -9.250 2.907 1.00 51.13 N ATOM 1552 CA GLY A 107 -8.418 -9.767 3.002 1.00 72.02 C ATOM 1553 C GLY A 107 -7.749 -8.987 4.127 1.00 42.51 C ATOM 1554 O GLY A 107 -8.457 -8.565 5.046 1.00 32.03 O ATOM 0 H GLY A 107 -10.290 -9.311 3.789 1.00 51.13 H new ATOM 0 HA2 GLY A 107 -8.420 -10.836 3.216 1.00 72.02 H new ATOM 0 HA3 GLY A 107 -7.883 -9.632 2.062 1.00 72.02 H new ATOM 1558 N GLU A 108 -6.444 -8.739 4.062 1.00 32.44 N ATOM 1559 CA GLU A 108 -5.684 -7.931 5.022 1.00 22.02 C ATOM 1560 C GLU A 108 -4.824 -6.916 4.250 1.00 63.15 C ATOM 1561 O GLU A 108 -4.546 -7.127 3.068 1.00 13.22 O ATOM 1562 CB GLU A 108 -4.870 -8.870 5.938 1.00 13.53 C ATOM 1563 CG GLU A 108 -5.775 -9.541 6.990 1.00 13.40 C ATOM 1564 CD GLU A 108 -5.102 -10.642 7.822 1.00 43.13 C ATOM 1565 OE1 GLU A 108 -3.900 -10.538 8.154 1.00 55.14 O ATOM 1566 OE2 GLU A 108 -5.832 -11.565 8.252 1.00 3.40 O ATOM 0 H GLU A 108 -5.860 -9.108 3.311 1.00 32.44 H new ATOM 0 HA GLU A 108 -6.341 -7.354 5.673 1.00 22.02 H new ATOM 0 HB2 GLU A 108 -4.379 -9.634 5.336 1.00 13.53 H new ATOM 0 HB3 GLU A 108 -4.084 -8.304 6.438 1.00 13.53 H new ATOM 0 HG2 GLU A 108 -6.149 -8.773 7.667 1.00 13.40 H new ATOM 0 HG3 GLU A 108 -6.640 -9.968 6.483 1.00 13.40 H new ATOM 1571 N VAL A 109 -4.401 -5.796 4.859 1.00 52.23 N ATOM 1572 CA VAL A 109 -3.554 -4.820 4.169 1.00 31.02 C ATOM 1573 C VAL A 109 -2.484 -4.360 5.139 1.00 21.32 C ATOM 1574 O VAL A 109 -2.766 -4.258 6.327 1.00 63.14 O ATOM 1575 CB VAL A 109 -4.388 -3.613 3.683 1.00 62.12 C ATOM 1576 CG1 VAL A 109 -3.628 -2.863 2.582 1.00 22.22 C ATOM 1577 CG2 VAL A 109 -5.770 -3.974 3.119 1.00 0.43 C ATOM 0 H VAL A 109 -4.632 -5.549 5.821 1.00 52.23 H new ATOM 0 HA VAL A 109 -3.100 -5.281 3.292 1.00 31.02 H new ATOM 0 HB VAL A 109 -4.544 -3.004 4.573 1.00 62.12 H new ATOM 0 HG11 VAL A 109 -4.222 -2.014 2.244 1.00 22.22 H new ATOM 0 HG12 VAL A 109 -2.676 -2.507 2.975 1.00 22.22 H new ATOM 0 HG13 VAL A 109 -3.446 -3.535 1.743 1.00 22.22 H new ATOM 0 HG21 VAL A 109 -6.283 -3.065 2.803 1.00 0.43 H new ATOM 0 HG22 VAL A 109 -5.652 -4.640 2.264 1.00 0.43 H new ATOM 0 HG23 VAL A 109 -6.358 -4.474 3.889 1.00 0.43 H new ATOM 1587 N ALA A 110 -1.295 -3.988 4.679 1.00 51.25 N ATOM 1588 CA ALA A 110 -0.383 -3.202 5.498 1.00 0.31 C ATOM 1589 C ALA A 110 0.013 -1.937 4.754 1.00 72.12 C ATOM 1590 O ALA A 110 -0.099 -1.865 3.523 1.00 14.23 O ATOM 1591 CB ALA A 110 0.821 -4.042 5.900 1.00 21.30 C ATOM 0 H ALA A 110 -0.943 -4.217 3.750 1.00 51.25 H new ATOM 0 HA ALA A 110 -0.880 -2.899 6.419 1.00 0.31 H new ATOM 0 HB1 ALA A 110 1.495 -3.442 6.512 1.00 21.30 H new ATOM 0 HB2 ALA A 110 0.486 -4.908 6.471 1.00 21.30 H new ATOM 0 HB3 ALA A 110 1.345 -4.378 5.005 1.00 21.30 H new ATOM 1597 N SER A 111 0.482 -0.929 5.486 1.00 21.44 N ATOM 1598 CA SER A 111 1.054 0.250 4.865 1.00 74.11 C ATOM 1599 C SER A 111 2.558 0.228 5.103 1.00 41.34 C ATOM 1600 O SER A 111 3.048 -0.145 6.167 1.00 12.51 O ATOM 1601 CB SER A 111 0.378 1.502 5.408 1.00 0.24 C ATOM 1602 OG SER A 111 -1.030 1.381 5.357 1.00 2.21 O ATOM 0 H SER A 111 0.475 -0.910 6.506 1.00 21.44 H new ATOM 0 HA SER A 111 0.883 0.256 3.788 1.00 74.11 H new ATOM 0 HB2 SER A 111 0.695 1.673 6.437 1.00 0.24 H new ATOM 0 HB3 SER A 111 0.693 2.370 4.829 1.00 0.24 H new ATOM 0 HG SER A 111 -1.431 2.269 5.255 1.00 2.21 H new ATOM 1607 N PHE A 112 3.303 0.636 4.094 1.00 40.35 N ATOM 1608 CA PHE A 112 4.746 0.674 4.082 1.00 61.13 C ATOM 1609 C PHE A 112 5.143 2.051 3.559 1.00 0.44 C ATOM 1610 O PHE A 112 4.409 2.688 2.794 1.00 64.31 O ATOM 1611 CB PHE A 112 5.230 -0.505 3.216 1.00 4.00 C ATOM 1612 CG PHE A 112 6.580 -0.294 2.569 1.00 74.41 C ATOM 1613 CD1 PHE A 112 7.741 -0.088 3.337 1.00 41.02 C ATOM 1614 CD2 PHE A 112 6.636 -0.186 1.166 1.00 64.22 C ATOM 1615 CE1 PHE A 112 8.926 0.312 2.696 1.00 4.12 C ATOM 1616 CE2 PHE A 112 7.816 0.228 0.534 1.00 2.42 C ATOM 1617 CZ PHE A 112 8.955 0.490 1.303 1.00 1.31 C ATOM 0 H PHE A 112 2.895 0.965 3.219 1.00 40.35 H new ATOM 0 HA PHE A 112 5.210 0.553 5.061 1.00 61.13 H new ATOM 0 HB2 PHE A 112 5.274 -1.401 3.836 1.00 4.00 H new ATOM 0 HB3 PHE A 112 4.493 -0.693 2.436 1.00 4.00 H new ATOM 0 HD1 PHE A 112 7.722 -0.236 4.407 1.00 41.02 H new ATOM 0 HD2 PHE A 112 5.765 -0.424 0.574 1.00 64.22 H new ATOM 0 HE1 PHE A 112 9.820 0.484 3.278 1.00 4.12 H new ATOM 0 HE2 PHE A 112 7.846 0.344 -0.539 1.00 2.42 H new ATOM 0 HZ PHE A 112 9.861 0.831 0.823 1.00 1.31 H new ATOM 1626 N PHE A 113 6.284 2.555 4.006 1.00 61.21 N ATOM 1627 CA PHE A 113 6.756 3.881 3.670 1.00 55.21 C ATOM 1628 C PHE A 113 8.263 3.940 3.859 1.00 21.13 C ATOM 1629 O PHE A 113 8.862 3.014 4.411 1.00 3.32 O ATOM 1630 CB PHE A 113 6.013 4.943 4.493 1.00 63.33 C ATOM 1631 CG PHE A 113 6.262 5.022 5.992 1.00 52.35 C ATOM 1632 CD1 PHE A 113 6.134 3.915 6.855 1.00 3.13 C ATOM 1633 CD2 PHE A 113 6.513 6.283 6.552 1.00 54.24 C ATOM 1634 CE1 PHE A 113 6.323 4.067 8.241 1.00 13.42 C ATOM 1635 CE2 PHE A 113 6.776 6.423 7.920 1.00 33.21 C ATOM 1636 CZ PHE A 113 6.685 5.313 8.773 1.00 20.52 C ATOM 0 H PHE A 113 6.915 2.042 4.622 1.00 61.21 H new ATOM 0 HA PHE A 113 6.543 4.099 2.623 1.00 55.21 H new ATOM 0 HB2 PHE A 113 6.254 5.917 4.068 1.00 63.33 H new ATOM 0 HB3 PHE A 113 4.945 4.786 4.345 1.00 63.33 H new ATOM 0 HD1 PHE A 113 5.889 2.944 6.450 1.00 3.13 H new ATOM 0 HD2 PHE A 113 6.503 7.158 5.919 1.00 54.24 H new ATOM 0 HE1 PHE A 113 6.189 3.220 8.898 1.00 13.42 H new ATOM 0 HE2 PHE A 113 7.050 7.388 8.320 1.00 33.21 H new ATOM 0 HZ PHE A 113 6.891 5.417 9.828 1.00 20.52 H new ATOM 1645 N THR A 114 8.882 5.024 3.395 1.00 31.13 N ATOM 1646 CA THR A 114 10.327 5.192 3.465 1.00 32.12 C ATOM 1647 C THR A 114 10.653 6.607 3.951 1.00 43.32 C ATOM 1648 O THR A 114 11.077 7.477 3.189 1.00 63.51 O ATOM 1649 CB THR A 114 10.968 4.821 2.117 1.00 64.41 C ATOM 1650 OG1 THR A 114 10.280 5.399 1.010 1.00 61.43 O ATOM 1651 CG2 THR A 114 11.006 3.310 1.887 1.00 72.45 C ATOM 0 H THR A 114 8.394 5.808 2.961 1.00 31.13 H new ATOM 0 HA THR A 114 10.763 4.510 4.195 1.00 32.12 H new ATOM 0 HB THR A 114 11.982 5.217 2.175 1.00 64.41 H new ATOM 0 HG1 THR A 114 10.724 5.137 0.176 1.00 61.43 H new ATOM 0 HG21 THR A 114 11.468 3.100 0.922 1.00 72.45 H new ATOM 0 HG22 THR A 114 11.587 2.836 2.678 1.00 72.45 H new ATOM 0 HG23 THR A 114 9.990 2.915 1.897 1.00 72.45 H new ATOM 1659 N SER A 115 10.404 6.840 5.239 1.00 11.02 N ATOM 1660 CA SER A 115 10.820 8.030 5.957 1.00 22.52 C ATOM 1661 C SER A 115 12.298 8.348 5.780 1.00 21.13 C ATOM 1662 O SER A 115 13.136 7.464 5.608 1.00 14.04 O ATOM 1663 CB SER A 115 10.491 7.826 7.438 1.00 21.43 C ATOM 1664 OG SER A 115 11.085 6.620 7.919 1.00 31.23 O ATOM 0 H SER A 115 9.891 6.181 5.824 1.00 11.02 H new ATOM 0 HA SER A 115 10.281 8.885 5.548 1.00 22.52 H new ATOM 0 HB2 SER A 115 10.855 8.674 8.018 1.00 21.43 H new ATOM 0 HB3 SER A 115 9.410 7.786 7.575 1.00 21.43 H new ATOM 0 HG SER A 115 11.005 6.583 8.895 1.00 31.23 H new ATOM 1669 N ALA A 116 12.622 9.602 6.063 1.00 43.34 N ATOM 1670 CA ALA A 116 13.983 10.015 6.423 1.00 55.41 C ATOM 1671 C ALA A 116 14.272 9.626 7.886 1.00 4.23 C ATOM 1672 O ALA A 116 14.986 10.331 8.603 1.00 13.23 O ATOM 1673 CB ALA A 116 14.158 11.519 6.178 1.00 4.22 C ATOM 0 H ALA A 116 11.950 10.369 6.051 1.00 43.34 H new ATOM 0 HA ALA A 116 14.707 9.498 5.793 1.00 55.41 H new ATOM 0 HB1 ALA A 116 15.171 11.816 6.448 1.00 4.22 H new ATOM 0 HB2 ALA A 116 13.984 11.739 5.125 1.00 4.22 H new ATOM 0 HB3 ALA A 116 13.443 12.072 6.787 1.00 4.22 H new ATOM 1679 N GLY A 117 13.608 8.572 8.378 1.00 73.33 N ATOM 1680 CA GLY A 117 13.517 8.161 9.766 1.00 12.01 C ATOM 1681 C GLY A 117 12.549 9.019 10.586 1.00 24.31 C ATOM 1682 O GLY A 117 11.947 8.557 11.562 1.00 51.45 O ATOM 0 H GLY A 117 13.087 7.946 7.764 1.00 73.33 H new ATOM 0 HA2 GLY A 117 13.197 7.120 9.810 1.00 12.01 H new ATOM 0 HA3 GLY A 117 14.508 8.209 10.218 1.00 12.01 H new ATOM 1686 N THR A 118 12.384 10.279 10.206 1.00 54.11 N ATOM 1687 CA THR A 118 11.647 11.278 10.954 1.00 41.15 C ATOM 1688 C THR A 118 10.155 11.096 10.711 1.00 41.33 C ATOM 1689 O THR A 118 9.734 10.506 9.712 1.00 54.42 O ATOM 1690 CB THR A 118 12.140 12.663 10.492 1.00 20.51 C ATOM 1691 OG1 THR A 118 12.220 12.706 9.080 1.00 63.23 O ATOM 1692 CG2 THR A 118 13.537 12.919 11.064 1.00 51.23 C ATOM 0 H THR A 118 12.775 10.642 9.337 1.00 54.11 H new ATOM 0 HA THR A 118 11.814 11.179 12.027 1.00 41.15 H new ATOM 0 HB THR A 118 11.439 13.420 10.843 1.00 20.51 H new ATOM 0 HG1 THR A 118 12.532 13.591 8.797 1.00 63.23 H new ATOM 0 HG21 THR A 118 13.889 13.898 10.739 1.00 51.23 H new ATOM 0 HG22 THR A 118 13.495 12.891 12.153 1.00 51.23 H new ATOM 0 HG23 THR A 118 14.223 12.150 10.708 1.00 51.23 H new ATOM 1700 N ASN A 119 9.327 11.649 11.605 1.00 33.22 N ATOM 1701 CA ASN A 119 7.886 11.822 11.407 1.00 22.12 C ATOM 1702 C ASN A 119 7.182 10.481 11.223 1.00 11.21 C ATOM 1703 O ASN A 119 6.080 10.426 10.688 1.00 64.23 O ATOM 1704 CB ASN A 119 7.603 12.782 10.232 1.00 55.14 C ATOM 1705 CG ASN A 119 8.437 14.049 10.305 1.00 53.34 C ATOM 1706 OD1 ASN A 119 8.473 14.707 11.336 1.00 51.05 O ATOM 1707 ND2 ASN A 119 9.164 14.375 9.251 1.00 14.44 N ATOM 0 H ASN A 119 9.650 11.997 12.508 1.00 33.22 H new ATOM 0 HA ASN A 119 7.476 12.275 12.310 1.00 22.12 H new ATOM 0 HB2 ASN A 119 7.806 12.270 9.291 1.00 55.14 H new ATOM 0 HB3 ASN A 119 6.546 13.046 10.229 1.00 55.14 H new ATOM 0 HD21 ASN A 119 9.774 15.192 9.285 1.00 14.44 H new ATOM 0 HD22 ASN A 119 9.116 13.810 8.403 1.00 14.44 H new ATOM 1713 N HIS A 120 7.837 9.385 11.605 1.00 32.41 N ATOM 1714 CA HIS A 120 7.398 8.018 11.394 1.00 75.54 C ATOM 1715 C HIS A 120 5.989 7.823 11.953 1.00 4.44 C ATOM 1716 O HIS A 120 5.073 7.438 11.230 1.00 22.12 O ATOM 1717 CB HIS A 120 8.448 7.056 11.985 1.00 2.32 C ATOM 1718 CG HIS A 120 8.824 7.335 13.425 1.00 22.11 C ATOM 1719 ND1 HIS A 120 9.652 8.327 13.885 1.00 74.51 N flip ATOM 1720 CD2 HIS A 120 8.354 6.650 14.520 1.00 72.55 C flip ATOM 1721 CE1 HIS A 120 9.658 8.274 15.282 1.00 34.34 C flip ATOM 1722 NE2 HIS A 120 8.876 7.228 15.614 1.00 11.43 N flip ATOM 0 H HIS A 120 8.731 9.436 12.093 1.00 32.41 H new ATOM 0 HA HIS A 120 7.325 7.792 10.330 1.00 75.54 H new ATOM 0 HB2 HIS A 120 8.067 6.037 11.914 1.00 2.32 H new ATOM 0 HB3 HIS A 120 9.349 7.103 11.373 1.00 2.32 H new ATOM 0 HD2 HIS A 120 7.686 5.801 14.504 1.00 72.55 H new ATOM 0 HE1 HIS A 120 10.182 8.935 15.956 1.00 34.34 H new ATOM 0 HE2 HIS A 120 8.703 6.916 16.570 1.00 11.43 H new ATOM 1729 N LYS A 121 5.777 8.166 13.225 1.00 62.32 N ATOM 1730 CA LYS A 121 4.504 7.973 13.881 1.00 33.42 C ATOM 1731 C LYS A 121 3.435 8.934 13.341 1.00 60.22 C ATOM 1732 O LYS A 121 2.258 8.576 13.340 1.00 20.11 O ATOM 1733 CB LYS A 121 4.740 8.167 15.380 1.00 4.33 C ATOM 1734 CG LYS A 121 5.010 6.857 16.136 1.00 52.34 C ATOM 1735 CD LYS A 121 4.624 7.010 17.607 1.00 71.14 C ATOM 1736 CE LYS A 121 4.840 5.730 18.426 1.00 60.41 C ATOM 1737 NZ LYS A 121 6.255 5.556 18.812 1.00 61.05 N ATOM 0 H LYS A 121 6.491 8.585 13.821 1.00 62.32 H new ATOM 0 HA LYS A 121 4.121 6.972 13.684 1.00 33.42 H new ATOM 0 HB2 LYS A 121 5.586 8.839 15.522 1.00 4.33 H new ATOM 0 HB3 LYS A 121 3.868 8.655 15.816 1.00 4.33 H new ATOM 0 HG2 LYS A 121 4.441 6.044 15.685 1.00 52.34 H new ATOM 0 HG3 LYS A 121 6.064 6.592 16.054 1.00 52.34 H new ATOM 0 HD2 LYS A 121 5.209 7.818 18.047 1.00 71.14 H new ATOM 0 HD3 LYS A 121 3.576 7.303 17.672 1.00 71.14 H new ATOM 0 HE2 LYS A 121 4.221 5.764 19.322 1.00 60.41 H new ATOM 0 HE3 LYS A 121 4.513 4.868 17.845 1.00 60.41 H new ATOM 0 HZ1 LYS A 121 6.359 4.680 19.364 1.00 61.05 H new ATOM 0 HZ2 LYS A 121 6.844 5.498 17.957 1.00 61.05 H new ATOM 0 HZ3 LYS A 121 6.560 6.366 19.388 1.00 61.05 H new ATOM 1747 N ALA A 122 3.828 10.120 12.864 1.00 62.43 N ATOM 1748 CA ALA A 122 2.916 11.079 12.254 1.00 55.02 C ATOM 1749 C ALA A 122 2.399 10.526 10.925 1.00 3.01 C ATOM 1750 O ALA A 122 1.188 10.485 10.735 1.00 62.24 O ATOM 1751 CB ALA A 122 3.600 12.441 12.078 1.00 2.14 C ATOM 0 H ALA A 122 4.796 10.439 12.893 1.00 62.43 H new ATOM 0 HA ALA A 122 2.061 11.233 12.912 1.00 55.02 H new ATOM 0 HB1 ALA A 122 2.902 13.142 11.621 1.00 2.14 H new ATOM 0 HB2 ALA A 122 3.911 12.821 13.051 1.00 2.14 H new ATOM 0 HB3 ALA A 122 4.474 12.329 11.436 1.00 2.14 H new ATOM 1757 N TYR A 123 3.288 10.055 10.038 1.00 13.02 N ATOM 1758 CA TYR A 123 2.928 9.426 8.765 1.00 34.12 C ATOM 1759 C TYR A 123 1.789 8.399 8.973 1.00 61.55 C ATOM 1760 O TYR A 123 0.732 8.533 8.355 1.00 24.41 O ATOM 1761 CB TYR A 123 4.162 8.830 8.071 1.00 62.54 C ATOM 1762 CG TYR A 123 3.730 7.836 7.016 1.00 62.21 C ATOM 1763 CD1 TYR A 123 3.283 8.283 5.757 1.00 24.40 C ATOM 1764 CD2 TYR A 123 3.623 6.478 7.361 1.00 35.21 C ATOM 1765 CE1 TYR A 123 2.644 7.381 4.884 1.00 73.54 C ATOM 1766 CE2 TYR A 123 3.074 5.565 6.457 1.00 15.24 C ATOM 1767 CZ TYR A 123 2.547 6.017 5.236 1.00 44.21 C ATOM 1768 OH TYR A 123 1.921 5.116 4.437 1.00 35.12 O ATOM 0 H TYR A 123 4.295 10.103 10.191 1.00 13.02 H new ATOM 0 HA TYR A 123 2.544 10.189 8.088 1.00 34.12 H new ATOM 0 HB2 TYR A 123 4.752 9.624 7.614 1.00 62.54 H new ATOM 0 HB3 TYR A 123 4.801 8.340 8.805 1.00 62.54 H new ATOM 0 HD1 TYR A 123 3.429 9.312 5.463 1.00 24.40 H new ATOM 0 HD2 TYR A 123 3.966 6.139 8.327 1.00 35.21 H new ATOM 0 HE1 TYR A 123 2.230 7.731 3.950 1.00 73.54 H new ATOM 0 HE2 TYR A 123 3.055 4.512 6.697 1.00 15.24 H new ATOM 0 HH TYR A 123 1.960 4.229 4.851 1.00 35.12 H new ATOM 1777 N VAL A 124 1.990 7.430 9.878 1.00 55.34 N ATOM 1778 CA VAL A 124 1.040 6.377 10.266 1.00 15.03 C ATOM 1779 C VAL A 124 -0.340 6.990 10.571 1.00 64.41 C ATOM 1780 O VAL A 124 -1.340 6.586 9.973 1.00 24.20 O ATOM 1781 CB VAL A 124 1.625 5.640 11.492 1.00 42.25 C ATOM 1782 CG1 VAL A 124 0.601 4.718 12.164 1.00 14.14 C ATOM 1783 CG2 VAL A 124 2.888 4.864 11.106 1.00 74.24 C ATOM 0 H VAL A 124 2.870 7.356 10.388 1.00 55.34 H new ATOM 0 HA VAL A 124 0.896 5.665 9.453 1.00 15.03 H new ATOM 0 HB VAL A 124 1.893 6.402 12.224 1.00 42.25 H new ATOM 0 HG11 VAL A 124 1.062 4.224 13.019 1.00 14.14 H new ATOM 0 HG12 VAL A 124 -0.252 5.306 12.501 1.00 14.14 H new ATOM 0 HG13 VAL A 124 0.264 3.967 11.450 1.00 14.14 H new ATOM 0 HG21 VAL A 124 3.283 4.353 11.984 1.00 74.24 H new ATOM 0 HG22 VAL A 124 2.644 4.130 10.338 1.00 74.24 H new ATOM 0 HG23 VAL A 124 3.637 5.556 10.721 1.00 74.24 H new ATOM 1793 N SER A 125 -0.418 7.936 11.513 1.00 52.32 N ATOM 1794 CA SER A 125 -1.683 8.517 11.945 1.00 13.24 C ATOM 1795 C SER A 125 -2.375 9.271 10.812 1.00 3.42 C ATOM 1796 O SER A 125 -3.582 9.122 10.622 1.00 40.01 O ATOM 1797 CB SER A 125 -1.421 9.468 13.118 1.00 43.14 C ATOM 1798 OG SER A 125 -0.964 8.743 14.238 1.00 34.12 O ATOM 0 H SER A 125 0.397 8.317 11.994 1.00 52.32 H new ATOM 0 HA SER A 125 -2.345 7.708 12.254 1.00 13.24 H new ATOM 0 HB2 SER A 125 -0.681 10.215 12.832 1.00 43.14 H new ATOM 0 HB3 SER A 125 -2.335 10.006 13.371 1.00 43.14 H new ATOM 0 HG SER A 125 -0.798 9.360 14.981 1.00 34.12 H new ATOM 1803 N HIS A 126 -1.630 10.097 10.077 1.00 42.01 N ATOM 1804 CA HIS A 126 -2.193 10.943 9.032 1.00 22.32 C ATOM 1805 C HIS A 126 -2.723 10.070 7.888 1.00 55.22 C ATOM 1806 O HIS A 126 -3.781 10.363 7.337 1.00 63.21 O ATOM 1807 CB HIS A 126 -1.131 11.955 8.569 1.00 34.31 C ATOM 1808 CG HIS A 126 -0.872 13.088 9.542 1.00 1.23 C ATOM 1809 ND1 HIS A 126 -0.874 14.436 9.246 1.00 23.52 N ATOM 1810 CD2 HIS A 126 -0.531 12.969 10.861 1.00 20.34 C ATOM 1811 CE1 HIS A 126 -0.484 15.106 10.347 1.00 13.21 C ATOM 1812 NE2 HIS A 126 -0.281 14.249 11.360 1.00 51.34 N ATOM 0 H HIS A 126 -0.621 10.196 10.191 1.00 42.01 H new ATOM 0 HA HIS A 126 -3.040 11.513 9.414 1.00 22.32 H new ATOM 0 HB2 HIS A 126 -0.195 11.425 8.392 1.00 34.31 H new ATOM 0 HB3 HIS A 126 -1.443 12.378 7.614 1.00 34.31 H new ATOM 0 HD1 HIS A 126 -1.127 14.852 8.350 1.00 23.52 H new ATOM 0 HD2 HIS A 126 -0.466 12.047 11.419 1.00 20.34 H new ATOM 0 HE1 HIS A 126 -0.354 16.176 10.406 1.00 13.21 H new ATOM 1819 N PHE A 127 -2.038 8.965 7.566 1.00 62.52 N ATOM 1820 CA PHE A 127 -2.563 7.964 6.647 1.00 60.44 C ATOM 1821 C PHE A 127 -3.877 7.390 7.168 1.00 53.11 C ATOM 1822 O PHE A 127 -4.828 7.342 6.405 1.00 52.42 O ATOM 1823 CB PHE A 127 -1.541 6.843 6.408 1.00 4.22 C ATOM 1824 CG PHE A 127 -2.146 5.581 5.810 1.00 73.31 C ATOM 1825 CD1 PHE A 127 -2.315 5.453 4.418 1.00 31.33 C ATOM 1826 CD2 PHE A 127 -2.585 4.543 6.659 1.00 43.34 C ATOM 1827 CE1 PHE A 127 -2.899 4.290 3.880 1.00 20.21 C ATOM 1828 CE2 PHE A 127 -3.196 3.399 6.123 1.00 33.33 C ATOM 1829 CZ PHE A 127 -3.353 3.271 4.734 1.00 32.52 C ATOM 0 H PHE A 127 -1.113 8.747 7.935 1.00 62.52 H new ATOM 0 HA PHE A 127 -2.755 8.454 5.692 1.00 60.44 H new ATOM 0 HB2 PHE A 127 -0.760 7.211 5.743 1.00 4.22 H new ATOM 0 HB3 PHE A 127 -1.062 6.592 7.354 1.00 4.22 H new ATOM 0 HD1 PHE A 127 -1.996 6.249 3.761 1.00 31.33 H new ATOM 0 HD2 PHE A 127 -2.450 4.629 7.727 1.00 43.34 H new ATOM 0 HE1 PHE A 127 -2.998 4.181 2.810 1.00 20.21 H new ATOM 0 HE2 PHE A 127 -3.546 2.616 6.780 1.00 33.33 H new ATOM 0 HZ PHE A 127 -3.822 2.390 4.322 1.00 32.52 H new ATOM 1838 N ASN A 128 -3.935 6.927 8.424 1.00 61.24 N ATOM 1839 CA ASN A 128 -5.088 6.167 8.927 1.00 13.41 C ATOM 1840 C ASN A 128 -6.389 6.970 8.864 1.00 52.34 C ATOM 1841 O ASN A 128 -7.469 6.381 8.846 1.00 14.32 O ATOM 1842 CB ASN A 128 -4.848 5.686 10.367 1.00 3.24 C ATOM 1843 CG ASN A 128 -4.204 4.311 10.410 1.00 52.12 C ATOM 1844 OD1 ASN A 128 -4.891 3.298 10.432 1.00 51.34 O ATOM 1845 ND2 ASN A 128 -2.886 4.238 10.417 1.00 60.13 N ATOM 0 H ASN A 128 -3.195 7.066 9.112 1.00 61.24 H new ATOM 0 HA ASN A 128 -5.195 5.303 8.271 1.00 13.41 H new ATOM 0 HB2 ASN A 128 -4.210 6.401 10.886 1.00 3.24 H new ATOM 0 HB3 ASN A 128 -5.797 5.658 10.902 1.00 3.24 H new ATOM 0 HD21 ASN A 128 -2.426 3.328 10.441 1.00 60.13 H new ATOM 0 HD22 ASN A 128 -2.328 5.092 10.398 1.00 60.13 H new ATOM 1851 N GLU A 129 -6.283 8.296 8.850 1.00 32.33 N ATOM 1852 CA GLU A 129 -7.339 9.249 8.580 1.00 23.11 C ATOM 1853 C GLU A 129 -7.729 9.212 7.096 1.00 0.41 C ATOM 1854 O GLU A 129 -8.819 8.756 6.746 1.00 12.43 O ATOM 1855 CB GLU A 129 -6.805 10.626 9.036 1.00 15.22 C ATOM 1856 CG GLU A 129 -7.648 11.238 10.150 1.00 14.22 C ATOM 1857 CD GLU A 129 -8.513 12.357 9.586 1.00 42.43 C ATOM 1858 OE1 GLU A 129 -9.518 12.037 8.914 1.00 33.52 O ATOM 1859 OE2 GLU A 129 -8.151 13.542 9.797 1.00 64.14 O ATOM 0 H GLU A 129 -5.394 8.758 9.041 1.00 32.33 H new ATOM 0 HA GLU A 129 -8.256 9.016 9.122 1.00 23.11 H new ATOM 0 HB2 GLU A 129 -5.777 10.518 9.380 1.00 15.22 H new ATOM 0 HB3 GLU A 129 -6.786 11.305 8.184 1.00 15.22 H new ATOM 0 HG2 GLU A 129 -8.278 10.473 10.604 1.00 14.22 H new ATOM 0 HG3 GLU A 129 -7.001 11.627 10.936 1.00 14.22 H new ATOM 1864 N TRP A 130 -6.828 9.650 6.210 1.00 1.24 N ATOM 1865 CA TRP A 130 -7.016 9.770 4.757 1.00 32.54 C ATOM 1866 C TRP A 130 -6.959 8.407 4.053 1.00 31.41 C ATOM 1867 O TRP A 130 -6.619 8.349 2.871 1.00 75.42 O ATOM 1868 CB TRP A 130 -5.943 10.720 4.200 1.00 51.42 C ATOM 1869 CG TRP A 130 -5.649 11.961 5.006 1.00 51.42 C ATOM 1870 CD1 TRP A 130 -6.537 12.666 5.747 1.00 31.53 C ATOM 1871 CD2 TRP A 130 -4.363 12.621 5.213 1.00 11.02 C ATOM 1872 NE1 TRP A 130 -5.881 13.654 6.455 1.00 35.42 N ATOM 1873 CE2 TRP A 130 -4.529 13.650 6.185 1.00 2.03 C ATOM 1874 CE3 TRP A 130 -3.066 12.444 4.687 1.00 34.11 C ATOM 1875 CZ2 TRP A 130 -3.449 14.417 6.649 1.00 31.31 C ATOM 1876 CZ3 TRP A 130 -1.999 13.282 5.062 1.00 60.53 C ATOM 1877 CH2 TRP A 130 -2.188 14.260 6.051 1.00 0.21 C ATOM 0 H TRP A 130 -5.897 9.947 6.502 1.00 1.24 H new ATOM 0 HA TRP A 130 -8.009 10.175 4.564 1.00 32.54 H new ATOM 0 HB2 TRP A 130 -5.015 10.158 4.091 1.00 51.42 H new ATOM 0 HB3 TRP A 130 -6.248 11.029 3.200 1.00 51.42 H new ATOM 0 HD1 TRP A 130 -7.601 12.483 5.779 1.00 31.53 H new ATOM 0 HE1 TRP A 130 -6.338 14.303 7.095 1.00 35.42 H new ATOM 0 HE3 TRP A 130 -2.888 11.647 3.980 1.00 34.11 H new ATOM 0 HZ2 TRP A 130 -3.586 15.120 7.457 1.00 31.31 H new ATOM 0 HZ3 TRP A 130 -1.034 13.172 4.589 1.00 60.53 H new ATOM 0 HH2 TRP A 130 -1.365 14.891 6.352 1.00 0.21 H new ATOM 1887 N ALA A 131 -7.201 7.323 4.789 1.00 22.12 N ATOM 1888 CA ALA A 131 -7.299 5.947 4.356 1.00 72.13 C ATOM 1889 C ALA A 131 -7.922 5.132 5.480 1.00 11.31 C ATOM 1890 O ALA A 131 -7.445 4.048 5.836 1.00 55.21 O ATOM 1891 CB ALA A 131 -5.929 5.384 3.964 1.00 43.33 C ATOM 0 H ALA A 131 -7.345 7.404 5.796 1.00 22.12 H new ATOM 0 HA ALA A 131 -7.927 5.892 3.467 1.00 72.13 H new ATOM 0 HB1 ALA A 131 -6.039 4.348 3.644 1.00 43.33 H new ATOM 0 HB2 ALA A 131 -5.513 5.974 3.147 1.00 43.33 H new ATOM 0 HB3 ALA A 131 -5.258 5.429 4.822 1.00 43.33 H new ATOM 1897 N ASP A 132 -8.989 5.654 6.079 1.00 41.45 N ATOM 1898 CA ASP A 132 -9.818 4.826 6.923 1.00 54.52 C ATOM 1899 C ASP A 132 -10.677 3.929 6.032 1.00 44.51 C ATOM 1900 O ASP A 132 -11.013 4.278 4.893 1.00 3.20 O ATOM 1901 CB ASP A 132 -10.670 5.666 7.889 1.00 12.31 C ATOM 1902 CG ASP A 132 -10.982 4.896 9.178 1.00 1.42 C ATOM 1903 OD1 ASP A 132 -10.694 3.679 9.245 1.00 4.54 O ATOM 1904 OD2 ASP A 132 -11.371 5.540 10.178 1.00 34.34 O ATOM 0 H ASP A 132 -9.288 6.625 5.994 1.00 41.45 H new ATOM 0 HA ASP A 132 -9.184 4.203 7.554 1.00 54.52 H new ATOM 0 HB2 ASP A 132 -10.142 6.588 8.133 1.00 12.31 H new ATOM 0 HB3 ASP A 132 -11.601 5.952 7.400 1.00 12.31 H new ATOM 1908 N GLY A 133 -11.054 2.780 6.568 1.00 32.34 N ATOM 1909 CA GLY A 133 -12.129 1.945 6.056 1.00 72.05 C ATOM 1910 C GLY A 133 -11.733 0.517 5.689 1.00 55.23 C ATOM 1911 O GLY A 133 -12.578 -0.174 5.122 1.00 13.52 O ATOM 0 H GLY A 133 -10.606 2.390 7.398 1.00 32.34 H new ATOM 0 HA2 GLY A 133 -12.921 1.903 6.804 1.00 72.05 H new ATOM 0 HA3 GLY A 133 -12.550 2.425 5.173 1.00 72.05 H new ATOM 1915 N LEU A 134 -10.514 0.044 5.979 1.00 63.04 N ATOM 1916 CA LEU A 134 -10.172 -1.374 5.859 1.00 1.52 C ATOM 1917 C LEU A 134 -9.434 -1.871 7.090 1.00 14.14 C ATOM 1918 O LEU A 134 -8.841 -1.098 7.847 1.00 54.13 O ATOM 1919 CB LEU A 134 -9.278 -1.629 4.637 1.00 21.02 C ATOM 1920 CG LEU A 134 -10.014 -1.457 3.299 1.00 63.41 C ATOM 1921 CD1 LEU A 134 -8.973 -1.398 2.189 1.00 40.54 C ATOM 1922 CD2 LEU A 134 -11.004 -2.589 3.031 1.00 63.15 C ATOM 0 H LEU A 134 -9.744 0.631 6.301 1.00 63.04 H new ATOM 0 HA LEU A 134 -11.114 -1.911 5.750 1.00 1.52 H new ATOM 0 HB2 LEU A 134 -8.429 -0.946 4.667 1.00 21.02 H new ATOM 0 HB3 LEU A 134 -8.875 -2.640 4.695 1.00 21.02 H new ATOM 0 HG LEU A 134 -10.596 -0.536 3.337 1.00 63.41 H new ATOM 0 HD11 LEU A 134 -9.472 -1.276 1.228 1.00 40.54 H new ATOM 0 HD12 LEU A 134 -8.305 -0.554 2.361 1.00 40.54 H new ATOM 0 HD13 LEU A 134 -8.395 -2.322 2.183 1.00 40.54 H new ATOM 0 HD21 LEU A 134 -11.498 -2.421 2.074 1.00 63.15 H new ATOM 0 HD22 LEU A 134 -10.471 -3.539 3.003 1.00 63.15 H new ATOM 0 HD23 LEU A 134 -11.750 -2.615 3.825 1.00 63.15 H new ATOM 1933 N ASN A 135 -9.431 -3.191 7.231 1.00 15.33 N ATOM 1934 CA ASN A 135 -8.532 -3.982 8.050 1.00 71.34 C ATOM 1935 C ASN A 135 -7.086 -3.799 7.587 1.00 21.31 C ATOM 1936 O ASN A 135 -6.633 -4.439 6.633 1.00 0.30 O ATOM 1937 CB ASN A 135 -8.941 -5.465 8.032 1.00 73.04 C ATOM 1938 CG ASN A 135 -9.454 -6.053 6.720 1.00 31.31 C ATOM 1939 OD1 ASN A 135 -10.498 -6.701 6.691 1.00 2.24 O ATOM 1940 ND2 ASN A 135 -8.743 -5.866 5.625 1.00 35.01 N ATOM 0 H ASN A 135 -10.107 -3.775 6.739 1.00 15.33 H new ATOM 0 HA ASN A 135 -8.602 -3.632 9.080 1.00 71.34 H new ATOM 0 HB2 ASN A 135 -8.078 -6.053 8.346 1.00 73.04 H new ATOM 0 HB3 ASN A 135 -9.715 -5.607 8.786 1.00 73.04 H new ATOM 0 HD21 ASN A 135 -9.058 -6.261 4.739 1.00 35.01 H new ATOM 0 HD22 ASN A 135 -7.879 -5.326 5.664 1.00 35.01 H new ATOM 1946 N VAL A 136 -6.352 -2.923 8.268 1.00 3.52 N ATOM 1947 CA VAL A 136 -4.915 -2.793 8.088 1.00 11.50 C ATOM 1948 C VAL A 136 -4.244 -3.482 9.280 1.00 34.03 C ATOM 1949 O VAL A 136 -4.582 -3.216 10.436 1.00 52.21 O ATOM 1950 CB VAL A 136 -4.512 -1.329 7.827 1.00 22.43 C ATOM 1951 CG1 VAL A 136 -4.727 -0.469 9.063 1.00 4.54 C ATOM 1952 CG2 VAL A 136 -3.068 -1.164 7.335 1.00 63.43 C ATOM 0 H VAL A 136 -6.741 -2.283 8.961 1.00 3.52 H new ATOM 0 HA VAL A 136 -4.561 -3.297 7.189 1.00 11.50 H new ATOM 0 HB VAL A 136 -5.166 -0.992 7.023 1.00 22.43 H new ATOM 0 HG11 VAL A 136 -4.434 0.558 8.847 1.00 4.54 H new ATOM 0 HG12 VAL A 136 -5.780 -0.494 9.345 1.00 4.54 H new ATOM 0 HG13 VAL A 136 -4.122 -0.854 9.884 1.00 4.54 H new ATOM 0 HG21 VAL A 136 -2.857 -0.107 7.173 1.00 63.43 H new ATOM 0 HG22 VAL A 136 -2.381 -1.560 8.083 1.00 63.43 H new ATOM 0 HG23 VAL A 136 -2.938 -1.707 6.399 1.00 63.43 H new ATOM 1962 N ILE A 137 -3.313 -4.386 9.000 1.00 61.05 N ATOM 1963 CA ILE A 137 -2.646 -5.269 9.943 1.00 44.43 C ATOM 1964 C ILE A 137 -1.289 -4.719 10.394 1.00 2.34 C ATOM 1965 O ILE A 137 -0.589 -5.355 11.189 1.00 20.31 O ATOM 1966 CB ILE A 137 -2.546 -6.679 9.325 1.00 40.23 C ATOM 1967 CG1 ILE A 137 -1.773 -6.676 7.985 1.00 22.04 C ATOM 1968 CG2 ILE A 137 -3.975 -7.220 9.136 1.00 14.10 C ATOM 1969 CD1 ILE A 137 -1.049 -7.967 7.634 1.00 72.01 C ATOM 0 H ILE A 137 -2.984 -4.529 8.045 1.00 61.05 H new ATOM 0 HA ILE A 137 -3.240 -5.332 10.855 1.00 44.43 H new ATOM 0 HB ILE A 137 -1.982 -7.325 9.998 1.00 40.23 H new ATOM 0 HG12 ILE A 137 -2.475 -6.446 7.183 1.00 22.04 H new ATOM 0 HG13 ILE A 137 -1.042 -5.868 8.011 1.00 22.04 H new ATOM 0 HG21 ILE A 137 -3.932 -8.218 8.700 1.00 14.10 H new ATOM 0 HG22 ILE A 137 -4.477 -7.268 10.103 1.00 14.10 H new ATOM 0 HG23 ILE A 137 -4.530 -6.557 8.472 1.00 14.10 H new ATOM 0 HD11 ILE A 137 -0.542 -7.851 6.676 1.00 72.01 H new ATOM 0 HD12 ILE A 137 -0.315 -8.195 8.407 1.00 72.01 H new ATOM 0 HD13 ILE A 137 -1.770 -8.782 7.567 1.00 72.01 H new ATOM 1980 N GLY A 138 -0.907 -3.529 9.941 1.00 15.51 N ATOM 1981 CA GLY A 138 0.248 -2.830 10.466 1.00 3.10 C ATOM 1982 C GLY A 138 0.655 -1.704 9.540 1.00 72.31 C ATOM 1983 O GLY A 138 0.257 -1.665 8.370 1.00 2.41 O ATOM 0 H GLY A 138 -1.394 -3.027 9.199 1.00 15.51 H new ATOM 0 HA2 GLY A 138 0.020 -2.431 11.454 1.00 3.10 H new ATOM 0 HA3 GLY A 138 1.078 -3.527 10.587 1.00 3.10 H new ATOM 1987 N VAL A 139 1.509 -0.829 10.056 1.00 64.14 N ATOM 1988 CA VAL A 139 2.322 0.056 9.262 1.00 40.44 C ATOM 1989 C VAL A 139 3.717 0.171 9.854 1.00 2.42 C ATOM 1990 O VAL A 139 3.905 0.405 11.055 1.00 62.14 O ATOM 1991 CB VAL A 139 1.601 1.382 8.959 1.00 73.02 C ATOM 1992 CG1 VAL A 139 0.865 2.016 10.110 1.00 11.33 C ATOM 1993 CG2 VAL A 139 2.559 2.407 8.331 1.00 11.14 C ATOM 0 H VAL A 139 1.652 -0.720 11.060 1.00 64.14 H new ATOM 0 HA VAL A 139 2.475 -0.373 8.272 1.00 40.44 H new ATOM 0 HB VAL A 139 0.827 1.091 8.249 1.00 73.02 H new ATOM 0 HG11 VAL A 139 0.398 2.943 9.777 1.00 11.33 H new ATOM 0 HG12 VAL A 139 0.097 1.332 10.472 1.00 11.33 H new ATOM 0 HG13 VAL A 139 1.567 2.233 10.915 1.00 11.33 H new ATOM 0 HG21 VAL A 139 2.020 3.333 8.129 1.00 11.14 H new ATOM 0 HG22 VAL A 139 3.379 2.608 9.020 1.00 11.14 H new ATOM 0 HG23 VAL A 139 2.958 2.008 7.398 1.00 11.14 H new ATOM 2003 N ALA A 140 4.711 0.003 8.988 1.00 32.24 N ATOM 2004 CA ALA A 140 6.106 0.175 9.322 1.00 12.43 C ATOM 2005 C ALA A 140 6.882 0.662 8.127 1.00 73.22 C ATOM 2006 O ALA A 140 6.457 0.500 6.985 1.00 43.13 O ATOM 2007 CB ALA A 140 6.706 -1.128 9.847 1.00 54.25 C ATOM 0 H ALA A 140 4.558 -0.262 8.015 1.00 32.24 H new ATOM 0 HA ALA A 140 6.172 0.925 10.110 1.00 12.43 H new ATOM 0 HB1 ALA A 140 7.757 -0.972 10.091 1.00 54.25 H new ATOM 0 HB2 ALA A 140 6.168 -1.442 10.742 1.00 54.25 H new ATOM 0 HB3 ALA A 140 6.622 -1.901 9.083 1.00 54.25 H new ATOM 2013 N ARG A 141 8.018 1.293 8.406 1.00 2.42 N ATOM 2014 CA ARG A 141 8.932 1.672 7.355 1.00 64.12 C ATOM 2015 C ARG A 141 9.773 0.452 6.994 1.00 12.30 C ATOM 2016 O ARG A 141 9.930 -0.458 7.820 1.00 33.31 O ATOM 2017 CB ARG A 141 9.789 2.854 7.830 1.00 3.33 C ATOM 2018 CG ARG A 141 10.825 2.382 8.856 1.00 61.31 C ATOM 2019 CD ARG A 141 11.378 3.478 9.764 1.00 51.33 C ATOM 2020 NE ARG A 141 12.463 4.224 9.116 1.00 4.03 N ATOM 2021 CZ ARG A 141 13.678 3.757 8.798 1.00 32.52 C ATOM 2022 NH1 ARG A 141 14.073 2.549 9.195 1.00 71.10 N ATOM 2023 NH2 ARG A 141 14.497 4.508 8.077 1.00 63.22 N ATOM 0 H ARG A 141 8.319 1.548 9.347 1.00 2.42 H new ATOM 0 HA ARG A 141 8.400 1.999 6.461 1.00 64.12 H new ATOM 0 HB2 ARG A 141 10.293 3.312 6.979 1.00 3.33 H new ATOM 0 HB3 ARG A 141 9.152 3.619 8.273 1.00 3.33 H new ATOM 0 HG2 ARG A 141 10.373 1.609 9.478 1.00 61.31 H new ATOM 0 HG3 ARG A 141 11.656 1.918 8.324 1.00 61.31 H new ATOM 0 HD2 ARG A 141 10.576 4.164 10.036 1.00 51.33 H new ATOM 0 HD3 ARG A 141 11.744 3.033 10.689 1.00 51.33 H new ATOM 0 HE ARG A 141 12.273 5.199 8.884 1.00 4.03 H new ATOM 0 HH11 ARG A 141 13.447 1.965 9.750 1.00 71.10 H new ATOM 0 HH12 ARG A 141 15.001 2.208 8.945 1.00 71.10 H new ATOM 0 HH21 ARG A 141 14.201 5.434 7.768 1.00 63.22 H new ATOM 0 HH22 ARG A 141 15.424 4.160 7.830 1.00 63.22 H new ATOM 2034 N ASP A 142 10.417 0.539 5.838 1.00 42.24 N ATOM 2035 CA ASP A 142 11.438 -0.393 5.375 1.00 51.14 C ATOM 2036 C ASP A 142 10.899 -1.843 5.414 1.00 60.22 C ATOM 2037 O ASP A 142 9.690 -2.078 5.343 1.00 60.04 O ATOM 2038 CB ASP A 142 12.771 -0.122 6.116 1.00 44.02 C ATOM 2039 CG ASP A 142 13.413 1.234 5.748 1.00 35.55 C ATOM 2040 OD1 ASP A 142 12.788 2.298 5.963 1.00 41.05 O ATOM 2041 OD2 ASP A 142 14.571 1.247 5.269 1.00 52.21 O ATOM 0 H ASP A 142 10.236 1.289 5.171 1.00 42.24 H new ATOM 0 HA ASP A 142 11.679 -0.236 4.324 1.00 51.14 H new ATOM 0 HB2 ASP A 142 12.593 -0.151 7.191 1.00 44.02 H new ATOM 0 HB3 ASP A 142 13.474 -0.923 5.887 1.00 44.02 H new ATOM 2045 N ASP A 143 11.782 -2.836 5.443 1.00 74.13 N ATOM 2046 CA ASP A 143 11.465 -4.272 5.421 1.00 53.13 C ATOM 2047 C ASP A 143 11.019 -4.833 6.785 1.00 63.01 C ATOM 2048 O ASP A 143 10.806 -6.038 6.920 1.00 23.05 O ATOM 2049 CB ASP A 143 12.679 -5.056 4.891 1.00 11.12 C ATOM 2050 CG ASP A 143 13.967 -4.728 5.645 1.00 61.33 C ATOM 2051 OD1 ASP A 143 14.181 -5.181 6.793 1.00 12.52 O ATOM 2052 OD2 ASP A 143 14.793 -3.952 5.105 1.00 2.52 O ATOM 0 H ASP A 143 12.786 -2.660 5.484 1.00 74.13 H new ATOM 0 HA ASP A 143 10.610 -4.395 4.756 1.00 53.13 H new ATOM 0 HB2 ASP A 143 12.479 -6.125 4.970 1.00 11.12 H new ATOM 0 HB3 ASP A 143 12.816 -4.834 3.833 1.00 11.12 H new ATOM 2056 N SER A 144 10.861 -3.992 7.811 1.00 21.42 N ATOM 2057 CA SER A 144 10.870 -4.434 9.204 1.00 15.14 C ATOM 2058 C SER A 144 9.651 -5.270 9.656 1.00 64.41 C ATOM 2059 O SER A 144 9.654 -5.723 10.803 1.00 74.23 O ATOM 2060 CB SER A 144 11.042 -3.207 10.109 1.00 61.33 C ATOM 2061 OG SER A 144 11.431 -3.611 11.414 1.00 23.45 O ATOM 0 H SER A 144 10.724 -2.988 7.697 1.00 21.42 H new ATOM 0 HA SER A 144 11.709 -5.124 9.291 1.00 15.14 H new ATOM 0 HB2 SER A 144 11.793 -2.538 9.688 1.00 61.33 H new ATOM 0 HB3 SER A 144 10.108 -2.647 10.157 1.00 61.33 H new ATOM 0 HG SER A 144 10.960 -4.436 11.655 1.00 23.45 H new ATOM 2066 N GLU A 145 8.608 -5.460 8.846 1.00 41.25 N ATOM 2067 CA GLU A 145 7.398 -6.201 9.231 1.00 55.41 C ATOM 2068 C GLU A 145 6.922 -7.159 8.126 1.00 15.51 C ATOM 2069 O GLU A 145 5.818 -7.697 8.200 1.00 74.04 O ATOM 2070 CB GLU A 145 6.295 -5.221 9.679 1.00 20.02 C ATOM 2071 CG GLU A 145 6.633 -4.556 11.022 1.00 2.14 C ATOM 2072 CD GLU A 145 5.486 -3.787 11.680 1.00 53.24 C ATOM 2073 OE1 GLU A 145 4.315 -3.837 11.241 1.00 22.01 O ATOM 2074 OE2 GLU A 145 5.753 -3.143 12.724 1.00 22.42 O ATOM 0 H GLU A 145 8.576 -5.101 7.892 1.00 41.25 H new ATOM 0 HA GLU A 145 7.646 -6.837 10.080 1.00 55.41 H new ATOM 0 HB2 GLU A 145 6.160 -4.453 8.917 1.00 20.02 H new ATOM 0 HB3 GLU A 145 5.348 -5.754 9.766 1.00 20.02 H new ATOM 0 HG2 GLU A 145 6.976 -5.326 11.713 1.00 2.14 H new ATOM 0 HG3 GLU A 145 7.467 -3.871 10.869 1.00 2.14 H new ATOM 2079 N VAL A 146 7.747 -7.430 7.114 1.00 40.32 N ATOM 2080 CA VAL A 146 7.373 -8.275 5.979 1.00 75.23 C ATOM 2081 C VAL A 146 6.925 -9.674 6.428 1.00 3.33 C ATOM 2082 O VAL A 146 5.919 -10.194 5.938 1.00 42.53 O ATOM 2083 CB VAL A 146 8.556 -8.296 4.986 1.00 52.12 C ATOM 2084 CG1 VAL A 146 8.341 -9.220 3.787 1.00 63.11 C ATOM 2085 CG2 VAL A 146 8.839 -6.892 4.427 1.00 0.51 C ATOM 0 H VAL A 146 8.699 -7.068 7.058 1.00 40.32 H new ATOM 0 HA VAL A 146 6.502 -7.861 5.472 1.00 75.23 H new ATOM 0 HB VAL A 146 9.395 -8.670 5.572 1.00 52.12 H new ATOM 0 HG11 VAL A 146 9.214 -9.180 3.136 1.00 63.11 H new ATOM 0 HG12 VAL A 146 8.195 -10.242 4.137 1.00 63.11 H new ATOM 0 HG13 VAL A 146 7.460 -8.897 3.232 1.00 63.11 H new ATOM 0 HG21 VAL A 146 9.677 -6.939 3.731 1.00 0.51 H new ATOM 0 HG22 VAL A 146 7.955 -6.523 3.906 1.00 0.51 H new ATOM 0 HG23 VAL A 146 9.086 -6.217 5.247 1.00 0.51 H new ATOM 2095 N ASP A 147 7.600 -10.226 7.435 1.00 21.12 N ATOM 2096 CA ASP A 147 7.271 -11.474 8.124 1.00 41.24 C ATOM 2097 C ASP A 147 5.791 -11.556 8.521 1.00 3.21 C ATOM 2098 O ASP A 147 5.139 -12.582 8.308 1.00 61.04 O ATOM 2099 CB ASP A 147 8.188 -11.600 9.352 1.00 75.22 C ATOM 2100 CG ASP A 147 7.560 -12.424 10.473 1.00 4.25 C ATOM 2101 OD1 ASP A 147 7.498 -13.659 10.370 1.00 31.33 O ATOM 2102 OD2 ASP A 147 7.105 -11.822 11.478 1.00 72.33 O ATOM 0 H ASP A 147 8.440 -9.789 7.814 1.00 21.12 H new ATOM 0 HA ASP A 147 7.438 -12.308 7.442 1.00 41.24 H new ATOM 0 HB2 ASP A 147 9.129 -12.060 9.052 1.00 75.22 H new ATOM 0 HB3 ASP A 147 8.425 -10.604 9.727 1.00 75.22 H new ATOM 2106 N LYS A 148 5.233 -10.468 9.056 1.00 43.31 N ATOM 2107 CA LYS A 148 3.863 -10.471 9.581 1.00 33.41 C ATOM 2108 C LYS A 148 2.873 -10.012 8.524 1.00 40.33 C ATOM 2109 O LYS A 148 1.667 -10.184 8.704 1.00 72.04 O ATOM 2110 CB LYS A 148 3.766 -9.674 10.895 1.00 15.14 C ATOM 2111 CG LYS A 148 4.285 -8.234 10.817 1.00 61.01 C ATOM 2112 CD LYS A 148 4.120 -7.447 12.129 1.00 60.24 C ATOM 2113 CE LYS A 148 3.064 -6.343 12.021 1.00 20.41 C ATOM 2114 NZ LYS A 148 1.680 -6.852 12.053 1.00 54.22 N ATOM 0 H LYS A 148 5.710 -9.570 9.138 1.00 43.31 H new ATOM 0 HA LYS A 148 3.590 -11.496 9.831 1.00 33.41 H new ATOM 0 HB2 LYS A 148 2.724 -9.652 11.213 1.00 15.14 H new ATOM 0 HB3 LYS A 148 4.324 -10.204 11.667 1.00 15.14 H new ATOM 0 HG2 LYS A 148 5.340 -8.251 10.544 1.00 61.01 H new ATOM 0 HG3 LYS A 148 3.758 -7.710 10.020 1.00 61.01 H new ATOM 0 HD2 LYS A 148 3.843 -8.134 12.929 1.00 60.24 H new ATOM 0 HD3 LYS A 148 5.077 -7.005 12.406 1.00 60.24 H new ATOM 0 HE2 LYS A 148 3.203 -5.636 12.839 1.00 20.41 H new ATOM 0 HE3 LYS A 148 3.219 -5.791 11.094 1.00 20.41 H new ATOM 0 HZ1 LYS A 148 1.035 -6.127 11.678 1.00 54.22 H new ATOM 0 HZ2 LYS A 148 1.612 -7.711 11.470 1.00 54.22 H new ATOM 0 HZ3 LYS A 148 1.416 -7.077 13.033 1.00 54.22 H new ATOM 2124 N TRP A 149 3.355 -9.489 7.401 1.00 75.22 N ATOM 2125 CA TRP A 149 2.538 -9.087 6.272 1.00 63.34 C ATOM 2126 C TRP A 149 2.610 -10.125 5.142 1.00 0.31 C ATOM 2127 O TRP A 149 2.393 -9.785 3.980 1.00 20.11 O ATOM 2128 CB TRP A 149 2.990 -7.716 5.797 1.00 32.41 C ATOM 2129 CG TRP A 149 2.989 -6.636 6.820 1.00 40.22 C ATOM 2130 CD1 TRP A 149 2.274 -6.605 7.963 1.00 0.20 C ATOM 2131 CD2 TRP A 149 3.730 -5.394 6.777 1.00 60.34 C ATOM 2132 NE1 TRP A 149 2.532 -5.432 8.626 1.00 42.41 N ATOM 2133 CE2 TRP A 149 3.389 -4.616 7.916 1.00 35.34 C ATOM 2134 CE3 TRP A 149 4.633 -4.847 5.852 1.00 4.21 C ATOM 2135 CZ2 TRP A 149 3.882 -3.315 8.095 1.00 52.23 C ATOM 2136 CZ3 TRP A 149 5.148 -3.553 6.025 1.00 64.14 C ATOM 2137 CH2 TRP A 149 4.758 -2.786 7.130 1.00 61.41 C ATOM 0 H TRP A 149 4.352 -9.331 7.252 1.00 75.22 H new ATOM 0 HA TRP A 149 1.495 -9.029 6.582 1.00 63.34 H new ATOM 0 HB2 TRP A 149 3.999 -7.807 5.396 1.00 32.41 H new ATOM 0 HB3 TRP A 149 2.346 -7.409 4.973 1.00 32.41 H new ATOM 0 HD1 TRP A 149 1.604 -7.381 8.303 1.00 0.20 H new ATOM 0 HE1 TRP A 149 2.137 -5.192 9.535 1.00 42.41 H new ATOM 0 HE3 TRP A 149 4.936 -5.430 4.995 1.00 4.21 H new ATOM 0 HZ2 TRP A 149 3.595 -2.731 8.957 1.00 52.23 H new ATOM 0 HZ3 TRP A 149 5.845 -3.149 5.306 1.00 64.14 H new ATOM 0 HH2 TRP A 149 5.133 -1.779 7.242 1.00 61.41 H new ATOM 2147 N SER A 150 3.006 -11.368 5.423 1.00 34.04 N ATOM 2148 CA SER A 150 2.869 -12.496 4.505 1.00 71.12 C ATOM 2149 C SER A 150 2.725 -13.767 5.346 1.00 72.23 C ATOM 2150 O SER A 150 3.493 -14.731 5.238 1.00 21.00 O ATOM 2151 CB SER A 150 4.041 -12.529 3.517 1.00 12.44 C ATOM 2152 OG SER A 150 3.733 -13.386 2.436 1.00 73.11 O ATOM 0 H SER A 150 3.438 -11.621 6.311 1.00 34.04 H new ATOM 0 HA SER A 150 1.978 -12.403 3.883 1.00 71.12 H new ATOM 0 HB2 SER A 150 4.246 -11.524 3.149 1.00 12.44 H new ATOM 0 HB3 SER A 150 4.944 -12.874 4.021 1.00 12.44 H new ATOM 0 HG SER A 150 3.495 -14.273 2.779 1.00 73.11 H new ATOM 2157 N LYS A 151 1.792 -13.721 6.293 1.00 64.05 N ATOM 2158 CA LYS A 151 1.448 -14.850 7.132 1.00 34.00 C ATOM 2159 C LYS A 151 0.660 -15.864 6.308 1.00 13.23 C ATOM 2160 O LYS A 151 0.589 -17.019 6.766 1.00 20.01 O ATOM 2161 CB LYS A 151 0.692 -14.343 8.356 1.00 1.10 C ATOM 2162 CG LYS A 151 1.508 -13.370 9.222 1.00 42.14 C ATOM 2163 CD LYS A 151 2.323 -14.071 10.320 1.00 41.24 C ATOM 2164 CE LYS A 151 1.594 -14.002 11.666 1.00 33.30 C ATOM 2165 NZ LYS A 151 0.521 -15.011 11.795 1.00 51.32 N ATOM 0 H LYS A 151 1.249 -12.882 6.497 1.00 64.05 H new ATOM 0 HA LYS A 151 2.338 -15.364 7.496 1.00 34.00 H new ATOM 0 HB2 LYS A 151 -0.222 -13.847 8.029 1.00 1.10 H new ATOM 0 HB3 LYS A 151 0.391 -15.195 8.966 1.00 1.10 H new ATOM 0 HG2 LYS A 151 2.185 -12.805 8.582 1.00 42.14 H new ATOM 0 HG3 LYS A 151 0.832 -12.651 9.684 1.00 42.14 H new ATOM 0 HD2 LYS A 151 2.491 -15.112 10.045 1.00 41.24 H new ATOM 0 HD3 LYS A 151 3.303 -13.602 10.407 1.00 41.24 H new ATOM 0 HE2 LYS A 151 2.315 -14.142 12.471 1.00 33.30 H new ATOM 0 HE3 LYS A 151 1.166 -13.007 11.791 1.00 33.30 H new ATOM 0 HZ1 LYS A 151 0.065 -14.916 12.725 1.00 51.32 H new ATOM 0 HZ2 LYS A 151 -0.185 -14.864 11.046 1.00 51.32 H new ATOM 0 HZ3 LYS A 151 0.928 -15.964 11.705 1.00 51.32 H new